Information card for entry 4081714

Structure parameters

• Formula: C22 H52 Al2 P2
• Calculated formula: C22 H52 Al2 P2
• SMILES: C([P]1(C(C)(C)C)C[Al](C)(C)[P](C(C)(C)C)(C(C)(C)C)C[Al]1(C)C)(C)(C)C
• Title of publication: Reactivity of Dimeric P/Al-Based Lewis Pairs toward Carbon Dioxide andtert-Butyl Isocyanate
• Authors of publication: Bertini, Federica; Hoffmann, Frank; Appelt, Christian; Uhl, Werner; Ehlers, Andreas W.; Slootweg, J. Chris; Lammertsma, Koop
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 22
• Pages of publication: 6764
• a: 10.7367 ± 0.0006 Å
• b: 8.5749 ± 0.0004 Å
• c: 15.5382 ± 0.0008 Å
• α: 90°
• β: 108.514 ± 0.001°
• γ: 90°
• Cell volume: 1356.51 ± 0.12 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 4
• 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: 0.049
• Residual factor for significantly intense reflections: 0.0349
• Weighted residual factors for significantly intense reflections: 0.088
• Weighted residual factors for all reflections included in the refinement: 0.0926
• Goodness-of-fit parameter for all reflections included in the refinement: 0.97
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No