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dc.contributor.authorBloomfield, Hannah R.
dc.contributor.authorRitch, Jamie S.
dc.date.accessioned2019-10-30T20:53:02Z
dc.date.available2019-10-30T20:53:02Z
dc.date.issued2019-11
dc.identifier.citationBloomfield, H. R.; Ritch, J. S. Acta Cryst. (2019). C75, 1471–1474en_US
dc.identifier.issn2053-2296
dc.identifier.urihttp://hdl.handle.net/10680/1743
dc.description.abstractA second polymorph of phenylselenium trichloride, PhSeCl3 or C6H5Cl3Se, is disclosed, which is comprised of asymmetric chlorine-bridged noncovalent dimer units rather than polymeric chains. These dimers are each weakly bound to an adjacent dimer through noncovalent Se...Cl bonding interactions. Phenyl rings within each dimer are oriented in a syn fashion. Density functional theory (DFT) calculations reveal that the putative anti isomer is within 5 kJ mol-1 of the experimentally observed form. This structure represents the first additional polymorph discovered for an organoselenium trihalide compound.en_US
dc.description.urihttps://doi.org/10.1107/S2053229619013019en_US
dc.language.isoenen_US
dc.publisherInternational Union of Crystallographyen_US
dc.rightsinfo:eu-repo/semantics/openAccessen_US
dc.subjectselenium compounden_US
dc.subjectpolymorphen_US
dc.subjectphenylselenium trichlorideen_US
dc.subjectcrystal structureen_US
dc.subjectchalcogen-halogen interactionen_US
dc.subjectchemistryen_US
dc.subjectcrystallographyen_US
dc.titleA new polymorph of phenylselenium trichlorideen_US
dc.typeArticleen_US
dc.rights.licenseAuthor(s) of this article may load this reprint on their own web site or institutional repository provided that this cover page is retained. Republication of this article or its storage in electronic databases other than as specified above is not permitted without prior permission in writing from the IUCr.en_US
dc.identifier.doi10.1107/S2053229619013019en_US


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