Crystallography Open Database

Information card for entry 7134474

Preview

Coordinates	7134474.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C70 H100 Cl2 Ga2 N2
Calculated formula	C70 H100 Cl2 Ga2 N2
Title of publication	Isolable GaN-based analogues of Thiele's and Chichibabin's hydrocarbons
Authors of publication	Jiang, Yuqi; Pan, Guo; Zhou, Ren; Huang, Ruihao; Ran, Dongmei; Xu, Daqian; Su, Yuanting
Journal of publication	Chemical Communications
Year of publication	2025
Journal volume	61
Journal issue	45
Pages of publication	8192 - 8195
a	18.6669 ± 0.0006 Å
b	18.6669 ± 0.0006 Å
c	39.267 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	13682.7 ± 1.2 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 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	0.1027
Residual factor for significantly intense reflections	0.0745
Weighted residual factors for significantly intense reflections	0.1927
Weighted residual factors for all reflections included in the refinement	0.2155
Goodness-of-fit parameter for all reflections included in the refinement	1.055
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
300516 (current)	2025-07-06	cif/ Updating files of 7134471, 7134472, 7134473, 7134474 Original log message: Adding full bibliography for 7134471--7134474.cif.	7134474.cif
299446	2025-04-30	cif/ Adding structures of 7134471, 7134472, 7134473, 7134474 via cif-deposit CGI script.	7134474.cif