Crystallography Open Database

Information card for entry 7246793

Preview

Coordinates	7246793.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C H N O P Zn
Calculated formula	C1.2 H5.6 N0.8 O3.2 P0.8 Zn0.4
Title of publication	The proton conduction behavior of two 1D open-framework metal phosphates with similar crystal structures and different hydrogen bond networks
Authors of publication	Zhang, Kai-ming; Ji, Min-fang; Zhou, Xue-Yi; Xuan, Fang; Duan, Bo-yuan; Yuan, Yuan; Liu, Guang-xiang; Duan, Hai-bao; Zhao, Hai-rong
Journal of publication	RSC Advances
Year of publication	2023
Journal volume	13
Journal issue	19
Pages of publication	12703 - 12711
a	5.222 ± 0.0012 Å
b	12.756 ± 0.004 Å
c	15.674 ± 0.006 Å
α	90°
β	90°
γ	90°
Cell volume	1044.1 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0268
Residual factor for significantly intense reflections	0.0221
Weighted residual factors for all reflections	0.0572
Weighted residual factors for significantly intense reflections	0.0553
Goodness-of-fit parameter for all reflections	1.102
Goodness-of-fit parameter for significantly intense reflections	1.085
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
283802 (current)	2023-05-16	cif/ Adding structures of 7246793, 7246794, 7246795, 7246796 via cif-deposit CGI script.	7246793.cif