title: Efficient pi-stacking with benzene provides 2D assembly of trans-[PtCl2(p-CF3C6H4CN)(2)]
metadata.name: dc.contributor.author
metadata.value: Ivanov, DM
metadata.lang: -
metadata.name: dc.contributor.author
metadata.value: Kirina, YV
metadata.lang: -
metadata.name: dc.contributor.author
metadata.value: Novikov, AS
metadata.lang: -
metadata.name: dc.contributor.author
metadata.value: Starova, GL
metadata.lang: -
metadata.name: dc.contributor.author
metadata.value: Kukushkin, VY
metadata.lang: -
metadata.name: dc.date.accessioned
metadata.value: 2016-04-07T16:35:33Z
metadata.lang: -
metadata.name: dc.date.available
metadata.value: 2016-04-07T16:35:33Z
metadata.lang: -
metadata.name: dc.date.issued
metadata.value: 2016
metadata.lang: -
metadata.name: dc.identifier.citation
metadata.value: Journal of Molecular Structure 1104 (2016) 19-23
metadata.lang: en_GB
metadata.name: dc.identifier.uri
metadata.value: http://hdl.handle.net/11701/1934
metadata.lang: -
metadata.name: dc.description.abstract
metadata.value: The new platinum(II) complex trans-[PtCl2(p-CF3C6H4CN)(2)], which was obtained upon treatment of [PtCl2(MeCN)(2)] with excess of p-CF3C6H4CN, co-crystallizes with benzene giving 2D layers formed by complex benzene and complex complex pi-stacking interactions. These interactions were detected by X-ray crystallography and their nature was analyzed by DFT calculations (M06 functional), including AIM analysis, inspection of NBO atomic charges, and evaluation of the vertical total energies for dissociation in the model supramolecular cluster. The crystal packing insignificantly effect the structure of the supramolecular associates and pi-stacking interactions are rather weak. (C) 2015 Elsevier B.V. All rights reserved.
metadata.lang: en_GB
metadata.name: dc.description.abstract
metadata.value: C1 [Ivanov, Daniil M.; Kirina, Yulia V.; Novikov, Alexander S.; Starova, Galina L.; Kukushkin, Vadim Yu.] St Petersburg State Univ, Inst Chem, St Petersburg 198504, Russia.
metadata.lang: en_GB
metadata.name: dc.title
metadata.value: Efficient pi-stacking with benzene provides 2D assembly of trans-[PtCl2(p-CF3C6H4CN)(2)]
metadata.lang: en_GB
resources.filename: file.txt
resources.url: https://dspace.spbu.ru/bitstream/11701/1934/1/file.txt
resources.format: Text
resources.size: 4 B