Information card for entry 4347761

Structure parameters

• Common name: 2(hex)
• Formula: C28 H30 N2 P2 Sn
• Calculated formula: C28 H30 N2 P2 Sn
• SMILES: N(c1c(P(c2ccccc2)[Sn]P(c2c(N(C)C)cccc2)c2ccccc2)cccc1)(C)C
• Title of publication: Intermolecular (119)Sn,(31)P Through-Space Spin-Spin Coupling in a Solid Bivalent Tin Phosphido Complex.
• Authors of publication: Arras, Janet; Eichele, Klaus; Maryasin, Boris; Schubert, Hartmut; Ochsenfeld, Christian; Wesemann, Lars
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 9
• Pages of publication: 4669 - 4675
• a: 14.8396 ± 0.0003 Å
• b: 14.8396 ± 0.0003 Å
• c: 11.7863 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2595.51 ± 0.1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 86
• Hermann-Mauguin space group symbol: P 42/n :2
• Hall space group symbol: -P 4bc
• Residual factor for all reflections: 0.0358
• Residual factor for significantly intense reflections: 0.0284
• Weighted residual factors for significantly intense reflections: 0.0585
• Weighted residual factors for all reflections included in the refinement: 0.0612
• Goodness-of-fit parameter for all reflections included in the refinement: 1.124
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No