Information card for entry 4515955

Structure parameters

• Formula: C36 H57 N O3 Si5
• Calculated formula: C36 H57 N O3 Si5
• SMILES: c12c(cc(C)cc1C)C[N]13Cc4c(c(cc(c4)C)C)O[Si]1(O2)([Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)Oc1c(cc(C)cc1C)C3
• Title of publication: Hypercoordinated Oligosilanes Based on Aminotrisphenols.
• Authors of publication: Aghazadeh Meshgi, Mohammad; Zaitsev, Kirill V.; Vener, Mikhail V.; Churakov, Andrei V.; Baumgartner, Judith; Marschner, Christoph
• Journal of publication: ACS omega
• Year of publication: 2018
• Journal volume: 3
• Journal issue: 8
• Pages of publication: 10317 - 10330
• a: 14.3849 ± 0.0018 Å
• b: 14.3849 ± 0.0018 Å
• c: 22.169 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 3972.7 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 165
• Hermann-Mauguin space group symbol: P -3 c 1
• Hall space group symbol: -P 3 2"c
• Residual factor for all reflections: 0.0611
• Residual factor for significantly intense reflections: 0.0599
• Weighted residual factors for significantly intense reflections: 0.1355
• Weighted residual factors for all reflections included in the refinement: 0.1361
• Goodness-of-fit parameter for all reflections included in the refinement: 1.261
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No