Information card for entry 7700469

Structure parameters

• Common name: [(XbicH2)SiPh][HCl2] . 3 CHCl3
• Chemical name: (9,9-dimethylxanthene-4,5-bis(4,6-di-tert-butyl-2,3-dioxybenzaldiminium)-(phenyl)silicon(IV) bichloride tri-chloroform solvate
• Formula: C54 H63 Cl11 N2 O5 Si
• Calculated formula: C53 H62 Cl8 N2 O5 Si
• Title of publication: Mono- and bimetallic pentacoordinate silicon complexes of a chelating bis(catecholimine) ligand.
• Authors of publication: Do, Thomas H.; Brown, Seth N.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 30
• Pages of publication: 11565 - 11574
• a: 16.3173 ± 0.0008 Å
• b: 17.8374 ± 0.0008 Å
• c: 21.3223 ± 0.0011 Å
• α: 89.6599 ± 0.0017°
• β: 81.8824 ± 0.0017°
• γ: 84.0998 ± 0.0016°
• Cell volume: 6111.1 ± 0.5 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0706
• Residual factor for significantly intense reflections: 0.0538
• Weighted residual factors for significantly intense reflections: 0.1347
• Weighted residual factors for all reflections included in the refinement: 0.1459
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No