Information card for entry 4081595

Structure parameters

• Formula: C38 H47 As I2 N2 P2 Si2
• Calculated formula: C38 H47 As I2 N2 P2 Si2
• SMILES: [As]2(I)(I)[N]([Si](C)(C)C)=P(c1ccccc1)(c1ccccc1)C2=P(N[Si](C)(C)C)(c1ccccc1)c1ccccc1.c1(ccccc1)C
• 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: 9.745 ± 0.0002 Å
• b: 11.332 ± 0.0003 Å
• c: 19.828 ± 0.0005 Å
• α: 78.493 ± 0.001°
• β: 80.071 ± 0.001°
• γ: 76.393 ± 0.001°
• Cell volume: 2067.2 ± 0.09 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.052
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for significantly intense reflections: 0.0845
• Weighted residual factors for all reflections included in the refinement: 0.0894
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No