Crystallography Open Database

Information card for entry 7221660

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Coordinates	7221660.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C240 H232 Cd12 N48 O56
Calculated formula	C240 H232 Cd12 N48 O56
Title of publication	Metal-controlled structural variations of coordination architectures constructed from flexible 1H-benzimidazole-1-propionic acid
Authors of publication	Zhang, Zhong; Feng, Yan-Fang; Wei, Qiu-Yu; Hu, Kun; Chen, Zi-Lu; Liang, Fu-Pei
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	35
Pages of publication	6724
a	27.288 ± 0.004 Å
b	27.288 ± 0.004 Å
c	32.044 ± 0.006 Å
α	90°
β	90°
γ	120°
Cell volume	20664 ± 6 Å³
Cell temperature	294 ± 2 K
Ambient diffraction temperature	294 ± 2 K
Number of distinct elements	5
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.0509
Residual factor for significantly intense reflections	0.0421
Weighted residual factors for significantly intense reflections	0.1055
Weighted residual factors for all reflections included in the refinement	0.1069
Goodness-of-fit parameter for all reflections included in the refinement	1.091
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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