Information card for entry 7018968

Structure parameters

• Formula: C26 H27 N2 S Sb
• Calculated formula: C26 H27 N2 S Sb
• SMILES: [Sb]12(=S)[N](c3c(cccc3C)C)=C(c3c1c(C(=[N]2c1c(C)cccc1C)C)ccc3)C
• Title of publication: Monomeric organoantimony(iii) sulphide and selenide with terminal Sb-E bond (E = S, Se). Synthesis, structure and theoretical consideration.
• Authors of publication: Simon, Petr; Jambor, Roman; Růžička, Aleš; Lyčka, Antonín; De Proft, Frank; Dostál, Libor
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 17
• Pages of publication: 5140 - 5143
• a: 12.1292 ± 0.0007 Å
• b: 12.1288 ± 0.0017 Å
• c: 16.2089 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2384.5 ± 0.4 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: 0.0564
• Residual factor for significantly intense reflections: 0.0451
• Weighted residual factors for significantly intense reflections: 0.101
• Weighted residual factors for all reflections included in the refinement: 0.1096
• Goodness-of-fit parameter for all reflections included in the refinement: 1.136
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No