Crystallography Open Database

Information card for entry 7712758

Preview

Coordinates	7712758.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H29 Ga N2
Calculated formula	C17 H29 Ga N2
SMILES	[GaH2](=C1N(C(=C(N1C)C)C)C)C1(C(=C(C(=C1C)C)C)C)C
Title of publication	Subvalent Group 13 Molecules by Carbene-induced Hydrogen Abstraction
Authors of publication	Werner, Luis; Hock, Andreas; Luz, Christian; Riethmann, Melanie; Radius, Udo
Journal of publication	Dalton Transactions
Year of publication	2023
a	11.0487 ± 0.0001 Å
b	15.7247 ± 0.0002 Å
c	20.1868 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	3507.2 ± 0.06 Å³
Cell temperature	100 ± 0.5 K
Ambient diffraction temperature	100 ± 0.5 K
Number of distinct elements	4
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0266
Residual factor for significantly intense reflections	0.024
Weighted residual factors for significantly intense reflections	0.0646
Weighted residual factors for all reflections included in the refinement	0.0661
Goodness-of-fit parameter for all reflections included in the refinement	1.044
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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