Information card for entry 7006845

Structure parameters

• Formula: C38 H70 N4 Si4
• Calculated formula: C38 H70 N4 Si4
• SMILES: c12c(cccc1)N(CC(C)(C)C)[Si](N2CC(C)(C)C)([Si](C)(C)C)[Si]1(N(c2c(cccc2)N1CC(C)(C)C)CC(C)(C)C)[Si](C)(C)C
• Title of publication: Insights into the making of a stable silylene.
• Authors of publication: Gehrhus, Barbara; Hitchcock, Peter B.; Pongtavornpinyo, Ruti; Zhang, Lihong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 15
• Pages of publication: 1847 - 1857
• a: 11.0126 ± 0.0002 Å
• b: 10.7343 ± 0.0002 Å
• c: 17.9366 ± 0.0004 Å
• α: 90°
• β: 93.993 ± 0.001°
• γ: 90°
• Cell volume: 2115.18 ± 0.07 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0522
• Residual factor for significantly intense reflections: 0.0436
• Weighted residual factors for significantly intense reflections: 0.1189
• Weighted residual factors for all reflections included in the refinement: 0.1249
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No