Information card for entry 4335048

Structure parameters

• Formula: C37 H28 F6 N7 Os P
• Calculated formula: C37 H28 F6 N7 Os P
• SMILES: [Os]1234([n]5c(c6cccc(c7[n]1cccc7)c46)cccc5)[n]1c4ccccc4n(c1c1[n]2c(ccc1)c1[n]3c2c(n1C)cccc2)C.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Monometallic Osmium(II) Complexes with Bis(N-methylbenzimidazolyl)benzene or -pyridine: A Comparison Study with Ruthenium(II) Analogues
• Authors of publication: Jiang-Yang Shao; Yu-Wu Zhong
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 6464 - 6472
• a: 9.257 ± 0.002 Å
• b: 11.733 ± 0.003 Å
• c: 17.132 ± 0.005 Å
• α: 97.5 ± 0.013°
• β: 99.13 ± 0.015°
• γ: 111.02 ± 0.012°
• Cell volume: 1679.1 ± 0.8 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: 0.0531
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.1249
• Weighted residual factors for all reflections included in the refinement: 0.1529
• Goodness-of-fit parameter for all reflections included in the refinement: 1.315
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No