Crystallography Open Database

Information card for entry 4517487

Preview

Coordinates	4517487.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H16 Cl Cu12 Mo12 N24 O42 P V2
Calculated formula	C16 H16 Cl Cu12 Mo12 N24 O42 P V2
Title of publication	Ternary Cross-Vanadium Tetra-Capped POMOFs@PPy/RGO Nanocomposites with Hybrid Battery-Supercapacitor Behavior for Enhancing Lithium Battery Storage
Authors of publication	Yang, Xiya; Sha, Jingquan; Li, Wenjing; Tan, Zenglong; Hou, Liran; Jiang, Jianzhuang
Journal of publication	ACS Sustainable Chemistry & Engineering
Year of publication	2020
Journal volume	8
Journal issue	11
Pages of publication	4667 - 4675
a	14.5374 ± 0.0008 Å
b	14.5374 ± 0.0008 Å
c	29.782 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	6294 ± 0.8 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	9
Space group number	92
Hermann-Mauguin space group symbol	P 41 21 2
Hall space group symbol	P 4abw 2nw
Residual factor for all reflections	0.108
Residual factor for significantly intense reflections	0.0947
Weighted residual factors for significantly intense reflections	0.2358
Weighted residual factors for all reflections included in the refinement	0.245
Goodness-of-fit parameter for all reflections included in the refinement	1.116
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
257094 (current)	2020-10-04	cif/ Updating files of 4517486, 4517487 Original log message: Adding full bibliography for 4517486--4517487.cif.	4517487.cif
250048	2020-04-04	cif/ Updating files of 4517486, 4517487 Original log message: Adding full bibliography for 4517486--4517487.cif.	4517487.cif
249234	2020-03-11	cif/ Adding structures of 4517486, 4517487 via cif-deposit CGI script.	4517487.cif