{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,7,9]],"date-time":"2026-07-09T13:44:55Z","timestamp":1783604695755,"version":"3.55.0"},"reference-count":55,"publisher":"American Chemical Society (ACS)","issue":"12","content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Phys. Chem. A"],"published-print":{"date-parts":[[2005,3,1]]},"DOI":"10.1021\/jp045469l","type":"journal-article","created":{"date-parts":[[2005,3,24]],"date-time":"2005-03-24T05:50:58Z","timestamp":1111643458000},"page":"2942-2947","source":"Crossref","is-referenced-by-count":11,"title":["Partial Hydrogen Bonds:\u2009 Structural Studies on Thioureidoalkylphosphonates"],"prefix":"10.1021","volume":"109","author":[{"given":"Lilianna","family":"Ch\u0229ci\u0144ska","sequence":"first","affiliation":[{"name":"Department of Crystallography and Crystal Chemistry, University of \u0141\u00f3d\u017a, Pomorska 149\/153, 90-236 \u0141\u00f3d\u017a, Poland"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"S\u0142awomir J.","family":"Grabowski","sequence":"additional","affiliation":[{"name":"Department of Crystallography and Crystal Chemistry, University of \u0141\u00f3d\u017a, Pomorska 149\/153, 90-236 \u0141\u00f3d\u017a, Poland"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"316","published-online":{"date-parts":[[2005,3,4]]},"reference":[{"key":"jp045469lb00001\/jp045469lb00001_1","volume-title":"Crystal Engineering:\u2009 The Design of Organic Solids","author":"Desiraju G. R.","year":"1989"},{"key":"jp045469lb00002\/jp045469lb00002_1","doi-asserted-by":"crossref","DOI":"10.1007\/978-3-642-85135-3","volume-title":"Hydrogen Bonding in Biological Structures","author":"Jeffrey G. A.","year":"1991"},{"key":"jp045469lb00003\/jp045469lb00003_1","volume-title":"An Introduction to Hydrogen Bonding","author":"Jeffrey G. A.","year":"1997"},{"key":"jp045469lb00004\/jp045469lb00004_1","doi-asserted-by":"crossref","first-page":"1087","DOI":"10.1021\/ja01874a028","volume":"61","author":"Albrecht G.","year":"1939","journal-title":"J. Am. Chem. Soc."},{"key":"jp045469lb00005\/jp045469lb00005_1","doi-asserted-by":"crossref","first-page":"1827","DOI":"10.1107\/S0567740872005096","volume":"28","author":"J\u00f6nsson P. G.","year":"1972","journal-title":"Acta Crystallogr."},{"key":"jp045469lb00006\/jp045469lb00006_1","volume-title":"The weak hydrogen bond in structural chemistry and biology","author":"Desiraju G. R.","year":"1999"},{"key":"jp045469lb00007\/jp045469lb00007_1","doi-asserted-by":"crossref","first-page":"509","DOI":"10.1107\/S0567740869002482","volume":"25","author":"Parthasarathy R.","year":"1969","journal-title":"Acta Crystallogr."},{"key":"jp045469lb00008\/jp045469lb00008_1","doi-asserted-by":"crossref","first-page":"4077","DOI":"10.1016\/S0040-4039(00)73116-9","volume":"35","author":"Zimmerman S. C.","year":"1994","journal-title":"J. Tetrahedron Lett."},{"key":"jp045469lb00008\/jp045469lb00008_2","doi-asserted-by":"crossref","first-page":"9090","DOI":"10.1021\/ja981604u","volume":"120","author":"Yang J.","year":"1998","journal-title":"J. Am. Chem. Soc."},{"key":"jp045469lb00008\/jp045469lb00008_3","doi-asserted-by":"crossref","first-page":"297","DOI":"10.1016\/S0022-2860(98)00702-9","volume":"480","author":"Bureiko S. F.","year":"1999","journal-title":"J. Mol. Struct."},{"key":"jp045469lb00008\/jp045469lb00008_4","doi-asserted-by":"crossref","first-page":"4352","DOI":"10.1002\/1521-3765(20011015)7:20<4352::AID-CHEM4352>3.0.CO;2-L","volume":"7","author":"Parra R. D.","year":"2001","journal-title":"Chem.Eur. J."},{"key":"jp045469lb00009\/jp045469lb00009_1","doi-asserted-by":"crossref","first-page":"18","DOI":"10.1002\/poc.685","volume":"17","author":"Grabowski S. J.","year":"2004","journal-title":"J. Phys. Org. Chem."},{"key":"jp045469lb00010\/jp045469lb00010_1","doi-asserted-by":"crossref","DOI":"10.1093\/oso\/9780198551683.001.0001","volume-title":"Atoms in Molecules. A Quantum Theory","author":"Bader R. F. W.","year":"1990"},{"key":"jp045469lb00010\/jp045469lb00010_2","volume-title":"Atoms in Molecules. An Introduction","author":"Popelier P.","year":"2000"},{"key":"jp045469lb00011\/jp045469lb00011_1","doi-asserted-by":"crossref","first-page":"6628","DOI":"10.1063\/1.463666","volume":"97","author":"M\u00f3 O.","year":"1992","journal-title":"J. Chem. Phys."},{"key":"jp045469lb00011\/jp045469lb00011_2","doi-asserted-by":"crossref","first-page":"73","DOI":"10.1016\/0166-1280(94)03802-R","volume":"314","author":"M\u00f3 O.","year":"1994","journal-title":"J. Mol. Struct. (THEOCHEM)"},{"key":"jp045469lb00011\/jp045469lb00011_3","doi-asserted-by":"crossref","first-page":"11166","DOI":"10.1063\/1.1420749","volume":"115","author":"Galvez O.","year":"2001","journal-title":"J. Chem. Phys."},{"key":"jp045469lb00011\/jp045469lb00011_4","first-page":"4879","volume":"118","author":"Galvez O.","year":"2003","journal-title":"J. Chem. Phys."},{"key":"jp045469lb00011\/jp045469lb00011_5","doi-asserted-by":"crossref","first-page":"1177","DOI":"10.1021\/jp030978t","volume":"108","author":"Pacios L. F.","year":"2004","journal-title":"J. Phys. Chem. A"},{"key":"jp045469lb00011\/jp045469lb00011_6","doi-asserted-by":"crossref","first-page":"5551","DOI":"10.1021\/jp993984r","volume":"104","author":"Grabowski S. J.","year":"2000","journal-title":"J. Phys. Chem. A"},{"key":"jp045469lb00011\/jp045469lb00011_7","doi-asserted-by":"crossref","first-page":"10739","DOI":"10.1021\/jp011819h","volume":"105","author":"Grabowski S. J.","year":"2001","journal-title":"J. Phys. Chem. A"},{"key":"jp045469lb00012\/jp045469lb00012_1","doi-asserted-by":"crossref","first-page":"9925","DOI":"10.1021\/jp9824813","volume":"102","author":"Rozas I.","year":"1998","journal-title":"J. Phys. Chem. A"},{"key":"jp045469lb00013\/jp045469lb00013_1","first-page":"o1213","volume":"57","author":"Ch\u0229ci\u0144ska L.","year":"2001","journal-title":"Acta Crystallogr."},{"key":"jp045469lb00013\/jp045469lb00013_2","first-page":"o1216","volume":"57","author":"Ch\u0229ci\u0144ska L.","year":"2001","journal-title":"Acta Crystallogr."},{"key":"jp045469lb00013\/jp045469lb00013_3","first-page":"o46","volume":"59","author":"Ch\u0229ci\u0144ska L.","year":"2003","journal-title":"Acta Crystallogr."},{"key":"jp045469lb00013\/jp045469lb00013_4","doi-asserted-by":"crossref","first-page":"213","DOI":"10.1002\/poc.596","volume":"16","author":"Ch\u0229ci\u0144ska L.","year":"2003","journal-title":"J. Phys. Org. Chem."},{"key":"jp045469lb00014\/jp045469lb00014_1","doi-asserted-by":"crossref","first-page":"3817","DOI":"10.1021\/jp031285f","volume":"108","author":"Parthasarathi R.","year":"2004","journal-title":"J. Phys. Chem. A"},{"key":"jp045469lb00015\/jp045469lb00015_1","first-page":"472","volume":"469","author":"Kudzin Z. H.","year":"1978","journal-title":"J. Synthesis"},{"key":"jp045469lb00016\/jp045469lb00016_1","unstructured":"MSC\/AFCDiffractometer Control Software; Molecular Structure Corp.\u2009 The Woodlands, TX, 1989."},{"key":"jp045469lb00017\/jp045469lb00017_1","volume-title":"Single-Crystal Structure Analysis Software, version 5.0","author":"TEXSAN","year":"1989"},{"key":"jp045469lb00018\/jp045469lb00018_1","doi-asserted-by":"crossref","first-page":"1014","DOI":"10.1107\/S0365110X65004802","volume":"19","author":"Meulenaer J.","year":"1965","journal-title":"Acta Crystallogr., A"},{"key":"jp045469lb00019\/jp045469lb00019_1","doi-asserted-by":"crossref","first-page":"473","DOI":"10.1107\/S0108767390000277","volume":"46","author":"Sheldrick G. M.","year":"1990","journal-title":"Acta Crystallogr."},{"key":"jp045469lb00020\/jp045469lb00020_1","unstructured":"Sheldrick, G. M.SHELXL97; University of G\u00f6ttingen:\u2009 G\u00f6ttingen, Germany, 1997."},{"key":"jp045469lb00021\/jp045469lb00021_1","volume-title":"Gaussian 98, revision A.6","author":"Frisch M. J.","year":"1998"},{"key":"jp045469lb00022\/jp045469lb00022_1","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":"jp045469lb00022\/jp045469lb00022_2","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":"jp045469lb00022\/jp045469lb00022_3","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":"jp045469lb00023\/jp045469lb00023_1","first-page":"15648","volume":"98","author":"Becke A. D.","year":"1993","journal-title":"J. Chem. Phys."},{"key":"jp045469lb00024\/jp045469lb00024_1","doi-asserted-by":"crossref","DOI":"10.1093\/oso\/9780195098235.001.0001","volume-title":"X-ray Charge Densities and Chemical Bonding","author":"Coppens P.","year":"1997"},{"key":"jp045469lb00025\/jp045469lb00025_1","doi-asserted-by":"crossref","first-page":"909","DOI":"10.1021\/ja00082a011","volume":"116","author":"Gilli P.","year":"1994","journal-title":"J. Am. Chem. Soc."},{"key":"jp045469lb00026\/jp045469lb00026_1","volume-title":"AIM2000 designed by Friedrich Biegler-K\u00f6nig","year":"2000"},{"key":"jp045469lb00027\/jp045469lb00027_1","doi-asserted-by":"crossref","first-page":"120","DOI":"10.1021\/ar00172a005","volume":"23","author":"Etter M. C.","year":"1990","journal-title":"Acc. Chem. Res."},{"key":"jp045469lb00027\/jp045469lb00027_2","doi-asserted-by":"crossref","first-page":"1555","DOI":"10.1002\/anie.199515551","volume":"34","author":"Bernstein J.","year":"1995","journal-title":"Angew. Chem., Int. Ed. Engl."},{"key":"jp045469lb00028\/jp045469lb00028_1","doi-asserted-by":"crossref","first-page":"775","DOI":"10.1107\/S0567740876003968","volume":"32","author":"Leiserowitz L.","year":"1976","journal-title":"Acta Crystallogr."},{"key":"jp045469lb00028\/jp045469lb00028_2","volume-title":"Structure Correlation","author":"Bernstein J.","year":"1994"},{"key":"jp045469lb00029\/jp045469lb00029_1","doi-asserted-by":"crossref","DOI":"10.1002\/9783527616091.app1","volume-title":"Typical Interatomic Distances in Organic Compounds and Organometallic Compounds and Coordination Complexes of the d- and f-block Metals","author":"Orpen A. G.","year":"1994"},{"key":"jp045469lb00030\/jp045469lb00030_1","doi-asserted-by":"crossref","first-page":"10153","DOI":"10.1016\/S0040-4020(98)00607-3","volume":"54","author":"Grabowski S.","year":"1998","journal-title":"J. Tetrahedron"},{"key":"jp045469lb00031\/jp045469lb00031_1","doi-asserted-by":"crossref","first-page":"9747","DOI":"10.1021\/j100024a016","volume":"99","author":"Koch U.","year":"1995","journal-title":"J. Phys. Chem."},{"key":"jp045469lb00032\/jp045469lb00032_1","doi-asserted-by":"crossref","first-page":"563","DOI":"10.1107\/S0108768199002128","volume":"55","author":"Espinosa E.","year":"1999","journal-title":"Acta Crystallogr."},{"key":"jp045469lb00033\/jp045469lb00033_1","doi-asserted-by":"crossref","first-page":"9","DOI":"10.1021\/ar00109a003","volume":"18","author":"Bader R. F. W.","year":"1985","journal-title":"Acc. Chem. Res."},{"key":"jp045469lb00033\/jp045469lb00033_2","doi-asserted-by":"crossref","first-page":"893","DOI":"10.1021\/cr00005a013","volume":"91","author":"Bader R. F. W.","year":"1991","journal-title":"Chem. Rev."},{"key":"jp045469lb00034\/jp045469lb00034_1","doi-asserted-by":"crossref","first-page":"12835","DOI":"10.1021\/ja0025705","volume":"122","author":"Arnold W. D.","year":"2000","journal-title":"J. Am. Chem. Soc."},{"key":"jp045469lb00034\/jp045469lb00034_2","doi-asserted-by":"crossref","first-page":"97","DOI":"10.1016\/S0009-2614(99)01306-8","volume":"317","author":"Jenkins S.","year":"2000","journal-title":"Chem. Phys. Lett."},{"key":"jp045469lb00035\/jp045469lb00035_1","doi-asserted-by":"crossref","first-page":"11154","DOI":"10.1021\/ja0017864","volume":"122","author":"Rozas I.","year":"2000","journal-title":"J. Am. Chem. Soc."},{"key":"jp045469lb00036\/jp045469lb00036_1","doi-asserted-by":"crossref","first-page":"1703","DOI":"10.1016\/S0009-2614(98)00036-0","volume":"285","author":"Espinosa E.","year":"1998","journal-title":"Chem. Phys. Lett."}],"container-title":["The Journal of Physical Chemistry A"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/jp045469l","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2024,1,24]],"date-time":"2024-01-24T06:20:50Z","timestamp":1706077250000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/jp045469l"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2005,3,1]]},"references-count":55,"journal-issue":{"issue":"12","published-print":{"date-parts":[[2005,3,1]]}},"alternative-id":["10.1021\/jp045469l"],"URL":"https:\/\/doi.org\/10.1021\/jp045469l","relation":{},"ISSN":["1089-5639","1520-5215"],"issn-type":[{"value":"1089-5639","type":"print"},{"value":"1520-5215","type":"electronic"}],"subject":[],"published":{"date-parts":[[2005,3,1]]}}}