{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2025,12,27]],"date-time":"2025-12-27T15:12:49Z","timestamp":1766848369742},"reference-count":51,"publisher":"American Chemical Society (ACS)","issue":"12","content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Phys. Chem. B"],"published-print":{"date-parts":[[2014,3,27]]},"DOI":"10.1021\/jp409201v","type":"journal-article","created":{"date-parts":[[2014,2,26]],"date-time":"2014-02-26T21:38:54Z","timestamp":1393450734000},"page":"3267-3280","source":"Crossref","is-referenced-by-count":31,"title":["New Solvates of an Old Drug Compound (Phenobarbital): Structure and Stability"],"prefix":"10.1021","volume":"118","author":[{"given":"Neslihan","family":"Zencirci","sequence":"first","affiliation":[{"name":"Institute\rof Pharmacy, University of Innsbruck, Innrain 52, 6020 Innsbruck, Austria"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Ulrich J.","family":"Griesser","sequence":"additional","affiliation":[{"name":"Institute\rof Pharmacy, University of Innsbruck, Innrain 52, 6020 Innsbruck, Austria"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Thomas","family":"Gelbrich","sequence":"additional","affiliation":[{"name":"Institute\rof Pharmacy, University of Innsbruck, Innrain 52, 6020 Innsbruck, Austria"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Volker","family":"Kahlenberg","sequence":"additional","affiliation":[{"name":"Institute\rof Mineralogy and Petrography, University of Innsbruck, Innrain\r52, 6020 Innsbruck, Austria"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Ram K. R.","family":"Jetti","sequence":"additional","affiliation":[{"name":"Institute\rof Pharmacy, University of Innsbruck, Innrain 52, 6020 Innsbruck, Austria"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"David C.","family":"Apperley","sequence":"additional","affiliation":[{"name":"Department\rof Chemistry, University of Durham, South Road, Durham DH1 3LE, United Kingdom"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Robin K.","family":"Harris","sequence":"additional","affiliation":[{"name":"Department\rof Chemistry, University of Durham, South Road, Durham DH1 3LE, United Kingdom"}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"316","published-online":{"date-parts":[[2014,3,12]]},"reference":[{"key":"ref1\/cit1","unstructured":"World Health Organization (WHO).WHO Model List of Essential Medicines,17th edition (March 2011), 2011."},{"key":"ref2\/cit2a","doi-asserted-by":"crossref","first-page":"1055","DOI":"10.1007\/BF01217548","volume":"50","author":"Brandst\u00e4tter-Kuhnert M.","year":"1962","journal-title":"Microchim. Acta"},{"key":"ref2\/cit2b","doi-asserted-by":"crossref","first-page":"360","DOI":"10.1007\/BF01234703","volume":"51","author":"Brandst\u00e4tter-Kuhnert M.","year":"1963","journal-title":"Microchim. Acta"},{"key":"ref2\/cit2c","first-page":"181","volume":"16","author":"Brandst\u00e4tter-Kuhnert M.","year":"1961","journal-title":"Mikroskopie"},{"key":"ref2\/cit2d","doi-asserted-by":"crossref","first-page":"201","DOI":"10.1007\/BF01216332","volume":"55","author":"Kuhnert-Brandst\u00e4tter M.","year":"1967","journal-title":"Microchim. Acta"},{"key":"ref3\/cit3","doi-asserted-by":"crossref","first-page":"9872","DOI":"10.1021\/ja302601f","volume":"134","author":"L\u00f3pez-Mej\u00edas V.","year":"2012","journal-title":"J. Am. Chem. Soc."},{"key":"ref4\/cit4a","doi-asserted-by":"crossref","first-page":"3444","DOI":"10.1021\/cg801416a","volume":"9","author":"Zencirci N.","year":"2009","journal-title":"Cryst. Growth Des."},{"key":"ref4\/cit4b","doi-asserted-by":"crossref","first-page":"302","DOI":"10.1021\/cg901062n","volume":"10","author":"Zencirci N.","year":"2010","journal-title":"Cryst. Growth Des."},{"key":"ref4\/cit4c","doi-asserted-by":"crossref","first-page":"770","DOI":"10.1139\/v11-011","volume":"89","author":"Abraham A.","year":"2011","journal-title":"Can. J. Chem."},{"key":"ref5\/cit5","doi-asserted-by":"crossref","first-page":"1572","DOI":"10.1107\/S0567740873005078","volume":"29","author":"Williams P. P.","year":"1973","journal-title":"Acta Crystallogr., Sect. B: Struct. Sci."},{"key":"ref6\/cit6","doi-asserted-by":"crossref","first-page":"577","DOI":"10.1023\/A:1018906320932","volume":"10","author":"Otsuka M.","year":"1993","journal-title":"Pharm. Res."},{"key":"ref7\/cit7a","unstructured":"aKuhnert-Brandst\u00e4tter, M.InWilson & Wilson\u2019s Comprehensive Analytical Chemistry;Wilson, C. L.; Wilson, D. W., Eds.Elsevier:Amsterdam, 1982; Vol.16, pp353\u2013358."},{"key":"ref7\/cit7b","volume-title":"Solid state chemistry of drugs","author":"Byrn S. R.","year":"1982"},{"key":"ref8\/cit8","doi-asserted-by":"crossref","first-page":"61","DOI":"10.1023\/B:JOCC.0000014690.32152.04","volume":"34","author":"Al-Saqqar S.","year":"2004","journal-title":"J. Chem. Crystallogr."},{"key":"ref9\/cit9","doi-asserted-by":"crossref","first-page":"17","DOI":"10.1016\/0040-6031(89)85159-7","volume":"147","author":"Chauvet A.","year":"1989","journal-title":"Thermochim. Acta"},{"key":"ref10\/cit10","doi-asserted-by":"crossref","first-page":"o2688","DOI":"10.1107\/S1600536810038651","volume":"66","author":"Gelbrich T.","year":"2010","journal-title":"Acta Crystallogr., Sect. E.: Struct Rep. Online"},{"key":"ref11\/cit11","unstructured":"Griesser, U. J.InPolymorphism in the Pharmaceutical Industry;Hilfiker, R., Ed.Wiley-VCH:Weinheim, 2006; pp211\u2013233."},{"key":"ref12\/cit12a","doi-asserted-by":"crossref","first-page":"9025","DOI":"10.1021\/ja00180a083","volume":"112","author":"Zerkowski J. A.","year":"1990","journal-title":"J. Am. Chem. Soc."},{"key":"ref12\/cit12b","doi-asserted-by":"crossref","first-page":"5473","DOI":"10.1021\/ja00039a096","volume":"114","author":"Zerkowski J. A.","year":"1992","journal-title":"J. Am. Chem. Soc."},{"key":"ref12\/cit12c","doi-asserted-by":"crossref","first-page":"4298","DOI":"10.1021\/ja00089a019","volume":"116","author":"Zerkowski J. A.","year":"1994","journal-title":"J. Am. Chem. Soc."},{"key":"ref12\/cit12d","doi-asserted-by":"crossref","first-page":"1250","DOI":"10.1021\/cm00044a024","volume":"6","author":"Zerkowski J. A.","year":"1994","journal-title":"Chem. Mater."},{"key":"ref12\/cit12e","doi-asserted-by":"crossref","first-page":"1830","DOI":"10.1039\/B204388B","author":"Vishweshwar P.","year":"2002","journal-title":"Chem. Commun."},{"key":"ref12\/cit12f","doi-asserted-by":"crossref","first-page":"417","DOI":"10.1021\/mp070014c","volume":"4","author":"Babu N. J.","year":"2007","journal-title":"Mol. Pharmaceutics"},{"key":"ref12\/cit12g","doi-asserted-by":"crossref","first-page":"623","DOI":"10.1107\/S0108768108026645","volume":"64","author":"Gryl M.","year":"2008","journal-title":"Acta Crystallogr., Sect. B: Struct. Sci."},{"key":"ref13\/cit13","doi-asserted-by":"crossref","first-page":"112","DOI":"10.1107\/S0108767307043930","volume":"64","author":"Sheldrick G. M.","year":"2008","journal-title":"Acta Crystallogr., Sect. A: Fundam. Crystallogr."},{"key":"ref14\/cit14a","doi-asserted-by":"crossref","first-page":"324","DOI":"10.1039\/b502484f","volume":"7","author":"Gelbrich T.","year":"2005","journal-title":"CrystEngComm"},{"key":"ref14\/cit14b","doi-asserted-by":"crossref","first-page":"5454","DOI":"10.1039\/c2ce25508a","volume":"14","author":"Gelbrich T.","year":"2012","journal-title":"CrystEngComm"},{"key":"ref15\/cit15a","doi-asserted-by":"crossref","first-page":"256","DOI":"10.1107\/S0108768189012929","volume":"46","author":"Etter M. C.","year":"1990","journal-title":"Acta Crystallogr., Sect. B: Struct. Sci."},{"key":"ref15\/cit15b","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."},{"key":"ref16\/cit16","doi-asserted-by":"crossref","first-page":"5502","DOI":"10.1039\/c1ce05430a","volume":"13","author":"Gelbrich T.","year":"2011","journal-title":"CrystEngComm"},{"key":"ref17\/cit17","doi-asserted-by":"crossref","first-page":"2494","DOI":"10.1039\/c2ce06659a","volume":"14","author":"Rossi D.","year":"2012","journal-title":"CrystEngComm"},{"key":"ref18\/cit18","doi-asserted-by":"crossref","first-page":"o421","DOI":"10.1107\/S0108270112039297","volume":"68","author":"Gelbrich T.","year":"2012","journal-title":"Acta Crystallogr., Sect. C: Cryst. Struct. Commun."},{"key":"ref19\/cit19","doi-asserted-by":"crossref","first-page":"1978","DOI":"10.1107\/S056774086900505X","volume":"25","author":"Craven B. M.","year":"1969","journal-title":"Acta Crystallogr., Sect. B: Struct. Sci."},{"key":"ref20\/cit20a","doi-asserted-by":"crossref","first-page":"979","DOI":"10.1021\/cg034209a","volume":"4","author":"Lewis T. C.","year":"2004","journal-title":"Cryst. Growth Des."},{"key":"ref20\/cit20b","doi-asserted-by":"crossref","first-page":"1337","DOI":"10.1107\/S0567740871003960","volume":"27","author":"Gatehouse B. M.","year":"1971","journal-title":"Acta Crystallogr., Sect. B: Struct. Sci."},{"key":"ref20\/cit20c","first-page":"969","author":"Bravic G.","year":"1968","journal-title":"C. R. Acad. Sci., Serie C: Sci. Chim."},{"key":"ref20\/cit20d","doi-asserted-by":"crossref","first-page":"o751","DOI":"10.1107\/S0108270107057174","volume":"63","author":"Gelbrich T.","year":"2007","journal-title":"Acta Crystallogr., Sect. C: Cryst. Struct. Commun."},{"key":"ref21\/cit21","doi-asserted-by":"crossref","first-page":"1693","DOI":"10.1039\/b612190j","volume":"9","author":"Day G. M.","year":"2007","journal-title":"Phys. Chem. Chem. Phys."},{"key":"ref22\/cit22","doi-asserted-by":"crossref","first-page":"1380","DOI":"10.1002\/jps.20940","volume":"96","author":"Othman A.","year":"2007","journal-title":"J. Pharm. Sci."},{"key":"ref23\/cit23","doi-asserted-by":"crossref","first-page":"435","DOI":"10.1016\/0079-6565(92)80004-Y","volume":"24","author":"Harris R. K.","year":"1992","journal-title":"Prog. NMR Spectrosc."},{"key":"ref24\/cit24","doi-asserted-by":"crossref","first-page":"58","DOI":"10.1016\/j.cplett.2009.05.031","volume":"475","author":"Hogg N. H. M.","year":"2009","journal-title":"Chem. Phys. Lett."},{"key":"ref25\/cit25","doi-asserted-by":"crossref","first-page":"631","DOI":"10.1021\/ar0201153","volume":"36","author":"Nassimbeni L. R.","year":"2003","journal-title":"Acc. Chem. Res."},{"key":"ref26\/cit26","doi-asserted-by":"crossref","first-page":"1054","DOI":"10.1021\/cg8008909","volume":"9","author":"Braun D. E.","year":"2009","journal-title":"Cryst. Growth Des."},{"key":"ref27\/cit27","volume-title":"Hansen Solubility Parameters, A Users Handbook","author":"Hansen C. M.","year":"2010","edition":"2"},{"key":"ref28\/cit28a","doi-asserted-by":"crossref","first-page":"19","DOI":"10.1021\/cg301506x","volume":"13","author":"Braun D. E.","year":"2013","journal-title":"Cryst. Growth Des."},{"key":"ref28\/cit28b","doi-asserted-by":"crossref","first-page":"3961","DOI":"10.1021\/jp211948q","volume":"116","author":"Braun D. E.","year":"2012","journal-title":"J. Phys. Chem. B"},{"key":"ref28\/cit28c","doi-asserted-by":"crossref","first-page":"5443","DOI":"10.1039\/C1CC10762C","volume":"47","author":"Braun D. E.","year":"2011","journal-title":"Chem. Commun."},{"key":"ref28\/cit28d","doi-asserted-by":"crossref","first-page":"210","DOI":"10.1021\/cg101162a","volume":"11","author":"Braun D. E.","year":"2011","journal-title":"Cryst. Growth Des."},{"key":"ref28\/cit28e","doi-asserted-by":"crossref","first-page":"2932","DOI":"10.1021\/cg300134z","volume":"12","author":"Bernardes C. E. S.","year":"2012","journal-title":"Cryst. Growth Des."},{"key":"ref28\/cit28f","doi-asserted-by":"crossref","first-page":"1977","DOI":"10.1021\/cg8000224","volume":"8","author":"Braun D. E.","year":"2008","journal-title":"Cryst. Growth Des."},{"key":"ref28\/cit28g","doi-asserted-by":"crossref","first-page":"1617","DOI":"10.1039\/b809219b","volume":"10","author":"Braun D. E.","year":"2008","journal-title":"CrystEngComm"}],"container-title":["The Journal of Physical Chemistry B"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/jp409201v","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,4,7]],"date-time":"2023-04-07T17:28:46Z","timestamp":1680888526000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/jp409201v"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2014,3,12]]},"references-count":51,"journal-issue":{"issue":"12","published-print":{"date-parts":[[2014,3,27]]}},"alternative-id":["10.1021\/jp409201v"],"URL":"https:\/\/doi.org\/10.1021\/jp409201v","relation":{},"ISSN":["1520-6106","1520-5207"],"issn-type":[{"value":"1520-6106","type":"print"},{"value":"1520-5207","type":"electronic"}],"subject":[],"published":{"date-parts":[[2014,3,12]]}}}