Crystallography Open Database

Information card for entry 1561733

Preview

Coordinates	1561733.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H28 Cu3 N3 O S3 W
Calculated formula	C14 H28 Cu3 N3 O S3 W
Title of publication	Single cyanide-bridged Mo(W)/S/Cu cluster-based coordination polymers: Reactant- and stoichiometry-dependent syntheses, effective photocatalytic properties
Authors of publication	Zhang, Jinfang; Wang, Chao; Wang, Yinlin; Chen, Weitao; Cifuentes, Marie P.; Humphrey, Mark G.; Zhang, Chi
Journal of publication	Journal of Solid State Chemistry
Year of publication	2015
Journal volume	231
Pages of publication	230 - 238
a	11.869 ± 0.002 Å
b	15.672 ± 0.003 Å
c	26.173 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	4868.5 ± 1.6 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
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	0.0653
Residual factor for significantly intense reflections	0.0543
Weighted residual factors for significantly intense reflections	0.1108
Weighted residual factors for all reflections included in the refinement	0.1164
Goodness-of-fit parameter for all reflections included in the refinement	1.197
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
264131 (current)	2021-04-14	cif/ Adding structures of 1561731, 1561732, 1561733, 1561734, 1561735 via cif-deposit CGI script.	1561733.cif