Information card for entry 2232983

Structure parameters

• Chemical name: Dicyclohexylammonium bis(hydrogen phenylphosphonato)trimethylstannate(IV)
• Formula: C27 H45 N O6 P2 Sn
• Calculated formula: C27 H45 N O6 P2 Sn
• SMILES: [Sn](OP(=O)(O)c1ccccc1)(OP(O)(=O)c1ccccc1)(C)(C)C.[NH2+](C1CCCCC1)C1CCCCC1
• Title of publication: Dicyclohexylammonium trimethylbis(hydrogen phenylphosphonato)stannate(IV)
• Authors of publication: Diop, Tidiane; Diop, Libasse; Diop, Cheikh A. K.; Molloy, Kieran C.; Kociok-Köhn, Gabriele
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 12
• Pages of publication: m1872 - m1873
• a: 10.8718 ± 0.0005 Å
• b: 12.7103 ± 0.0007 Å
• c: 13.3218 ± 0.0007 Å
• α: 100.625 ± 0.003°
• β: 103.687 ± 0.003°
• γ: 111.996 ± 0.003°
• Cell volume: 1580.41 ± 0.15 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0615
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for significantly intense reflections: 0.1146
• Weighted residual factors for all reflections included in the refinement: 0.1237
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes