Crystallography Open Database

Information card for entry 4308361

Preview

Coordinates	4308361.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C58 H82 Au Cl Ga2 N4
Calculated formula	C58 H82 Au Cl Ga2 N4
SMILES	[Au]([Ga]1(Cl)[N](=C(C)C=C(N1c1c(C(C)C)cccc1C(C)C)C)c1c(cccc1C(C)C)C(C)C)[Ga]1N(c2c(C(C)C)cccc2C(C)C)C(=CC(=[N]1c1c(C(C)C)cccc1C(C)C)C)C
Title of publication	Insertion of Ga(DDP) into the Au‒Cl Bond of (PPh3)AuCl: A First Structurally Characterized Au‒Ga Bond
Authors of publication	Kempter, Andreas; Gemel, Christian; Fischer, Roland A.
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Journal issue	2
Pages of publication	163 - 165
a	13.788 ± 0.002 Å
b	17.9638 ± 0.0018 Å
c	25.485 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	6312.2 ± 1.2 Å³
Cell temperature	105 ± 2 K
Ambient diffraction temperature	105 ± 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	0.0439
Residual factor for significantly intense reflections	0.0362
Weighted residual factors for significantly intense reflections	0.076
Weighted residual factors for all reflections included in the refinement	0.0781
Goodness-of-fit parameter for all reflections included in the refinement	0.984
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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