Crystallography Open Database

Information card for entry 4309823

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Coordinates	4309823.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H14 Cu2 N7 S3
Calculated formula	C23 H14 Cu2 N7 S3
Title of publication	Ligand-Controlled Mixed-Valence Copper Rectangular Grid-Type Coordination Polymers Based on Pyridylterpyridine
Authors of publication	Lei Hou; Dan Li; Wen-Juan Shi; Ye-Gao Yin; Seik Weng Ng
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	7825 - 7832
a	8.2121 ± 0.0005 Å
b	11.8356 ± 0.0008 Å
c	13.4445 ± 0.0009 Å
α	71.227 ± 0.001°
β	88.312 ± 0.001°
γ	73.112 ± 0.001°
Cell volume	1180.91 ± 0.13 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	0.055
Residual factor for significantly intense reflections	0.043
Weighted residual factors for significantly intense reflections	0.11
Weighted residual factors for all reflections included in the refinement	0.122
Goodness-of-fit parameter for all reflections included in the refinement	1.04
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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