Crystallography Open Database

Information card for entry 7227155

Preview

Coordinates	7227155.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C72 H72 N12 Ni2 O24 V4
Calculated formula	C72 H48 N12 Ni2 O24 V4
Title of publication	Preparation, structure and characterization of a series of vanadates
Authors of publication	Guo, Hai-Yang; Zhang, Ting-Ting; Lin, Po-Han; Xiao-Zhang, Xiao-Zhang; Cui, Xiao-Bing; Huo, Qi-Sheng; Xu, Ji-Qing
Journal of publication	CrystEngComm
Year of publication	2017
Journal volume	19
Journal issue	2
Pages of publication	265
a	12.18 ± 0.0007 Å
b	13.5592 ± 0.0008 Å
c	13.8287 ± 0.0007 Å
α	85.204 ± 0.004°
β	65.431 ± 0.005°
γ	75.508 ± 0.005°
Cell volume	2010.4 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0649
Residual factor for significantly intense reflections	0.0518
Weighted residual factors for significantly intense reflections	0.1557
Weighted residual factors for all reflections included in the refinement	0.1682
Goodness-of-fit parameter for all reflections included in the refinement	1.021
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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