Information card for entry 4070082

Structure parameters

• Formula: C12 H19 F2 N2 Sb
• Calculated formula: C12 H19 F2 N2 Sb
• SMILES: [Sb]12([N](C)(Cc3c2c(C[N]1(C)C)ccc3)C)(F)F
• Title of publication: Synthesis and Structural Study on Organoantimony(III) and Organobismuth(III) Hydroxides Containing an NCN Pincer Type Ligand†
• Authors of publication: Fridrichová, Adéla; Svoboda, Tomáš; Jambor, Roman; Padělková, Zdeňka; Růžička, Aleš; Erben, Milan; Jirásko, Robert; Dostál, Libor
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 18
• Pages of publication: 5522
• a: 9.5823 ± 0.0011 Å
• b: 23.1213 ± 0.0011 Å
• c: 12.8888 ± 0.0012 Å
• α: 90°
• β: 102.101 ± 0.01°
• γ: 90°
• Cell volume: 2792.1 ± 0.4 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0955
• Residual factor for significantly intense reflections: 0.0557
• Weighted residual factors for significantly intense reflections: 0.117
• Weighted residual factors for all reflections included in the refinement: 0.1399
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No