Information card for entry 4332209

Structure parameters

• Formula: C17 H26 N P S
• Calculated formula: C17 H26 N P S
• SMILES: S=P(C1=C(N(C)C)Cc2c1cccc2)(C(C)C)C(C)C
• Title of publication: Rh(I) and Ir(I) Derivatives of a P(S),N-Substituted Indene Ligand: Synthetic, Structural, and Catalytic Alkene Hydrosilylation Studies
• Authors of publication: Wechsler, Dominik; Myers, Anne; McDonald, Robert; Ferguson, Michael J.; Stradiotto, Mark
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 11
• Pages of publication: 4562 - 4570
• a: 10.5482 ± 0.0004 Å
• b: 11.2705 ± 0.0005 Å
• c: 14.399 ± 0.0006 Å
• α: 90°
• β: 98.752 ± 0.001°
• γ: 90°
• Cell volume: 1691.87 ± 0.12 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 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: 0.0369
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.0962
• Weighted residual factors for all reflections included in the refinement: 0.0978
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No