Information card for entry 4068287

Structure parameters

• Formula: C37 H71 N5 Si2
• Calculated formula: C37 H71 N5 Si2
• SMILES: [Si@]12([Si@]3(N2c2c(C)cc(C)cc2C)N(C(C)(C)C)[C@H](C(C)(C)C)CN3C(C)(C)C)N(C(C)(C)C)[C@H](C(C)(C)C)CN1C(C)(C)C.[Si@@]12([Si@@]3(N2c2c(C)cc(C)cc2C)N(C(C)(C)C)[C@@H](C(C)(C)C)CN3C(C)(C)C)N(C(C)(C)C)[C@@H](C(C)(C)C)CN1C(C)(C)C
• Title of publication: Synthesis and Reactivity of Three New N-Heterocyclic Silylenes
• Authors of publication: Tomasik, Adam C.; Mitra, Amitabha; West, Robert
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 1
• Pages of publication: 378
• a: 24.888 ± 0.002 Å
• b: 20.3814 ± 0.0018 Å
• c: 19.7477 ± 0.0018 Å
• α: 90°
• β: 124.288 ± 0.001°
• γ: 90°
• Cell volume: 8276.3 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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: 0.0763
• Residual factor for significantly intense reflections: 0.0481
• Weighted residual factors for significantly intense reflections: 0.1166
• Weighted residual factors for all reflections included in the refinement: 0.1239
• Goodness-of-fit parameter for all reflections included in the refinement: 0.904
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No