Crystallography Open Database

Information card for entry 7224780

Preview

Coordinates	7224780.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H38 Mo8 N8 O35
Calculated formula	C40 H38 Mo8 N8 O35
Title of publication	Engineering the proton conductivity of metal‒organic hybrid materials by varying the coordination mode of the ligand
Authors of publication	Liu, Bai-Ling; Zang, Hong-Ying; Tan, Hua-Qiao; Wang, Yong-Hui; Li, Yang-Guang
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	18
Pages of publication	3300
a	7.3598 ± 0.0015 Å
b	14.818 ± 0.003 Å
c	26.434 ± 0.005 Å
α	90°
β	94.94 ± 0.03°
γ	90°
Cell volume	2872.1 ± 1 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0623
Residual factor for significantly intense reflections	0.0417
Weighted residual factors for significantly intense reflections	0.0957
Weighted residual factors for all reflections included in the refinement	0.1024
Goodness-of-fit parameter for all reflections included in the refinement	0.945
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
182637 (current)	2016-05-06	cif/ Updating files of 7224779, 7224780 Original log message: Adding full bibliography for 7224779--7224780.cif.	7224780.cif
180697	2016-04-02	cif/ Adding structures of 7224779, 7224780 via cif-deposit CGI script.	7224780.cif