Crystallography Open Database

Information card for entry 7239504

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Coordinates	7239504.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C128 H114 Cl2 N42 O8 Zn9
Calculated formula	C128 H114 Cl2 N42 O8 Zn9
Title of publication	Bottom-up assembly of a porous MOF based on nanosized nonanuclear zinc precursors for highly selective gas adsorption
Authors of publication	Li, Yun-Wu; He, Kun-Huan; Bu, Xian-He
Journal of publication	Journal of Materials Chemistry A
Year of publication	2013
Journal volume	1
Journal issue	13
Pages of publication	4186
a	48.197 ± 0.01 Å
b	17.145 ± 0.003 Å
c	27.248 ± 0.005 Å
α	90°
β	117.37 ± 0.03°
γ	90°
Cell volume	19996 ± 9 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1141
Residual factor for significantly intense reflections	0.0647
Weighted residual factors for significantly intense reflections	0.1609
Weighted residual factors for all reflections included in the refinement	0.1834
Goodness-of-fit parameter for all reflections included in the refinement	1.001
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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