Information card for entry 4076620

Structure parameters

• Formula: C50 H46 O8 S2 Sn2
• Calculated formula: C50 H46 O8 S2 Sn2
• Title of publication: First Example of a Hydrogen-Bonded Three-DimensionalPillaredStructure Involving an Organotin Motif: Synthesis and X-ray Crystal Structures of {[nBu2Sn(H2O)3(L)Sn(H2O)3nBu2]2+[L]2-}·2MeOH·2H2O and {[Ph3Sn(L)Sn(H2O)Ph3]n}·THF (L = 1,5-Naphthalenedisulfonate)
• Authors of publication: Chandrasekhar, Vadapalli; Boomishankar, Ramamoorthy; Steiner, Alexander; Bickley, Jamie F.
• Journal of publication: Organometallics
• Year of publication: 2003
• Journal volume: 22
• Journal issue: 17
• Pages of publication: 3342
• a: 14.3593 ± 0.0006 Å
• b: 15.9365 ± 0.0007 Å
• c: 20.5615 ± 0.0009 Å
• α: 90°
• β: 107.443 ± 0.001°
• γ: 90°
• Cell volume: 4488.9 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.028
• Residual factor for significantly intense reflections: 0.0246
• Weighted residual factors for significantly intense reflections: 0.0623
• Weighted residual factors for all reflections included in the refinement: 0.064
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No