Information card for entry 2016256

Structure parameters

• Chemical name: Tetrakis(1-naphthylamino)silane tetrahydrofuran trisolvate
• Formula: C52 H56 N4 O3 Si
• Calculated formula: C52 H56 N4 O3 Si
• SMILES: [Si](Nc1cccc2ccccc12)(Nc1cccc2ccccc12)(Nc1cccc2ccccc12)Nc1cccc2ccccc12.O1CCCC1.O1CCCC1.O1CCCC1
• Title of publication: Tetrakis(1-naphthylamino)silane and its tetrahydrofuran trisolvate
• Authors of publication: Balakrishna, Maravanji S.; Chivers, Tristram; Parvez, Masood
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 11
• Pages of publication: o617 - o619
• a: 21.048 ± 0.007 Å
• b: 14.672 ± 0.007 Å
• c: 15.16 ± 0.009 Å
• α: 90°
• β: 104.46 ± 0.02°
• γ: 90°
• Cell volume: 4533 ± 4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.2468
• Residual factor for significantly intense reflections: 0.0782
• Weighted residual factors for significantly intense reflections: 0.1666
• Weighted residual factors for all reflections included in the refinement: 0.2303
• Goodness-of-fit parameter for all reflections included in the refinement: 0.977
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes