Crystallography Open Database

Information card for entry 1546852

Preview

Coordinates	1546852.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H20 Cl2 Cu N8 O10
Calculated formula	C32 H20 Cl2 Cu N8 O10
Title of publication	Self-assembly of new M( <scp>ii</scp> ) coordination polymers based on asymmetric 1,3,4-oxadiazole-containing ligands: effect of counterions and magnetic properties
Authors of publication	Wu, Xiang-Wen; Pan, Feng; Zhang, Dong; Jin, Guo-Xia; Ma, Jian-Ping
Journal of publication	CrystEngComm
Year of publication	2017
Journal volume	19
Journal issue	39
Pages of publication	5864 - 5872
a	30.6123 ± 0.001 Å
b	30.6123 ± 0.001 Å
c	29.4707 ± 0.0012 Å
α	90°
β	90°
γ	120°
Cell volume	23917.3 ± 1.5 Å³
Cell temperature	108 ± 11 K
Ambient diffraction temperature	108 ± 11 K
Number of distinct elements	6
Space group number	148
Hermann-Mauguin space group symbol	R -3
Hall space group symbol	-R 3
Residual factor for all reflections	0.1369
Residual factor for significantly intense reflections	0.1114
Weighted residual factors for significantly intense reflections	0.3184
Weighted residual factors for all reflections included in the refinement	0.3363
Goodness-of-fit parameter for all reflections included in the refinement	1.095
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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