Crystallography Open Database

Information card for entry 4132546

Preview

Coordinates	4132546.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C134.73 H109.04 N5.58 O35.58 S6 Tb6
Calculated formula	C134.728 H109.03 N5.5758 O35.576 S6 Tb6
Title of publication	Enriching the Reticular Chemistry Repertoire: Merged Nets Approach for the Rational Design of Intricate Mixed-Linker Metal-Organic Framework Platforms.
Authors of publication	Jiang, Hao; Jia, Jiangtao; Shkurenko, Aleksander; Chen, Zhijie; Adil, Karim; Belmabkhout, Youssef; Weselinski, Lukasz J.; Assen, Ayalew H.; Xue, Dong-Xu; O'Keeffe, Michael; Eddaoudi, Mohamed
Journal of publication	Journal of the American Chemical Society
Year of publication	2018
Journal volume	140
Journal issue	28
Pages of publication	8858 - 8867
a	45.6614 ± 0.0005 Å
b	45.6614 ± 0.0005 Å
c	45.6614 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	95202.4 ± 1.8 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 K
Number of distinct elements	6
Space group number	203
Hermann-Mauguin space group symbol	F d -3 :2
Hall space group symbol	-F 2uv 2vw 3
Residual factor for all reflections	0.0766
Residual factor for significantly intense reflections	0.0744
Weighted residual factors for significantly intense reflections	0.2086
Weighted residual factors for all reflections included in the refinement	0.2141
Goodness-of-fit parameter for all reflections included in the refinement	1.092
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
242512 (current)	2019-11-26	cif/ Adding structures of 4132546 via cif-deposit CGI script.	4132546.cif