Crystallography Open Database

Information card for entry 7022067

7022066 << 7022067 >> 7022068

Preview

Coordinates	7022067.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C4 H44 Mo8 N4 O54 P V6
Calculated formula	C4 H16 Mo8 N4 O53.988 P V6
Title of publication	Transition metal-induced self-assembly of small molybdenum clusters.
Authors of publication	Zhang, Weisong; Gong, Jingjing; Zhang, Lili; Yang, Yanan; Liu, Yang; Zhang, Hengchao; Zhang, Guangju; Dong, Huan; Hu, Hailiang; Zhao, Fangfang; Kang, Zhenhui
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	5
Pages of publication	1760 - 1769
a	11.0987 ± 0.0006 Å
b	20.7513 ± 0.0011 Å
c	12.2034 ± 0.0006 Å
α	90°
β	116.917 ± 0.001°
γ	90°
Cell volume	2506.1 ± 0.2 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0695
Residual factor for significantly intense reflections	0.0596
Weighted residual factors for significantly intense reflections	0.1605
Weighted residual factors for all reflections included in the refinement	0.1711
Goodness-of-fit parameter for all reflections included in the refinement	1.109
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179925 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/20.	7022067.cif
89960	2013-11-17	cif/ Adding structures of 7022067, 7022068, 7022069, 7022070, 7022071, 7022072, 7022073, 7022074 via cif-deposit CGI script.	7022067.cif