{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2025,10,31]],"date-time":"2025-10-31T07:22:45Z","timestamp":1761895365259},"reference-count":115,"publisher":"American Chemical Society (ACS)","issue":"21","content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["Organometallics"],"published-print":{"date-parts":[[2011,11,14]]},"DOI":"10.1021\/om200766y","type":"journal-article","created":{"date-parts":[[2011,10,14]],"date-time":"2011-10-14T13:00:00Z","timestamp":1318597200000},"page":"5928-5942","source":"Crossref","is-referenced-by-count":25,"title":["Synthesis, Structure, Ligand Dynamics, and Catalytic Activity of Cationic [Pd(\u03b7<sup>3<\/sup>-allyl)(\u03ba<sup>2<\/sup>(<i>E,N<\/i>)-EN-chelate)]<sup>+<\/sup>(E = P, O, S, Se) Complexes"],"prefix":"10.1021","volume":"30","author":[{"given":"Bernhard","family":"Bichler","sequence":"first","affiliation":[]},{"given":"Luis F.","family":"Veiros","sequence":"additional","affiliation":[{"name":"Centro de Qu\u00edmica Estrutural, Instituto Superior T\u00e9cnico, Universidade T\u00e9cnica de Lisboa, 1049-001 Lisboa, Portugal"}]},{"given":"\u00d6zg\u00fcr","family":"\u00d6ztopcu","sequence":"additional","affiliation":[]},{"given":"Michael","family":"Puchberger","sequence":"additional","affiliation":[]},{"given":"Kurt","family":"Mereiter","sequence":"additional","affiliation":[]},{"given":"Kouki","family":"Matsubara","sequence":"additional","affiliation":[{"name":"Department of Chemistry, Faculty of Science, Fukuoka University, 8-19-1 Nanakuma, Fukuoka 814-0180, Japan"}]},{"given":"Karl A.","family":"Kirchner","sequence":"additional","affiliation":[]}],"member":"316","published-online":{"date-parts":[[2011,10,14]]},"reference":[{"key":"ref1\/cit1a","doi-asserted-by":"crossref","first-page":"27","DOI":"10.1016\/0010-8545(91)80013-4","volume":"108","author":"Bader A.","year":"1991","journal-title":"Coord. Chem. Rev."},{"key":"ref1\/cit1b","doi-asserted-by":"crossref","first-page":"4473","DOI":"10.1002\/ejic.200600212","author":"Bassetti M.","year":"2006","journal-title":"Eur. J. Inorg. Chem."},{"key":"ref1\/cit1c","doi-asserted-by":"crossref","first-page":"336","DOI":"10.1021\/ar9900865","volume":"33","author":"Helmchen G.","year":"2000","journal-title":"Acc. Chem. Res."},{"key":"ref1\/cit1d","doi-asserted-by":"crossref","first-page":"4151","DOI":"10.1021\/cr040642v","volume":"104","author":"McManus H. A.","year":"2004","journal-title":"Chem. Rev."},{"key":"ref1\/cit1e","doi-asserted-by":"crossref","first-page":"134","DOI":"10.1021\/cr050993p","volume":"106","author":"Braunstein P.","year":"2006","journal-title":"Chem. Rev."},{"key":"ref1\/cit1f","doi-asserted-by":"crossref","first-page":"1629","DOI":"10.1021\/cr030026j","volume":"104","author":"Grushin V. V.","year":"2004","journal-title":"Chem. Rev."},{"key":"ref1\/cit1g","doi-asserted-by":"crossref","first-page":"451","DOI":"10.1016\/S0010-8545(98)00147-7","volume":"176","author":"Ly T. Q.","year":"1998","journal-title":"Coord. Chem. Rev."},{"key":"ref2\/cit2","doi-asserted-by":"crossref","first-page":"527","DOI":"10.1135\/cccc20070527","volume":"72","author":"Benito-Garagorri D.","year":"2007","journal-title":"Collect. Czech. Chem. Commun."},{"key":"ref3\/cit3a","doi-asserted-by":"crossref","first-page":"4085","DOI":"10.1002\/ejic.200900535","author":"Standfest-Hauser C. M.","year":"2009","journal-title":"Eur. J. Inorg. Chem."},{"key":"ref3\/cit3b","doi-asserted-by":"crossref","first-page":"3097","DOI":"10.1016\/j.poly.2010.08.014","volume":"29","author":"Lackner-Warton W.","year":"2010","journal-title":"Polyhedron"},{"key":"ref4\/cit4","first-page":"44","volume":"15","author":"Zhao W.-J.","year":"1996","journal-title":"Jiegou Huaxue"},{"key":"ref5\/cit5","doi-asserted-by":"crossref","first-page":"431","DOI":"10.1002\/zfch.19670071118","volume":"11","author":"Seidel W.","year":"1967","journal-title":"Z. Chem."},{"key":"ref6\/cit6","doi-asserted-by":"crossref","first-page":"2699","DOI":"10.1021\/ic50094a016","volume":"9","author":"Ainscough W.","year":"1970","journal-title":"Inorg. Chem."},{"key":"ref7\/cit7","doi-asserted-by":"crossref","first-page":"3380","DOI":"10.1002\/cber.19851180835","volume":"118","author":"Brunner H.","year":"1985","journal-title":"Chem. Ber."},{"key":"ref8\/cit8a","doi-asserted-by":"crossref","first-page":"83","DOI":"10.1002\/zaac.19875450210","volume":"545","author":"Schirmer W.","year":"1987","journal-title":"Z. Anorg. Allg. Chem."},{"key":"ref8\/cit8b","doi-asserted-by":"crossref","first-page":"239","DOI":"10.1002\/zaac.655740127","volume":"574","author":"Schirmer W.","year":"1989","journal-title":"Z. Anorg. Allg. Chem."},{"key":"ref9\/cit9","first-page":"473","volume":"124","author":"Aucott S. M.","year":"1997","journal-title":"Phosphorus, Sulfur, Silicon"},{"key":"ref10\/cit10a","doi-asserted-by":"crossref","first-page":"2559","DOI":"10.1039\/b003294h","author":"Aucott S. M.","year":"2000","journal-title":"J. Chem. Soc., Dalton Trans."},{"key":"ref10\/cit10b","doi-asserted-by":"crossref","first-page":"3421","DOI":"10.1039\/b104523g","author":"Clarke M. L.","year":"2001","journal-title":"J. Chem. Soc., Dalton Trans."},{"key":"ref10\/cit10c","doi-asserted-by":"crossref","first-page":"1397","DOI":"10.1016\/S0277-5387(03)00115-3","volume":"22","author":"Slawin A. M. Z.","year":"2003","journal-title":"Polyhedron"},{"key":"ref11\/cit11","doi-asserted-by":"crossref","first-page":"4568","DOI":"10.1016\/j.ica.2004.06.040","volume":"357","author":"Sanchez G.","year":"2004","journal-title":"Inorg. Chim. Acta"},{"key":"ref12\/cit12a","doi-asserted-by":"crossref","first-page":"3255","DOI":"10.1021\/om050015b","volume":"24","author":"Smolensky E.","year":"2005","journal-title":"Organometallics"},{"key":"ref12\/cit12b","doi-asserted-by":"crossref","first-page":"4510","DOI":"10.1021\/om700455e","volume":"26","author":"Smolensky E.","year":"2007","journal-title":"Organometallics"},{"key":"ref13\/cit13","doi-asserted-by":"crossref","first-page":"495","DOI":"10.1039\/b9nj00523d","volume":"34","author":"Nabavizadeh S. M.","year":"2010","journal-title":"New J. Chem."},{"key":"ref14\/cit14a","doi-asserted-by":"crossref","first-page":"726","DOI":"10.1021\/om101013j","volume":"30","author":"Hyder I.","year":"2011","journal-title":"Organometallics"},{"key":"ref14\/cit14b","doi-asserted-by":"crossref","first-page":"1767","DOI":"10.1002\/ejic.200901162","author":"Macias-Arce I.","year":"2010","journal-title":"Eur. J. Inorg. Chem."},{"key":"ref15\/cit15","doi-asserted-by":"crossref","first-page":"16","DOI":"10.1002\/zfch.19730130109","volume":"13","author":"Henning H.-G.","year":"1973","journal-title":"Z. Chem."},{"key":"ref16\/cit16","doi-asserted-by":"crossref","first-page":"3281","DOI":"10.1002\/hlca.200390269","volume":"86","author":"Biricik N.","year":"2003","journal-title":"Helv. Chim. Acta"},{"key":"ref17\/cit17a","unstructured":"Trost, B. M.; Verhoeven, T. R.InComprehensive Organometallic Chemistry;Wilkinson, G.; Stone, F. G. A.; Abel, E. W., Eds.Pergamon Press:Oxford, 1982; Vol.8, p799."},{"key":"ref17\/cit17b","doi-asserted-by":"crossref","first-page":"566","DOI":"10.1002\/anie.199305661","volume":"32","author":"von Matt P","year":"1993","journal-title":"Angew. Chem., Int. Ed. Engl."},{"key":"ref17\/cit17c","unstructured":"Hayashi, T.InCatalytic Asymmetric Synthesis;Ojima, I., Ed.VCH Publishers:New York, 1993; p325, and references therein."},{"key":"ref17\/cit17d","unstructured":"Noyori, R.Asymmetric Catalysis in Organic Synthesis;Wiley:New York, 1994; p82."},{"key":"ref17\/cit17e","doi-asserted-by":"crossref","first-page":"395","DOI":"10.1021\/cr9409804","volume":"96","author":"Trost B. M.","year":"1996","journal-title":"Chem. Rev."},{"key":"ref17\/cit17f","doi-asserted-by":"crossref","first-page":"257","DOI":"10.1021\/cr00091a007","volume":"89","author":"Consiglio G.","year":"1989","journal-title":"Chem. Rev."},{"key":"ref17\/cit17g","doi-asserted-by":"crossref","first-page":"1089","DOI":"10.1016\/S0957-4166(00)82091-1","volume":"3","author":"Frost C. G.","year":"1992","journal-title":"Tetrahedron: Asymmetry"},{"key":"ref17\/cit17h","doi-asserted-by":"crossref","first-page":"203","DOI":"10.1016\/S0022-328X(98)01059-6","volume":"576","author":"Helmchen G.","year":"1999","journal-title":"J. Organomet. Chem."},{"key":"ref18\/cit18","doi-asserted-by":"crossref","first-page":"527","DOI":"10.1135\/cccc20070527","volume":"72","author":"Benito-Garagorri D.","year":"2007","journal-title":"Collect. Czech. Chem. Commun."},{"key":"ref19\/cit19","doi-asserted-by":"crossref","first-page":"441","DOI":"10.1016\/B978-0-12-378850-4.50057-2","volume-title":"Dynamic Nuclear Magnetic Resonance Spectroscopy","author":"Vrieze K.","year":"1975"},{"key":"ref20\/cit20","doi-asserted-by":"crossref","unstructured":"Faller, J. W.InDynamic NMR Spectroscopy in Organometallic Chemistry, Comprehensive Organometallic Chemistry III;Crabtree, R. H.; Mingos, D. M. P., Eds.Elsevier:Oxford, 2006; pp407\u2013428.","DOI":"10.1016\/B0-08-045047-4\/00017-0"},{"key":"ref21\/cit21a","doi-asserted-by":"crossref","first-page":"407","DOI":"10.1016\/0022-328X(89)87302-4","volume":"370","author":"Cesarotti E.","year":"1989","journal-title":"J. Organomet. Chem."},{"key":"ref21\/cit21b","doi-asserted-by":"crossref","first-page":"2073","DOI":"10.1039\/DT9910002073","author":"Cesarotti E.","year":"1991","journal-title":"J. Chem. Soc., Dalton Trans."},{"key":"ref22\/cit22a","doi-asserted-by":"crossref","first-page":"3758","DOI":"10.1021\/om9610354","volume":"16","author":"Fernandez-Galan R.","year":"1997","journal-title":"Organometallics"},{"key":"ref22\/cit22b","doi-asserted-by":"crossref","first-page":"3183","DOI":"10.1021\/om070093u","volume":"26","author":"Montoya V.","year":"2007","journal-title":"Organometallics"},{"key":"ref23\/cit23","doi-asserted-by":"crossref","first-page":"3631","DOI":"10.1021\/ja00087a072","volume":"116","author":"Gogoll A.","year":"1994","journal-title":"J. Am. Chem. Soc."},{"key":"ref24\/cit24","doi-asserted-by":"crossref","first-page":"3183","DOI":"10.1021\/om070093u","volume":"26","author":"Montoya V.","year":"2007","journal-title":"Organometallics"},{"key":"ref25\/cit25","doi-asserted-by":"crossref","first-page":"3236","DOI":"10.1021\/om0702274","volume":"26","author":"Chernyshova E. S.","year":"2007","journal-title":"Organometallics"},{"key":"ref26\/cit26","doi-asserted-by":"crossref","first-page":"437","DOI":"10.1021\/om7010613","volume":"27","author":"Filipuzzi S.","year":"2008","journal-title":"Organometallics"},{"key":"ref27\/cit27","doi-asserted-by":"crossref","first-page":"8031","DOI":"10.1021\/ic800361v","volume":"47","author":"Peng H.","year":"2008","journal-title":"Inorg. Chem."},{"key":"ref28\/cit28a","doi-asserted-by":"crossref","first-page":"35","DOI":"10.1016\/S0010-8545(96)90176-9","volume":"155","author":"Pregosin P. S.","year":"1996","journal-title":"Coord. Chem. Rev."},{"key":"ref28\/cit28b","doi-asserted-by":"crossref","first-page":"3311","DOI":"10.1021\/om00007a035","volume":"14","author":"Herrmann J.","year":"1995","journal-title":"Organometallics"},{"key":"ref29\/cit29a","doi-asserted-by":"crossref","first-page":"4067","DOI":"10.1021\/ja00088a048","volume":"116","author":"Breutel C.","year":"1994","journal-title":"J. Am. Chem. Soc."},{"key":"ref29\/cit29b","doi-asserted-by":"crossref","first-page":"842","DOI":"10.1021\/om00002a035","volume":"14","author":"Pregosin P. S.","year":"1995","journal-title":"Organometallics"},{"key":"ref30\/cit30a","doi-asserted-by":"crossref","first-page":"2724","DOI":"10.1021\/om801204a","volume":"28","author":"Wassenaar J.","year":"2009","journal-title":"Organometallics"},{"key":"ref30\/cit30b","doi-asserted-by":"crossref","first-page":"6489","DOI":"10.1021\/om900697e","volume":"28","author":"Moreno A.","year":"2009","journal-title":"Organometallics"},{"key":"ref30\/cit30c","doi-asserted-by":"crossref","first-page":"6508","DOI":"10.1021\/ja002657q","volume":"123","author":"Deng W.","year":"2001","journal-title":"J. Am. Chem. Soc."},{"key":"ref31\/cit31","doi-asserted-by":"crossref","first-page":"5076","DOI":"10.1021\/om050537r","volume":"24","author":"Faller J. W.","year":"2005","journal-title":"Organometallics"},{"key":"ref32\/cit32a","doi-asserted-by":"crossref","first-page":"1016","DOI":"10.1039\/b207447h","author":"Mandal S. K.","year":"2003","journal-title":"Dalton Trans."},{"key":"ref32\/cit32b","doi-asserted-by":"crossref","first-page":"1081","DOI":"10.1002\/ejic.200300627","author":"Camus J. M.","year":"2004","journal-title":"Eur. J. Inorg. Chem."},{"key":"ref33\/cit33","doi-asserted-by":"crossref","first-page":"5955","DOI":"10.1021\/om060726p","volume":"25","author":"Filipuzzi S.","year":"2006","journal-title":"Organometallics"},{"key":"ref34\/cit34","doi-asserted-by":"crossref","first-page":"4858","DOI":"10.1021\/om1000327","volume":"29","author":"Dastgir S.","year":"2010","journal-title":"Organometallics"},{"key":"ref35\/cit35","volume-title":"Density Functional Theory of Atoms and Molecules","author":"Parr R. G.","year":"1989"},{"key":"ref36\/cit36a","doi-asserted-by":"crossref","first-page":"1083","DOI":"10.1016\/0040-4020(68)88057-3","volume":"24","author":"Wiberg K. B.","year":"1968","journal-title":"Tetrahedron"},{"key":"ref36\/cit36b","unstructured":"Wiberg indices are electronic parameters related to the electron density between atoms. They can be obtained from a natural population analysis and provide an indication of the bond strength."},{"key":"ref37\/cit37a","doi-asserted-by":"crossref","first-page":"4101","DOI":"10.1021\/ja057704z","volume":"128","author":"Marion N.","year":"2006","journal-title":"J. Am. Chem. Soc."},{"key":"ref37\/cit37b","doi-asserted-by":"crossref","first-page":"1204","DOI":"10.1021\/om0490278","volume":"24","author":"Piechaczyk O.","year":"2005","journal-title":"Organometallics"},{"key":"ref38\/cit38","doi-asserted-by":"crossref","first-page":"2413","DOI":"10.1002\/(SICI)1521-3773(19990816)38:16<2413::AID-ANIE2413>3.0.CO;2-H","volume":"38","author":"Wolfe J. P.","year":"1999","journal-title":"Angew. Chem., Int. Ed."},{"key":"ref39\/cit39","volume-title":"Purification of Laboratory Chemicals","author":"Perrin D. D.","year":"1988","edition":"3"},{"key":"ref40\/cit40a","doi-asserted-by":"crossref","first-page":"713","DOI":"10.1016\/S0020-1693(00)94915-6","volume":"7","author":"Knebel W. J.","year":"1973","journal-title":"Inorg. Chim. Acta"},{"key":"ref40\/cit40b","doi-asserted-by":"crossref","first-page":"632","DOI":"10.1021\/ic50133a025","volume":"13","author":"Knebel W. J.","year":"1974","journal-title":"Inorg. Chem."},{"key":"ref40\/cit40c","doi-asserted-by":"crossref","first-page":"915","DOI":"10.1039\/DT9770000915","author":"Ainscough E. W.","year":"1977","journal-title":"J. Chem. Soc., Dalton Trans."},{"key":"ref41\/cit41","doi-asserted-by":"crossref","first-page":"7008","DOI":"10.1039\/c1dt10377f","volume":"40","author":"\u00d6ztopcu \u00d6.","year":"2011","journal-title":"Dalton Trans."},{"key":"ref42\/cit42","doi-asserted-by":"crossref","first-page":"2033","DOI":"10.1021\/ja00293a038","volume":"107","author":"Auburn P. R.","year":"1985","journal-title":"J. Am. Chem. Soc."},{"key":"ref43\/cit43","unstructured":"Bruker programs:APEX2, version 2009.9-0;SAINT, version 7.68 A;SADABS, version 2008\/1;SHELXTL, version 2008\/4;Bruker AXS Inc.:Madison, WI, 2009."},{"key":"ref44\/cit44","doi-asserted-by":"crossref","first-page":"112","DOI":"10.1107\/S0108767307043930","volume":"64","author":"Sheldrick G. M.","year":"2008","journal-title":"Acta Crystallogr."},{"key":"ref45\/cit45","unstructured":"Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Montgomery, J. A., Jr.; Vreven, T.; Kudin, K. N.; Burant, J. C.; Millam, J. M.; Iyengar, S. S.; Tomasi, J.; Barone, V.; Mennucci, B.; Cossi, M.; Scalmani, G.; Rega, N.; Petersson, G. A.; Nakatsuji, H.; Hada, M.; Ehara, M.; Toyota, K.; Fukuda, R.; Hasegawa, J.; Ishida, M.; Nakajima, T.; Honda, Y.; Kitao, O.; Nakai, H.; Klene, M.; Li, X.; Knox, J. E.; Hratchian, H. P.; Cross, J. B.; Adamo, C.; Jaramillo, J.; Gomperts, R.; Stratmann, R. E.; Yazyev, O.; Austin, A. J.; Cammi, R.; Pomelli, C.; Ochterski, J. W.; Ayala, P. Y.; Morokuma, K.; Voth, G. A.; Salvador, P.; Dannenberg, J. J.; Zakrzewski, V. G.; Dapprich, S.; Daniels, A. D.; Strain, M. C.; Farkas, O.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Ortiz, J. V.; Cui, Q.; Baboul, A. G.; Clifford, S.; Cioslowski, J.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I.; Martin, R. L.; Fox, D. J.; Keith, T.; Al-Laham, M. A.; Peng, C. Y.; Nanayakkara, A.; Challacombe, M.; Gill, P. M. W.; Johnson, B.; Chen, W.; Wong, M. W.; Gonzalez, C.; Pople, J. A.Gaussian 03, Revision C.02;Gaussian, Inc.:Wallingford, CT, 2004."},{"key":"ref46\/cit46","volume-title":"Ab Initio Molecular Orbital Theory","author":"Hehre W. J.","year":"1986"},{"key":"ref47\/cit47a","doi-asserted-by":"crossref","first-page":"1396","DOI":"10.1103\/PhysRevLett.78.1396","volume":"78","author":"Perdew J. P.","year":"1997","journal-title":"Phys. Rev. Lett."},{"key":"ref47\/cit47b","doi-asserted-by":"crossref","first-page":"8822","DOI":"10.1103\/PhysRevB.33.8822","volume":"33","author":"Perdew J. P.","year":"1986","journal-title":"Phys. Rev. B"},{"key":"ref48\/cit48a","unstructured":"Dunning, T. H., Jr.; Hay, P. J.Modern Theoretical Chemistry;Schaefer, H. F., III, Ed.Plenum:New York, 1976; Vol.3, p1."},{"key":"ref48\/cit48b","doi-asserted-by":"crossref","first-page":"270","DOI":"10.1063\/1.448799","volume":"82","author":"Hay P. J.","year":"1985","journal-title":"J. Chem. Phys."},{"key":"ref48\/cit48c","doi-asserted-by":"crossref","first-page":"284","DOI":"10.1063\/1.448800","volume":"82","author":"Wadt W. R.","year":"1985","journal-title":"J. Chem. Phys."},{"key":"ref48\/cit48d","first-page":"2299","volume":"82","author":"Hay P. J.","year":"1985","journal-title":"J. Chem. Phys."},{"key":"ref49\/cit49","doi-asserted-by":"crossref","first-page":"111","DOI":"10.1016\/0009-2614(93)80086-5","volume":"208","author":"Ehlers A. W.","year":"1993","journal-title":"Chem. Phys. Lett."},{"key":"ref50\/cit50a","doi-asserted-by":"crossref","first-page":"724","DOI":"10.1063\/1.1674902","volume":"54","author":"Ditchfield R.","year":"1971","journal-title":"J. Chem. Phys."},{"key":"ref50\/cit50b","doi-asserted-by":"crossref","first-page":"2257","DOI":"10.1063\/1.1677527","volume":"56","author":"Hehre W. J.","year":"1972","journal-title":"J. Chem. Phys."},{"key":"ref50\/cit50c","doi-asserted-by":"crossref","first-page":"209","DOI":"10.1080\/00268977400100171","volume":"27","author":"Hariharan P. C.","year":"1974","journal-title":"Mol. Phys."},{"key":"ref50\/cit50d","doi-asserted-by":"crossref","first-page":"163","DOI":"10.1016\/0009-2614(80)80628-2","volume":"76","author":"Gordon M. S.","year":"1980","journal-title":"Chem. Phys. Lett."},{"key":"ref50\/cit50e","doi-asserted-by":"crossref","first-page":"213","DOI":"10.1007\/BF00533485","volume":"28","author":"Hariharan P. C.","year":"1973","journal-title":"Theor. Chim. Acta"},{"key":"ref51\/cit51a","doi-asserted-by":"crossref","first-page":"49","DOI":"10.1002\/(SICI)1096-987X(19960115)17:1<49::AID-JCC5>3.0.CO;2-0","volume":"17","author":"Peng C.","year":"1996","journal-title":"J. Comput. Chem."},{"key":"ref51\/cit51b","doi-asserted-by":"crossref","first-page":"449","DOI":"10.1002\/ijch.199300051","volume":"33","author":"Peng C.","year":"1994","journal-title":"Isr. J. Chem."},{"key":"ref52\/cit52a","doi-asserted-by":"crossref","first-page":"41","DOI":"10.1016\/0166-1280(88)80248-3","volume":"169","author":"Carpenter J. E.","year":"1988","journal-title":"J. Mol. Struct. (THEOCHEM)"},{"key":"ref52\/cit52b","unstructured":"Carpenter, J. E.Ph.D. thesis,University of Wisconsin,Madison WI, 1987."},{"key":"ref52\/cit52c","doi-asserted-by":"crossref","first-page":"7211","DOI":"10.1021\/ja00544a007","volume":"102","author":"Foster J. P.","year":"1980","journal-title":"J. Am. Chem. Soc."},{"key":"ref52\/cit52d","doi-asserted-by":"crossref","first-page":"4066","DOI":"10.1063\/1.445134","volume":"78","author":"Reed A. E.","year":"1983","journal-title":"J. Chem. Phys."},{"key":"ref52\/cit52e","first-page":"1736","volume":"78","author":"Reed A. E.","year":"1983","journal-title":"J. Chem. Phys."},{"key":"ref52\/cit52f","doi-asserted-by":"crossref","first-page":"735","DOI":"10.1063\/1.449486","volume":"83","author":"Reed A. E.","year":"1985","journal-title":"J. Chem. Phys."},{"key":"ref52\/cit52g","doi-asserted-by":"crossref","first-page":"899","DOI":"10.1021\/cr00088a005","volume":"88","author":"Reed A. E.","year":"1988","journal-title":"Chem. Rev."},{"key":"ref52\/cit52h","doi-asserted-by":"crossref","unstructured":"Weinhold, F.; Carpenter, J. E.The Structure of Small Molecules and Ions;Plenum:New York, 1988; p227.","DOI":"10.1007\/978-1-4684-7424-4_24"},{"key":"ref53\/cit53a","doi-asserted-by":"crossref","first-page":"1211","DOI":"10.1080\/00268979300100801","volume":"78","author":"Haeusermann U.","year":"1993","journal-title":"Mol. Phys."},{"key":"ref53\/cit53b","doi-asserted-by":"crossref","first-page":"7535","DOI":"10.1063\/1.466847","volume":"100","author":"Kuechle W.","year":"1994","journal-title":"J. Chem. Phys."},{"key":"ref53\/cit53c","doi-asserted-by":"crossref","first-page":"1052","DOI":"10.1063\/1.471950","volume":"105","author":"Leininger T.","year":"1996","journal-title":"J. Chem. Phys."},{"key":"ref54\/cit54a","doi-asserted-by":"crossref","first-page":"5639","DOI":"10.1063\/1.438980","volume":"72","author":"McClean A. D.","year":"1980","journal-title":"J. Chem. Phys."},{"key":"ref54\/cit54b","doi-asserted-by":"crossref","first-page":"650","DOI":"10.1063\/1.438955","volume":"72","author":"Krishnan R.","year":"1980","journal-title":"J. Chem. Phys."},{"key":"ref54\/cit54c","doi-asserted-by":"crossref","first-page":"1033","DOI":"10.1063\/1.1673095","volume":"52","author":"Wachters A. J. H.","year":"1970","journal-title":"J. Chem. Phys."},{"key":"ref54\/cit54d","doi-asserted-by":"crossref","first-page":"4377","DOI":"10.1063\/1.433731","volume":"66","author":"Hay P. J.","year":"1977","journal-title":"J. Chem. Phys."},{"key":"ref54\/cit54e","doi-asserted-by":"crossref","first-page":"1062","DOI":"10.1063\/1.457230","volume":"91","author":"Raghavachari K.","year":"1989","journal-title":"J. Chem. Phys."},{"key":"ref54\/cit54f","doi-asserted-by":"crossref","first-page":"1206","DOI":"10.1002\/jcc.540111013","volume":"11","author":"Binning R. C.","year":"1990","journal-title":"J. Comput. Chem."},{"key":"ref54\/cit54g","doi-asserted-by":"crossref","first-page":"511","DOI":"10.1063\/1.460367","volume":"94","author":"McGrath M. P.","year":"1991","journal-title":"J. Chem. Phys."},{"key":"ref54\/cit54h","doi-asserted-by":"crossref","first-page":"294","DOI":"10.1002\/jcc.540040303","volume":"4","author":"Clark T.","year":"1983","journal-title":"J. Comput. Chem."},{"key":"ref54\/cit54i","doi-asserted-by":"crossref","first-page":"3265","DOI":"10.1063\/1.447079","volume":"80","author":"Frisch M. J.","year":"1984","journal-title":"J. Chem. Phys."},{"key":"ref55\/cit55a","doi-asserted-by":"crossref","first-page":"3032","DOI":"10.1063\/1.474659","volume":"107","author":"Canc\u00e8s M. T.","year":"1997","journal-title":"J. Chem. Phys."},{"key":"ref55\/cit55b","doi-asserted-by":"crossref","first-page":"253","DOI":"10.1016\/S0009-2614(98)00106-7","volume":"286","author":"Cossi M.","year":"1998","journal-title":"Chem. Phys. Lett."},{"key":"ref55\/cit55c","doi-asserted-by":"crossref","first-page":"5151","DOI":"10.1063\/1.473558","volume":"106","author":"Mennucci B.","year":"1997","journal-title":"J. Chem. Phys."},{"key":"ref56\/cit56a","doi-asserted-by":"crossref","first-page":"2999","DOI":"10.1021\/cr9904009","volume":"105","author":"Tomasi J.","year":"2005","journal-title":"Chem. Rev."},{"key":"ref56\/cit56b","doi-asserted-by":"crossref","first-page":"43","DOI":"10.1063\/1.1480445","volume":"117","author":"Cossi M.","year":"2002","journal-title":"J. Chem. Phys."}],"container-title":["Organometallics"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/om200766y","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2024,4,13]],"date-time":"2024-04-13T18:31:28Z","timestamp":1713033088000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/om200766y"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2011,10,14]]},"references-count":115,"journal-issue":{"issue":"21","published-print":{"date-parts":[[2011,11,14]]}},"alternative-id":["10.1021\/om200766y"],"URL":"https:\/\/doi.org\/10.1021\/om200766y","relation":{},"ISSN":["0276-7333","1520-6041"],"issn-type":[{"value":"0276-7333","type":"print"},{"value":"1520-6041","type":"electronic"}],"subject":[],"published":{"date-parts":[[2011,10,14]]}}}