Information card for entry 4328936

Structure parameters

• Formula: C25 H44 Cl2 Ga2 N2
• Calculated formula: C25 H44 Cl2 Ga2 N2
• SMILES: [Ga]1([N](=CC=[N]1C1CCCCC1)C1CCCCC1)(C)C.[Ga](Cl)(Cl)(C)C.Cc1ccccc1
• Title of publication: Addition of Aluminum and Gallium Species to Aromatic and Alkyl-Substituted 1,4-Diaza-1,3-butadiene Ligands
• Authors of publication: Ana M. Felix; Diane A. Dickie; Ian S. Horne; Giang Page; Richard A. Kemp
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 4650 - 4662
• a: 10.9899 ± 0.0005 Å
• b: 11.3709 ± 0.0006 Å
• c: 12.9317 ± 0.0006 Å
• α: 115.158 ± 0.003°
• β: 92.861 ± 0.003°
• γ: 91.203 ± 0.003°
• Cell volume: 1459.3 ± 0.13 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0336
• Residual factor for significantly intense reflections: 0.0253
• Weighted residual factors for significantly intense reflections: 0.0642
• Weighted residual factors for all reflections included in the refinement: 0.0681
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No