Information card for entry 7008723

Structure parameters

• Formula: C31 H34 Al N2 P
• Calculated formula: C31 H34 Al N2 P
• SMILES: P(C1=[N]([Al](N1C(C)C)(c1ccccc1)c1ccccc1)C(C)C)(c1ccccc1)c1ccccc1
• Title of publication: Lithium and aluminium complexes supported by chelating phosphaguanidinates.
• Authors of publication: Mansfield, Natalie E.; Coles, Martyn P.; Hitchcock, Peter B.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 17
• Pages of publication: 2833 - 2841
• a: 15.9891 ± 0.0005 Å
• b: 11.2621 ± 0.0003 Å
• c: 15.4755 ± 0.0003 Å
• α: 90°
• β: 104.277 ± 0.002°
• γ: 90°
• Cell volume: 2700.62 ± 0.12 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0337
• Residual factor for significantly intense reflections: 0.0299
• Weighted residual factors for significantly intense reflections: 0.072
• Weighted residual factors for all reflections included in the refinement: 0.0743
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No