Crystallography Open Database

Information card for entry 7211789

Preview

Coordinates	7211789.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H75 Mo8 N10 Ni2 O48 P V6
Calculated formula	C60 H32 Mo8 N10 Ni2 O48 P V6
Title of publication	0D and 1D dimensional structures based on the combination of polyoxometalates, transition metal coordination complexes and organic amines
Authors of publication	Shi, Shu-Yun; Zou, Yong-Cun; Cui, Xiao-Bing; Xu, Jia-Ning; Wang, Yan; Wang, Guo-Wu; Yang, Guang-Di; Xu, Ji-Qing; Wang, Tie-Gang; Gao, Zhong-Min
Journal of publication	CrystEngComm
Year of publication	2010
Journal volume	12
Journal issue	7
Pages of publication	2122
a	19.809 ± 0.004 Å
b	16.058 ± 0.003 Å
c	28.211 ± 0.006 Å
α	90°
β	90°
γ	90°
Cell volume	8974 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	8
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0725
Residual factor for significantly intense reflections	0.0521
Weighted residual factors for significantly intense reflections	0.1349
Weighted residual factors for all reflections included in the refinement	0.1501
Goodness-of-fit parameter for all reflections included in the refinement	1.061
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180448 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/17.	7211789.cif
92377	2014-01-12	cif/ Adding structures of 7211788, 7211789, 7211790, 7211791, 7211792 via cif-deposit CGI script.	7211789.cif