Information card for entry 7032554

Structure parameters

• Formula: C28 H36 Al Cl2 N2 P
• Calculated formula: C28 H36 Al Cl2 N2 P
• SMILES: C(C)(C)(C)N1[Al]([N](c3c(cccc3C(C)C)C(C)C)=P1(c1ccccc1)c1ccccc1)(Cl)Cl
• Title of publication: A new bulky iminophosphonamide as an N,N'-chelating ligand: synthesis and structural characterization of heteroleptic group 13 element complexes.
• Authors of publication: Prashanth, Billa; Singh, Sanjay
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 44
• Pages of publication: 16880 - 16888
• a: 8.8896 ± 0.0004 Å
• b: 17.8277 ± 0.0009 Å
• c: 17.8433 ± 0.0009 Å
• α: 90°
• β: 102.859 ± 0.003°
• γ: 90°
• Cell volume: 2756.9 ± 0.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• 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: 0.0369
• Residual factor for significantly intense reflections: 0.0292
• Weighted residual factors for significantly intense reflections: 0.0741
• Weighted residual factors for all reflections included in the refinement: 0.0784
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No