Information card for entry 4081596

Structure parameters

• Formula: C29 H33 As Cl2 F6 I N2 P2 Sb Si
• Calculated formula: C29 H33 As Cl2 F6 I N2 P2 Sb Si
• Title of publication: CH‒NH Tautomerism in the Products of the Reactions of the Methanide [HC(PPh2NSiMe3)2]−with Pnictogen and Tellurium Iodides
• Authors of publication: Thirumoorthi, Ramalingam; Chivers, Tristram; Gendy, Chris; Vargas-Baca, Ignacio
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 19
• Pages of publication: 5360
• a: 17.537 ± 0.0003 Å
• b: 13.329 ± 0.0003 Å
• c: 16.31 ± 0.0005 Å
• α: 90 ± 0.0013°
• β: 102.558 ± 0.0016°
• γ: 90 ± 0.0017°
• Cell volume: 3721.27 ± 0.16 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 10
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.04
• Residual factor for significantly intense reflections: 0.0368
• Weighted residual factors for significantly intense reflections: 0.0797
• Weighted residual factors for all reflections included in the refinement: 0.0819
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No