Crystallography Open Database

Information card for entry 7244024

Preview

Coordinates	7244024.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H34 Cr Cu Mo6 N7 O31
Calculated formula	C12 H34 Cr Cu Mo6 N7 O31
Title of publication	A series of POM-based compounds by tuning coordination groups and spacers of ligands: electrocatalytic, capacitive and photoelectrocatalytic properties
Authors of publication	Sun, Chenxi; Ying, Jun; Zhang, Yanping; Jin, Liang; Tian, Aixiang; Wang, Xiuli
Journal of publication	CrystEngComm
Year of publication	2022
Journal volume	24
Journal issue	3
Pages of publication	587 - 600
a	12.2348 ± 0.0007 Å
b	13.557 ± 0.0008 Å
c	13.8907 ± 0.0008 Å
α	110.677 ± 0.001°
β	110.381 ± 0.001°
γ	98.307 ± 0.001°
Cell volume	1924.4 ± 0.2 Å³
Cell temperature	296.15 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.064
Residual factor for significantly intense reflections	0.0381
Weighted residual factors for significantly intense reflections	0.0764
Weighted residual factors for all reflections included in the refinement	0.086
Goodness-of-fit parameter for all reflections included in the refinement	1.009
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
272635 (current)	2022-02-04	cif/ Updating files of 7244020, 7244021, 7244022, 7244023, 7244024, 7244025, 7244026 Original log message: Adding full bibliography for 7244020--7244026.cif.	7244024.cif
271280	2021-12-09	cif/ Adding structures of 7244020, 7244021, 7244022, 7244023, 7244024, 7244025, 7244026 via cif-deposit CGI script.	7244024.cif