Information card for entry 4314891

Structure parameters

• Formula: C48 H28 F6 N4 O4 Sn
• Calculated formula: C48 H28 F6 N4 O4 Sn
• Title of publication: Design and Synthesis of Sn-Porphyrin Based Molecular Gates
• Authors of publication: Aurélie Guenet; Ernest Graf; Nathalie Kyritsakas; Mir Wais Hosseini
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 1872 - 1883
• a: 8.4354 ± 0.0002 Å
• b: 10.5166 ± 0.0002 Å
• c: 12.5859 ± 0.0004 Å
• α: 104.479 ± 0.002°
• β: 103.888 ± 0.002°
• γ: 105.721 ± 0.001°
• Cell volume: 982.24 ± 0.05 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0739
• Residual factor for significantly intense reflections: 0.0626
• Weighted residual factors for significantly intense reflections: 0.1529
• Weighted residual factors for all reflections included in the refinement: 0.1671
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No