Information card for entry 7028270

Structure parameters

• Formula: C25 H27 Bi Cl N
• Calculated formula: C25 H27 Bi Cl N
• SMILES: [Bi]1(Cl)([N](=Cc2ccccc12)c1c(cccc1C(C)C)C(C)C)c1ccccc1
• Title of publication: Synthesis and structure of N,C-chelated organoantimony(v) and organobismuth(v) compounds.
• Authors of publication: Urbanová, Iva; Jambor, Roman; Růžička, Aleš; Jirásko, Robert; Dostál, Libor
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 2
• Pages of publication: 505 - 512
• a: 11.248 ± 0.0009 Å
• b: 14.075 ± 0.0014 Å
• c: 14.5001 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2295.6 ± 0.3 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 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: 0.0614
• Residual factor for significantly intense reflections: 0.0426
• Weighted residual factors for significantly intense reflections: 0.0842
• Weighted residual factors for all reflections included in the refinement: 0.0943
• Goodness-of-fit parameter for all reflections included in the refinement: 1.177
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No