Information card for entry 4077327

Structure parameters

• Formula: C62 H54 N2 O5 P4 Ru2
• Calculated formula: C65 H58 N2 O6 P4 Ru2
• SMILES: [Ru]123([Ru]([P](C[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)([P](C[P]2(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(N3/N=C/C(=O)OCC)(C#[O])C#[O])(C#[O])C#[O].Cc1ccccc1
• Title of publication: Synthesis and Reactivity of a Diruthenium Diazoalkane Complex
• Authors of publication: Gao, Yuan; Jennings, Michael C.; Puddephatt, Richard J.; Jenkins, Hilary A.
• Journal of publication: Organometallics
• Year of publication: 2001
• Journal volume: 20
• Journal issue: 16
• Pages of publication: 3500
• a: 11.9163 ± 0.0006 Å
• b: 22.1179 ± 0.0011 Å
• c: 22.3515 ± 0.0011 Å
• α: 90°
• β: 98.903 ± 0.001°
• γ: 90°
• Cell volume: 5820.1 ± 0.5 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 6
• 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: 0.0672
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for significantly intense reflections: 0.1333
• Weighted residual factors for all reflections included in the refinement: 0.1474
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No