Crystallography Open Database

Information card for entry 7230962

Preview

Coordinates	7230962.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H44 Mo8 N14 Ni3 O42
Calculated formula	C18 H44 Mo8 N14 Ni3 O42
Title of publication	A series of new polyoxometalate-based metal‒organic complexes with different rigid pyridyl-bis(triazole) ligands: assembly, structures and electrochemical properties
Authors of publication	Wang, Xiuli; Bai, Xue; Lin, Hongyan; Sun, Junjun; Wang, Xiang; Liu, Guocheng
Journal of publication	RSC Advances
Year of publication	2018
Journal volume	8
Journal issue	40
Pages of publication	22676
a	10.881 ± 0.0004 Å
b	12.329 ± 0.0005 Å
c	12.458 ± 0.0005 Å
α	106.843 ± 0.001°
β	113.571 ± 0.001°
γ	102.689 ± 0.001°
Cell volume	1354.64 ± 0.09 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	0.0307
Residual factor for significantly intense reflections	0.0252
Weighted residual factors for significantly intense reflections	0.057
Weighted residual factors for all reflections included in the refinement	0.0594
Goodness-of-fit parameter for all reflections included in the refinement	1.029
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
208564 (current)	2018-06-20	cif/ Adding structures of 7230961, 7230962, 7230963, 7230964, 7230965 via cif-deposit CGI script.	7230962.cif