Crystallography Open Database

Information card for entry 4131667

Preview

Coordinates	4131667.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C228 H138 N36 O65 Zn20
Calculated formula	C228 H138 N36 O65 Zn20
Title of publication	Engineering of Pore Geometry for Ultrahigh Capacity Methane Storage in Mesoporous Metal-Organic Frameworks.
Authors of publication	Liang, Cong-Cong; Shi, Zhao-Lin; He, Chun-Ting; Tan, Jing; Zhou, Hu-Die; Zhou, Hao-Long; Lee, Yongjin; Zhang, Yue-Biao
Journal of publication	Journal of the American Chemical Society
Year of publication	2017
Journal volume	139
Journal issue	38
Pages of publication	13300 - 13303
a	77.569 ± 0.009 Å
b	77.569 ± 0.009 Å
c	77.569 ± 0.009 Å
α	90°
β	90°
γ	90°
Cell volume	466729 ± 9 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	209
Hermann-Mauguin space group symbol	F 4 3 2
Hall space group symbol	F 4 2 3
Residual factor for all reflections	0.0572
Residual factor for significantly intense reflections	0.0345
Weighted residual factors for significantly intense reflections	0.0817
Weighted residual factors for all reflections included in the refinement	0.0901
Goodness-of-fit parameter for all reflections included in the refinement	0.966
Diffraction radiation wavelength	0.8265 Å
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4131667.html