Crystallography Open Database

Information card for entry 4348062

Preview

Coordinates	4348062.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	SCU-6
Formula	C31 H29 N3 O14 U2
Calculated formula	C31 H28 N3 O14 U2
Title of publication	First Cationic Uranyl-Organic Framework with Anion-Exchange Capabilities.
Authors of publication	Bai, Zhuanling; Wang, Yanlong; Li, Yuxiang; Liu, Wei; Chen, Lanhua; Sheng, Daopeng; Diwu, Juan; Chai, Zhifang; Albrecht-Schmitt, Thomas E; Wang, Shuao
Journal of publication	Inorganic chemistry
Year of publication	2016
Journal volume	55
Journal issue	13
Pages of publication	6358 - 6360
a	11.5033 ± 0.0013 Å
b	11.7686 ± 0.0012 Å
c	13.3628 ± 0.0014 Å
α	86.074 ± 0.004°
β	77.548 ± 0.004°
γ	77.848 ± 0.003°
Cell volume	1726.4 ± 0.3 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0412
Residual factor for significantly intense reflections	0.0339
Weighted residual factors for significantly intense reflections	0.1026
Weighted residual factors for all reflections included in the refinement	0.112
Goodness-of-fit parameter for all reflections included in the refinement	0.804
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
232717 (current)	2019-11-23	cif/ Adding structures of 4348062, 4348063 via cif-deposit CGI script.	4348062.cif