Crystallography Open Database





Information card for 7205748

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Coordinates

7205748.cif

Structure parameters

Formula - C40 H155 N30 Ni4 O95 P V36 -
Calculated formula - C40 H154 N30 Ni4 O95 P V36 -
Title of publication {[VIV14VV4O42(H2O)][Ni(C4N3H13)(C4N3H14)]4(H2O)6}4+: a novel nanosized calix-type polyoxovanadate cation
Authors of publication Zhang, Zhibin; Xu, Yan; Zheng, Lei; Zhu, Dunru; Song, You
Journal of publication CrystEngComm
Year of publication 2011
Journal volume 13
Journal issue 7
Pages of publication 2191
a 18.8231 ± 0.0007 Å
b 18.8231 ± 0.0007 Å
c 20.332 ± 0.0015 Å
α 90°
β 90°
γ 90°
Cell volume 7203.8 ± 0.7 Å3
Cell temperature 196 ± 2 K
Ambient diffraction temperature 196 ± 2 K
Number of distinct elements 7
Hermann-Mauguin symmetry space group P 4/n :2
Hall symmetry space group -P 4a
Residual factor for all reflections 0.1037
Residual factor for observed reflections 0.0698
Weighted residual factors for the observed reflections 0.1932
Weighted residual factors for all reflections included in the refinement 0.2045
Goodness-of-fit parameter for observed reflections 1.104
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder Yes
Has Fobs No

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