Information card for entry 7104620

Structure parameters

• Formula: C18 H38 Mo2 P2
• Calculated formula: C18 H38 Mo2 P2
• SMILES: [CH2]1=[CH]2C[Mo]345612([CH](=[CH2]3)[CH2]4[Mo]12346([P](C)(C)C)(C[CH]1=[CH2]2)[CH2]5[CH]3=[CH2]4)[P](C)(C)C
• Title of publication: Interplay of metal-allyl and metal-metal bonding in dimolybdenum allyl complexes.
• Authors of publication: Trovitch, Ryan J; John, Kevin D; Martin, Richard L; Obrey, Stephen J; Scott, Brian L; Sattelberger, Alfred P; Baker, R Thomas
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 28
• Pages of publication: 4206 - 4208
• a: 10.7554 ± 0.0007 Å
• b: 8.8269 ± 0.0006 Å
• c: 11.9842 ± 0.0008 Å
• α: 90°
• β: 108.515 ± 0.001°
• γ: 90°
• Cell volume: 1078.85 ± 0.12 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 141 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0733
• Residual factor for significantly intense reflections: 0.0572
• Weighted residual factors for significantly intense reflections: 0.1323
• Weighted residual factors for all reflections included in the refinement: 0.1403
• 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