Crystallography Open Database

Information card for entry 4130919

Preview

Coordinates	4130919.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H18 Cl3 Co2 In3 N12 O16
Calculated formula	C30 H18 Cl3.24 Co2 In3 N12 O15.76
Title of publication	Multivariable Modular Design of Pore Space Partition.
Authors of publication	Zhao, Xiang; Bu, Xianhui; Nguyen, Edward T.; Zhai, Quan-Guo; Mao, Chengyu; Feng, Pingyun
Journal of publication	Journal of the American Chemical Society
Year of publication	2016
Journal volume	138
Journal issue	46
Pages of publication	15102 - 15105
a	13.9818 ± 0.0002 Å
b	13.9818 ± 0.0002 Å
c	18.3209 ± 0.0003 Å
α	90°
β	90°
γ	120°
Cell volume	3101.73 ± 0.08 Å³
Cell temperature	174 ± 2 K
Ambient diffraction temperature	174 ± 2 K
Number of distinct elements	7
Space group number	194
Hermann-Mauguin space group symbol	P 63/m m c
Hall space group symbol	-P 6c 2c
Residual factor for all reflections	0.0615
Residual factor for significantly intense reflections	0.0498
Weighted residual factors for significantly intense reflections	0.1489
Weighted residual factors for all reflections included in the refinement	0.1539
Goodness-of-fit parameter for all reflections included in the refinement	1.192
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Duplicate of	4130918
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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