Information card for entry 7010552

Structure parameters

• Common name: Complex-2
• Formula: C50 H82 Li3 N7 Si6
• Calculated formula: C50 H82 Li3 N7 Si6
• SMILES: [Si]([N]12=C([N]34([Si](C)(C)C)[Li]51([N]#Cc1ccc(cc1)C)[N]1([Si](C)(C)C)C(=[N]5([Si](C)(C)C)[Li]31[N]([Si](C)(C)C)=C(N3[Si](C)(C)(C)[Li]243)c1ccc(cc1)C)c1ccc(cc1)C)c1ccc(cc1)C)(C)(C)C
• Title of publication: Towards the formation of dimeric and trimeric lithium benzamidinates: characterization of intermediate structures
• Authors of publication: Lisovskii, Anatoli; Botoshansky, Mark; Eisen, Moris S.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2001
• Journal issue: 11
• Pages of publication: 1692
• a: 13.506 ± 0.002 Å
• b: 14.668 ± 0.004 Å
• c: 30.918 ± 0.009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6125 ± 3 ų
• Cell temperature: 220 ± 1 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1155
• Residual factor for significantly intense reflections: 0.0383
• Weighted residual factors for significantly intense reflections: 0.0658
• Weighted residual factors for all reflections included in the refinement: 0.0811
• Goodness-of-fit parameter for all reflections included in the refinement: 0.878
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No