Crystallography Open Database

Information card for entry 1561735

Preview

Coordinates	1561735.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H36 Cu3 Mo N3 O S3
Calculated formula	C18 H36 Cu3 Mo N3 O S3
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	11.482 ± 0.002 Å
b	15.535 ± 0.003 Å
c	15.861 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	2829.2 ± 0.9 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0471
Residual factor for significantly intense reflections	0.0447
Weighted residual factors for significantly intense reflections	0.1006
Weighted residual factors for all reflections included in the refinement	0.1032
Goodness-of-fit parameter for all reflections included in the refinement	1.05
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.	1561735.cif