Crystallography Open Database

Information card for entry 7221060

Preview

Coordinates	7221060.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H36 Cd6 I K N48 O12
Calculated formula	C60 H36 Cd6 I K N48 O12
Title of publication	Ion template effects of 4,5-dicyanoimidazole in the assembly of a series of 3D bimetallic coordination networks
Authors of publication	Zheng, Bao-Hua; Hao, Xue-Na; An, Bo; Qiao, Jin-Zhong; Hu, Tuo-Ping
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	32
Pages of publication	6103
a	20.7166 ± 0.0004 Å
b	20.7166 ± 0.0004 Å
c	20.7166 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	8891.1 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	7
Space group number	205
Hermann-Mauguin space group symbol	P a -3
Hall space group symbol	-P 2ac 2ab 3
Residual factor for all reflections	0.0278
Residual factor for significantly intense reflections	0.0203
Weighted residual factors for significantly intense reflections	0.0441
Weighted residual factors for all reflections included in the refinement	0.0479
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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