Crystallography Open Database

Information card for entry 2012070

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Structure parameters

Formula	C30 H33 N6 Ni2 O16.5 V4
Calculated formula	C30 H24 N6 Ni2 O16.5 V4
Title of publication	A three-dimensional inorganic/organic hybrid material, [Ni~2~(4,4'-bipy)~3~(H~2~O)~2~V~4~O~12~]·2.5H~2~O
Authors of publication	Yang, Lan; Hu, Changwen; Naruke, Haruo; Yamase, Toshihiro
Journal of publication	Acta Crystallographica Section C
Year of publication	2001
Journal volume	57
Journal issue	7
Pages of publication	799 - 801
a	30.3799 ± 0.0009 Å
b	11.2402 ± 0.0003 Å
c	11.5366 ± 0.0003 Å
α	90°
β	105.961 ± 0.001°
γ	90°
Cell volume	3787.6 ± 0.18 Å³
Cell temperature	173.2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for significantly intense reflections	0.0422
Weighted residual factors for all reflections included in the refinement	0.1141
Goodness-of-fit parameter for all reflections included in the refinement	1.399
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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