Information card for entry 4320674

Structure parameters

• Formula: C29 H41 Cl2 Ga N2
• Calculated formula: C29 H41 Cl2 Ga N2
• SMILES: [Ga]1(Cl)(Cl)[N](=C(C=C(N1c1c(cccc1C(C)C)C(C)C)C)C)c1c(cccc1C(C)C)C(C)C
• Title of publication: Siloxide and Triflate Gallium(III) Complexes Supported by the BDI Ligand
• Authors of publication: Malcolm H. Chisholm; Diana Navarro-Llobet; Judith Gallucci
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 6506 - 6508
• a: 17.149 ± 0.0001 Å
• b: 13.124 ± 0.0001 Å
• c: 13.777 ± 0.0001 Å
• α: 90°
• β: 108.798 ± 0.001°
• γ: 90°
• Cell volume: 2935.31 ± 0.04 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• 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: 0.0418
• Residual factor for significantly intense reflections: 0.0299
• Weighted residual factors for all reflections: 0.076
• Weighted residual factors for significantly intense reflections: 0.0717
• Goodness-of-fit parameter for all reflections: 1.063
• Goodness-of-fit parameter for significantly intense reflections: 1.109
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No