Crystallography Open Database

Information card for entry 7214159

Preview

Coordinates	7214159.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H13 Cu O8.5 S
Calculated formula	C14 H8 Cu O7 S
Title of publication	Seven dicarboxylate-based coordination polymers with structural varieties and different solvent resistance properties derived from the introduction of small organic linkers
Authors of publication	Huang, Chao; Ji, Feixiang; Liu, Lu; Li, Na; Li, Haofei; Wu, Jie; Hou, Hongwei; Fan, Yaoting
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	13
Pages of publication	2615
a	12.248 ± 0.002 Å
b	22.262 ± 0.005 Å
c	7.1435 ± 0.0014 Å
α	90°
β	124.47 ± 0.03°
γ	90°
Cell volume	1605.8 ± 0.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0468
Residual factor for significantly intense reflections	0.0409
Weighted residual factors for significantly intense reflections	0.095
Weighted residual factors for all reflections included in the refinement	0.0987
Goodness-of-fit parameter for all reflections included in the refinement	1.07
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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