Information card for entry 7704660

Structure parameters

• Formula: C37 H65 N4 P Si3
• Calculated formula: C37 H65 N4 P Si3
• SMILES: P([Si]1[N](=C(N(C)C)C=C(N1c1c(cccc1C(C)C)C(C)C)N(C)C)c1c(cccc1C(C)C)C(C)C)([Si](C)(C)C)[Si](C)(C)C
• Title of publication: Probing the non-innocent nature of an amino-functionalised β-diketiminate ligand in silylene/iminosilane systems.
• Authors of publication: Do, Dinh Cao Huan; Vasko, Petra; Fuentes, M Ángeles; Hicks, Jamie; Aldridge, Simon
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 25
• Pages of publication: 8701 - 8709
• a: 9.9161 ± 0.0003 Å
• b: 10.3439 ± 0.0003 Å
• c: 20.8211 ± 0.0009 Å
• α: 77.111 ± 0.003°
• β: 85.335 ± 0.003°
• γ: 72.843 ± 0.003°
• Cell volume: 1988.92 ± 0.13 ų
• Cell temperature: 115 ± 2 K
• Ambient diffraction temperature: 115 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0368
• Residual factor for significantly intense reflections: 0.0329
• Weighted residual factors for significantly intense reflections: 0.0884
• Weighted residual factors for all reflections included in the refinement: 0.0914
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No