Information card for entry 2200956

Structure parameters

• Chemical name: Triisopropyl[5-(4-nitrophenyl)tetrahydrofuran-3-ylidenemethyl]silane
• Formula: C20 H31 N O3 Si
• Calculated formula: C20 H31 N O3 Si
• SMILES: N(=O)(=O)c1ccc(cc1)C1OC\C(=C/[Si](C(C)C)(C(C)C)C(C)C)C1
• Title of publication: Triisopropyl[5-(4-nitrophenyl)tetrahydrofuran-3-ylidenemethyl]silane
• Authors of publication: Light, Mark E.; Hursthouse, Michael B.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 2
• Pages of publication: o202 - o203
• a: 14.6339 ± 0.0003 Å
• b: 7.7463 ± 0.0001 Å
• c: 35.8752 ± 0.0007 Å
• α: 90°
• β: 91.066 ± 0.003°
• γ: 90°
• Cell volume: 4066.06 ± 0.13 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.2006
• Residual factor for significantly intense reflections: 0.0824
• Weighted residual factors for significantly intense reflections: 0.1955
• Weighted residual factors for all reflections included in the refinement: 0.254
• Goodness-of-fit parameter for all reflections included in the refinement: 0.969
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes