Information card for entry 7032550

Structure parameters

• Formula: C36 H52 Li N2 O2 P
• Calculated formula: C36 H52 Li N2 O2 P
• SMILES: [Li]1([N](C(C)(C)C)=P(c2ccccc2)(c2ccccc2)N1c1c(cccc1C(C)C)C(C)C)([O]1CCCC1)[O]1CCCC1
• 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: 17.958 ± 0.003 Å
• b: 10.172 ± 0.0015 Å
• c: 20.232 ± 0.003 Å
• α: 90°
• β: 111.853 ± 0.002°
• γ: 90°
• Cell volume: 3430.2 ± 0.9 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: 0.0748
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.1073
• Weighted residual factors for all reflections included in the refinement: 0.119
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No