Information card for entry 4316868

Structure parameters

• Formula: C22 H51 Cl N2 Si6
• Calculated formula: C22 H51 Cl N2 Si6
• SMILES: Cl[Si@@]1([Si@@]2(N([Si](C)(C)C)[Si](C)(C)C)[C@]3(C(=C(C)[C@@]1([C@@]23C)C)C)C)N([Si](C)(C)C)[Si](C)(C)C.Cl[Si@]1([Si@]2(N([Si](C)(C)C)[Si](C)(C)C)[C@@]3(C(=C(C)[C@]1([C@]23C)C)C)C)N([Si](C)(C)C)[Si](C)(C)C
• Title of publication: One Pot Synthesis of Disilatricycloheptene Analogue and Jutzi's Disilene
• Authors of publication: Shabana Khan; Sakya S. Sen; Herbert W. Roesky; Daniel Kratzert; Reent Michel; Dietmar Stalke
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 9689 - 9693
• a: 21.707 ± 0.003 Å
• b: 9.2762 ± 0.0013 Å
• c: 16.985 ± 0.003 Å
• α: 90°
• β: 110.554 ± 0.003°
• γ: 90°
• Cell volume: 3202.4 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0575
• Residual factor for significantly intense reflections: 0.0392
• Weighted residual factors for significantly intense reflections: 0.0863
• Weighted residual factors for all reflections included in the refinement: 0.0943
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No