Crystallography Open Database

Information card for entry 7235755

Preview

Coordinates	7235755.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H12 N28 O2 Pb2
Calculated formula	C12 H12 N28 O2 Pb2
Title of publication	High-energy-density materials with remarkable thermostability and insensitivity: syntheses, structures and physicochemical properties of Pb(ii) compounds with 3-(tetrazol-5-yl) triazole
Authors of publication	Gao, Wenjuan; Liu, Xiangyu; Su, Zhiyong; Zhang, Sheng; Yang, Qi; Wei, Qing; Chen, Sanping; Xie, Gang; Yang, Xuwu; Gao, Shengli
Journal of publication	Journal of Materials Chemistry A
Year of publication	2014
Journal volume	2
Journal issue	30
Pages of publication	11958
a	13.8054 ± 0.0014 Å
b	13.8054 ± 0.0014 Å
c	27.53 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	5246.9 ± 1.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.0368
Residual factor for significantly intense reflections	0.0298
Weighted residual factors for significantly intense reflections	0.0611
Weighted residual factors for all reflections included in the refinement	0.0633
Goodness-of-fit parameter for all reflections included in the refinement	0.903
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
233296 (current)	2019-11-23	cif/ Adding structures of 7235755, 7235756 via cif-deposit CGI script.	7235755.cif