Structural insights into the polymorphism of bismuth(III) di-n-butyldithiocarbamate by X-ray diffraction, solid-state (13C/15N) CP-MAS NMR and DFT calculations

Vasantha Gowda,Bipul Sarma,Risto S. Laitinen,Anna-Carin Larsson,A. V. Ivanov,Dinu Iuga,Perttu Lantto,Oleg N. Antzutkin

Polyhedron（2017）

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摘要

The structures of two interconvertible crystalline polymorphs of the bismuth(III) di-n-butyldithiocarbamate complex are resolved by a combination of solid-state NMR, single crystal XRD and DFT modelling.

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关键词

Bismuth(III) di-n-butyldithiocarbamate,Polymorphism,Single-crystal X-ray structure,13C and 15N CP-MAS NMR,Density functional theory calculations

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