Information card for entry 4326905

Structure parameters

• Formula: C26 H56 N2 O4 P4 Sn
• Calculated formula: C26 H56 N2 O4 P4 Sn
• SMILES: [Sn]12([P](N=P(C(C)C)(C(C)C)C(=O)O1)(C(C)C)C(C)C)[P](N=P(C(C)C)(C(C)C)C(=O)O2)(C(C)C)C(C)C
• Title of publication: Formation of a Reversible, Intramolecular Main-Group Metal-CO2 Adduct
• Authors of publication: Diane A. Dickie; Eric N. Coker; Richard A. Kemp
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 11288 - 11290
• a: 8.9955 ± 0.0018 Å
• b: 9.2698 ± 0.0019 Å
• c: 23.265 ± 0.005 Å
• α: 88.35 ± 0.03°
• β: 89.39 ± 0.03°
• γ: 62.3 ± 0.03°
• Cell volume: 1716.9 ± 0.8 ų
• Cell temperature: 188 ± 2 K
• Ambient diffraction temperature: 188 ± 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: 0.0789
• Residual factor for significantly intense reflections: 0.066
• Weighted residual factors for significantly intense reflections: 0.1816
• Weighted residual factors for all reflections included in the refinement: 0.1867
• Goodness-of-fit parameter for all reflections included in the refinement: 1.196
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No