Crystallography Open Database

Information card for entry 7007134

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Coordinates	7007134.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H12 Cu2 N8 S2
Calculated formula	C20 H12 Cu2 N8 S2
Title of publication	Syntheses of supramolecular CuCN complexes by decomposing CuSCN: a general route to CuCN coordination polymers?
Authors of publication	Zhou, Xiao-Ping; Li, Dan; Wu, Tao; Zhang, Xuanjun
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2006
Journal issue	20
Pages of publication	2435 - 2443
a	3.814 ± 0.003 Å
b	16.187 ± 0.011 Å
c	17.468 ± 0.012 Å
α	113.292 ± 0.01°
β	92.875 ± 0.012°
γ	95.627 ± 0.011°
Cell volume	981.1 ± 1.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0803
Residual factor for significantly intense reflections	0.0614
Weighted residual factors for significantly intense reflections	0.1507
Weighted residual factors for all reflections included in the refinement	0.1717
Goodness-of-fit parameter for all reflections included in the refinement	1.166
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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