Information card for entry 4071408

Structure parameters

• Formula: C33 H50 Cl4 O Os P4
• Calculated formula: C33 H50 Cl4 O Os P4
• SMILES: [Os]12(Cl)([P](C)(C)C)([P](C)(C)C)([P](C)(C)C)C=C([P+](c3ccccc3)(c3ccccc3)c3ccccc3)C(O)[CH]1=[CH2]2.C(Cl)Cl.Cl
• Title of publication: Formation of Four Conjugated Osmacyclic Species in a One-Pot Reaction
• Authors of publication: Gong, Lei; Lin, Yumei; Wen, Ting Bin; Zhang, Hong; Zeng, Birong; Xia, Haiping
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 11
• Pages of publication: 2584
• a: 11.1653 ± 0.0004 Å
• b: 12.7631 ± 0.0003 Å
• c: 13.6141 ± 0.0004 Å
• α: 87.747 ± 0.002°
• β: 85.366 ± 0.002°
• γ: 83.153 ± 0.002°
• Cell volume: 1919.06 ± 0.1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0353
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for significantly intense reflections: 0.0677
• Weighted residual factors for all reflections included in the refinement: 0.0696
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No