Information card for entry 7030648

Structure parameters

• Formula: C41 H63 Cl6 N2 O2 Sb
• Calculated formula: C41 H63 Cl6 N2 O2 Sb
• SMILES: [NH+](=C\C(c1ccccc1)=C\Nc1c(cccc1C(C)C)C(C)C)/c1c(cccc1C(C)C)C(C)C.O(CC)CC.[Sb](Cl)(Cl)(Cl)(Cl)(Cl)[Cl-].O(CC)CC
• Title of publication: Synthesis and structures of β-dialdiminatoantimony(III) halides and β-dialdiminium hexahalogenoantimoniates
• Authors of publication: Hitchcock, Peter B.; Lappert, Michael F.; Li, Gang; Coles, Martyn P.
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 37
• Pages of publication: 7820 - 7826
• a: 11.3613 ± 0.0003 Å
• b: 16.9485 ± 0.0006 Å
• c: 25.5387 ± 0.0006 Å
• α: 90°
• β: 94.765 ± 0.002°
• γ: 90°
• Cell volume: 4900.7 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0749
• Residual factor for significantly intense reflections: 0.0608
• Weighted residual factors for significantly intense reflections: 0.1496
• Weighted residual factors for all reflections included in the refinement: 0.1596
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7002272
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No