Information card for entry 7003138

Structure parameters

• Formula: C52 H72 Al2 Cl4 N4
• Calculated formula: C52 H72 Al2 Cl4 N4
• SMILES: C1[C@@H](N([Al]([N]=1c1c(cccc1C(C)C)C(C)C)(Cl)Cl)c1c(cccc1C(C)C)C(C)C)[C@@H]1C=[N]([Al](N1c1c(cccc1C(C)C)C(C)C)(Cl)Cl)c1c(cccc1C(C)C)C(C)C
• Title of publication: Light group 13 chloride diazadiene complexes: consequences of varying substituent bulk
• Authors of publication: Hinchliffe, Alan; Mair, Francis S.; McInnes, Eric J. L.; Pritchard, Robin G.; Warren, John E.
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 2
• Pages of publication: 222 - 233
• a: 10.8043 ± 0.0012 Å
• b: 12.4962 ± 0.0013 Å
• c: 12.6503 ± 0.0018 Å
• α: 118.224 ± 0.007°
• β: 90.425 ± 0.007°
• γ: 115.297 ± 0.006°
• Cell volume: 1312.7 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.1447
• Residual factor for significantly intense reflections: 0.084
• Weighted residual factors for significantly intense reflections: 0.1808
• Weighted residual factors for all reflections included in the refinement: 0.2141
• Goodness-of-fit parameter for all reflections included in the refinement: 1.112
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No