Crystallography Open Database

Information card for entry 4120118

4120117 << 4120118 >> 4120119

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Coordinates	4120118.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C63 H51 Co2 In3 N6 O37
Calculated formula	C63 H51 Co2 In3 N6 O37
Title of publication	Entrapment of Metal Clusters in Metal-Organic Framework Channels by Extended Hooks Anchored at Open Metal Sites
Authors of publication	Shou-Tian Zheng; Xiang Zhao; Samuel Lau; Addis Fuhr; Pingyun Feng; Xianhui Bu
Journal of publication	Journal of the American Chemical Society
Year of publication	2013
Journal volume	135
Pages of publication	10270 - 10273
a	18.1997 ± 0.0008 Å
b	18.1997 ± 0.0008 Å
c	20.0204 ± 0.001 Å
α	90°
β	90°
γ	120°
Cell volume	5742.9 ± 0.5 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	190
Hermann-Mauguin space group symbol	P -6 2 c
Hall space group symbol	P -6c -2c
Residual factor for all reflections	0.0567
Residual factor for significantly intense reflections	0.038
Weighted residual factors for significantly intense reflections	0.0979
Weighted residual factors for all reflections included in the refinement	0.1039
Goodness-of-fit parameter for all reflections included in the refinement	0.943
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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