Information card for entry 7032556

Structure parameters

• Formula: C42 H47 Al F5 N2 P
• Calculated formula: C42 H47 Al F5 N2 P
• SMILES: C(C)(C)(C)N1[Al](C)(c2c(c(c(c(c2F)F)F)F)F)[N](c2c(cccc2C(C)C)C(C)C)=P1(c1ccccc1)c1ccccc1.c1(ccccc1)C
• 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: 11.9558 ± 0.0001 Å
• b: 11.9841 ± 0.0001 Å
• c: 16.9461 ± 0.0002 Å
• α: 70.932 ± 0.001°
• β: 73.026 ± 0.001°
• γ: 67.057 ± 0.001°
• Cell volume: 2075.14 ± 0.04 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0741
• Residual factor for significantly intense reflections: 0.0642
• Weighted residual factors for significantly intense reflections: 0.1781
• Weighted residual factors for all reflections included in the refinement: 0.1855
• Goodness-of-fit parameter for all reflections included in the refinement: 1.226
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No