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A second solvatomorph of poly[[μ₄-N,N'-(1,3,5-oxadiazinane-3,5-di-yl)bis-(carbamoyl-methano-ato)]nickel(II)dipotassium]: crystal structure, Hirshfeld surface analysis and semi-empirical geometry optimization.

ABSTRACT: The title compound, poly[tri-aqua-bis-[μ₄-N,N'-(1,3,5-oxadiazinane-3,5-di-yl)bis(carbamoyl-methano-ato)]dinickel(II)tetra-potassium], [K₄Ni₂(C₇H₆N₄O₇)₂(H₂O)₃] _n , is a second solvatomorph of poly[(μ₄-N,N'-(1,3,5-oxadiazinane-3,5-di-yl)bis-(carbamoyl-methano-ato)nickel(II)dipotassium] reported previously [Plutenko et al. (2021 ▸). Acta Cryst. E77, 298-304]. The asymmetric unit of the title compound includes two structurally independent complex anions [Ni(C₇H₆N₄O₇)]^2-, which exhibit an L-shaped geometry and consist of two almost flat fragments perpendic

SUBMITTER: Plutenko MO

PROVIDER: S-EPMC8647735 | biostudies-literature | 2021 Dec

REPOSITORIES: biostudies-literature

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A second solvatomorph of poly[[μ₄-N,N'-(1,3,5-oxadiazinane-3,5-di-yl)bis-(carbamoyl-methano-ato)]nickel(II)dipotassium]: crystal structure, Hirshfeld surface analysis and semi-empirical geometry optimization.

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A second solvatomorph of poly[[μ4-N,N'-(1,3,5-oxadiazinane-3,5-di-yl)bis-(carbamoyl-methano-ato)]nickel(II)dipotassium]: crystal structure, Hirshfeld surface analysis and semi-empirical geometry optimization.

OmicsDI is part of the ELIXIR infrastructure

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A second solvatomorph of poly[[μ₄-N,N'-(1,3,5-oxadiazinane-3,5-di-yl)bis-(carbamoyl-methano-ato)]nickel(II)dipotassium]: crystal structure, Hirshfeld surface analysis and semi-empirical geometry optimization.