Crystallography Open Database

Information card for entry 7213946

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Coordinates	7213946.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C81 H66 Cd3 N12 O15
Calculated formula	C81 H60 Cd3 N12 O15
Title of publication	Syntheses, structures and luminescent properties of seven metal‒organic frameworks constructed with a rigid bis(imidazole) ligand and versatile carboxylate acids
Authors of publication	Guo, Huadong; Guo, Xianmin; Zou, Hengye; Qi, Yanjuan; Chen, Ruizhan
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	11
Pages of publication	2176
a	13.698 ± 0.005 Å
b	16.879 ± 0.005 Å
c	18.153 ± 0.005 Å
α	110.202 ± 0.005°
β	91.837 ± 0.005°
γ	109.065 ± 0.005°
Cell volume	3673 ± 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	0.0542
Residual factor for significantly intense reflections	0.0408
Weighted residual factors for significantly intense reflections	0.0942
Weighted residual factors for all reflections included in the refinement	0.1032
Goodness-of-fit parameter for all reflections included in the refinement	1.025
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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