Crystallography Open Database

Information card for entry 7059525

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Coordinates	7059525.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H34 Cu2 N8 O15
Calculated formula	C48 H34 Cu2 N8 O15
Title of publication	Proton conduction in two Cu/Zn dimer-based hydrogen-bonded supramolecular frameworks from imidazole multi-carboxylate
Authors of publication	Wang, Qingxu; Ye, Zhejun; Shi, Guoqing; Guo, Kaimeng; Li, Gang
Journal of publication	New Journal of Chemistry
Year of publication	2020
Journal volume	44
Journal issue	19
Pages of publication	8098 - 8105
a	9.7608 ± 0.0007 Å
b	11.4406 ± 0.0008 Å
c	11.5187 ± 0.0008 Å
α	96.599 ± 0.006°
β	107.619 ± 0.006°
γ	113.073 ± 0.007°
Cell volume	1087.14 ± 0.16 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	0.0537
Residual factor for significantly intense reflections	0.0429
Weighted residual factors for significantly intense reflections	0.1163
Weighted residual factors for all reflections included in the refinement	0.1262
Goodness-of-fit parameter for all reflections included in the refinement	1.023
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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