Information card for entry 2219420

Structure parameters

• Chemical name: <i>trans</i>-Tetraiodidobis(tri-<i>p</i>-tolylphosphine oxide-κ<i>O</i>)tin(IV)
• Formula: C42 H42 I4 O2 P2 Sn
• Calculated formula: C42 H42 I4 O2 P2 Sn
• SMILES: I[Sn](I)(I)(I)([O]=P(c1ccc(C)cc1)(c1ccc(C)cc1)c1ccc(C)cc1)[O]=P(c1ccc(C)cc1)(c1ccc(C)cc1)c1ccc(C)cc1
• Title of publication: <i>trans</i>-Tetraiodidobis(tri-<i>p</i>-tolylphosphine oxide-κ<i>O</i>)tin(IV)
• Authors of publication: Hitosugi-Levesque, Marina; Tanski, Joseph M.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 9
• Pages of publication: m1107
• a: 18.6013 ± 0.0011 Å
• b: 11.9677 ± 0.0007 Å
• c: 19.3335 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4303.9 ± 0.4 ų
• Cell temperature: 125 ± 2 K
• Ambient diffraction temperature: 125 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0223
• Residual factor for significantly intense reflections: 0.0188
• Weighted residual factors for significantly intense reflections: 0.0467
• Weighted residual factors for all reflections included in the refinement: 0.0483
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes