Information card for entry 7106420

Structure parameters

• Formula: C78 H122 Li4 N28 Sn7
• Calculated formula: C78 H122 Li4 N28 Sn7
• Title of publication: Oxidative Dehydrocoupling of N-H Bonds Using a Redox-Active Main Group Superbase
• Authors of publication: R.J.Less; V.Naseri; M.McPartlin; D.S.Wright
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 6129
• a: 13.8673 ± 0.0001 Å
• b: 18.7128 ± 0.0002 Å
• c: 20.1729 ± 0.0003 Å
• α: 97.486 ± 0.001°
• β: 104.43 ± 0.001°
• γ: 103.962 ± 0.001°
• Cell volume: 4817.84 ± 0.1 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0851
• Residual factor for significantly intense reflections: 0.0559
• Weighted residual factors for significantly intense reflections: 0.162
• Weighted residual factors for all reflections included in the refinement: 0.1854
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No