Information card for entry 7003137

Structure parameters

• Formula: C26 H36 B Cl N2
• Calculated formula: C26 H36 B Cl N2
• SMILES: ClB1N(C=CN1c1c(cccc1C(C)C)C(C)C)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: 19.3586 ± 0.0005 Å
• b: 6.855 ± 0.0002 Å
• c: 20.0253 ± 0.0005 Å
• α: 90°
• β: 101.033 ± 0.001°
• γ: 90°
• Cell volume: 2608.3 ± 0.12 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0798
• Residual factor for significantly intense reflections: 0.0638
• Weighted residual factors for significantly intense reflections: 0.145
• Weighted residual factors for all reflections included in the refinement: 0.1545
• Goodness-of-fit parameter for all reflections included in the refinement: 1.11
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No