Crystallography Open Database

Information card for entry 7134471

Preview

Coordinates	7134471.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H54.6 Br0.38 Cl0.62 Ga N
Calculated formula	C35 H55 Br0.381 Cl0.619 Ga N
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	32.7341 ± 0.0019 Å
b	23.0166 ± 0.0013 Å
c	9.2046 ± 0.0006 Å
α	90°
β	92.844 ± 0.002°
γ	90°
Cell volume	6926.5 ± 0.7 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0812
Residual factor for significantly intense reflections	0.0492
Weighted residual factors for significantly intense reflections	0.1313
Weighted residual factors for all reflections included in the refinement	0.1567
Goodness-of-fit parameter for all reflections included in the refinement	1.033
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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