Information card for entry 7133023

Structure parameters

• Formula: C58 H49 Cl N4 O6 P2 Ru
• Calculated formula: C58 H49 Cl N4 O6 P2 Ru
• SMILES: [RuH]1([P](c2ccccc2)(c2ccccc2)c2ccccc2)([P](c2ccccc2)(c2ccccc2)c2ccccc2)([O]=C(c2nc(n3c2cccc3C)c2nc(ccc2)C)c2[n]1c(ccc2)C)C#[O].Cl(=O)(=O)(=O)[O-]
• Title of publication: Superior electrocatalytic hydrogen evolution activity of a triply bridged diruthenium(II) complex on a carbon cloth support.
• Authors of publication: Arya, Yogita; Ansari, Toufik; Bera, Sudip Kumar; Panda, Sanjib; Indra, Arindam; Lahiri, Goutam Kumar
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 47
• Pages of publication: 6011 - 6014
• a: 15.601 ± 0.0002 Å
• b: 21.105 ± 0.0003 Å
• c: 22.1703 ± 0.0003 Å
• α: 110.152 ± 0.001°
• β: 101.134 ± 0.001°
• γ: 99.661 ± 0.001°
• Cell volume: 6502.66 ± 0.17 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0772
• Residual factor for significantly intense reflections: 0.0545
• Weighted residual factors for significantly intense reflections: 0.1438
• Weighted residual factors for all reflections included in the refinement: 0.1615
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No