Analyses of supramolecular interactions present in a coordination polymer of Mn(II) with 2-picolinate and 4,4′-Azobis(pyridine)

Seth, Piya; Frontera Beccaria, Antonio; Ghosh, Ashutosh; Bauzá Riera, Antonio

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dc.contributor.author	Seth, Piya
dc.contributor.author	Frontera Beccaria, Antonio
dc.contributor.author	Ghosh, Ashutosh
dc.contributor.author	Bauzá Riera, Antonio
dc.date.accessioned	2018-09-21T10:12:34Z
dc.identifier.uri	http://hdl.handle.net/11201/147575
dc.description.abstract	[eng]A new 2D coordination polymer [MnII(pic)(4,4′ -azpy)(H2O)]ClO4·EtOH (pic = 2-picolinate) has been synthesized where each of the octahedral Mn(II) center is connected by trans coordinating 4,4′-azpy and syn-anti bridging picolinate, resulting in a sheet like structure. Density functional theory (DFT) calculations, at the BLYP-D3/def2-TZVPD level of theory, are performed to explore the interplay of various supramolecular interactions present within the coordination polymer.
dc.format	application/pdf
dc.relation.isformatof	Versió postprint del document publicat a: https://doi.org/10.1016/j.inoche.2013.12.015
dc.relation.ispartof	Inorganic Chemistry Communications, 2014, vol. 41, p. 1-5
dc.subject.classification	54 - Química
dc.subject.other	54 - Chemistry. Crystallography. Mineralogy
dc.title	Analyses of supramolecular interactions present in a coordination polymer of Mn(II) with 2-picolinate and 4,4′-Azobis(pyridine)
dc.type	info:eu-repo/semantics/article
dc.type	info:eu-repo/semantics/acceptedVersion
dc.date.updated	2018-09-21T10:12:34Z
dc.date.embargoEndDate	info:eu-repo/date/embargoEnd/2075-01-01
dc.embargo	2075-01-01
dc.rights.accessRights	info:eu-repo/semantics/embargoedAccess
dc.identifier.doi	https://doi.org/10.1016/j.inoche.2013.12.015