Information card for entry 4308360

Structure parameters

• Formula: C53 H62 Au Cl Ga N2 P
• Calculated formula: C53 H62 Au Cl Ga N2 P
• SMILES: [Au]([Ga]1(Cl)[N](c2c(cccc2C(C)C)C(C)C)=C(C=C(N1c1c(C(C)C)cccc1C(C)C)C)C)[P](c1ccccc1)(c1ccccc1)c1ccccc1.c1ccccc1
• 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: 22.708 ± 0.008 Å
• b: 13.753 ± 0.005 Å
• c: 15.9 ± 0.006 Å
• α: 90°
• β: 101.593 ± 0.009°
• γ: 90°
• Cell volume: 4864 ± 3 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0751
• Residual factor for significantly intense reflections: 0.0552
• Weighted residual factors for significantly intense reflections: 0.1324
• Weighted residual factors for all reflections included in the refinement: 0.1435
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No