Information card for entry 1551997

Structure parameters

• Formula: C24 H26 Cl3 Ga N O P
• Calculated formula: C24 H26 Cl3 Ga N O P
• SMILES: C(=C(/N(C)C)OCC)(\[P+](c1ccccc1)(c1ccccc1)c1ccccc1)[Ga](Cl)(Cl)Cl
• Title of publication: Coordination chemistry at carbon
• Authors of publication: Manuel Alcarazo; Christian W. Lehmann; Anakuthil Anoop; Walter Thiel; Alois Furstner
• Journal of publication: Nature Chemistry
• Year of publication: 2009
• Journal volume: 1
• Pages of publication: 295 - 301
• a: 9.7142 ± 0.0003 Å
• b: 36.4547 ± 0.001 Å
• c: 14.5834 ± 0.0004 Å
• α: 90°
• β: 96.126 ± 0.001°
• γ: 90°
• Cell volume: 5134.9 ± 0.3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• 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: 0.0609
• Residual factor for significantly intense reflections: 0.0454
• Weighted residual factors for significantly intense reflections: 0.1045
• Weighted residual factors for all reflections included in the refinement: 0.1141
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No