Crystallography Open Database

Information card for entry 4503973

Preview

Coordinates	4503973.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H48 Br2 Cu3 N4 O S3 W
Calculated formula	C31 H48 Br2 Cu3 N4 O S3 W
Title of publication	Novel Cluster Coordination Polymers Based on Tetranuclear Nest-Shaped [WOS3Cu3] Heterothiometallitic Secondary Building Units and 4,4'-Bipyridine Ligand
Authors of publication	Liang, Kai; Zheng, He-Gen; Song, Ying-Lin; Li, Yi-Zhi; Xin, Xin-Quan
Journal of publication	Crystal Growth & Design
Year of publication	2007
Journal volume	7
Journal issue	2
Pages of publication	373 - 376
a	9.843 ± 0.001 Å
b	12.974 ± 0.001 Å
c	17.362 ± 0.002 Å
α	97.65 ± 0.01°
β	101.5 ± 0.01°
γ	108.65 ± 0.01°
Cell volume	2011.8 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0548
Residual factor for significantly intense reflections	0.0348
Weighted residual factors for significantly intense reflections	0.0638
Weighted residual factors for all reflections included in the refinement	0.0674
Goodness-of-fit parameter for all reflections included in the refinement	0.949
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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