Information card for entry 1556656

Structure parameters

• Formula: C23 H35 B Ru2 S5
• Calculated formula: C23 H35 B Ru2 S5
• SMILES: [c]12([c]3([c]4([c]5([c]1(C)[Ru]1672345C(=S)[Ru]234587([c]7([c]2([c]3([c]4([c]57C)C)C)C)C)[S]1[BH]1SC[S]8C[S]61)C)C)C)C
• Title of publication: Synthesis of Trithia-Borinane Complexes Stabilized in Diruthenium Core: [(Cp*Ru)2(n1-S)(n1-CS){(CH2)2S3BR}] (R = H or SMe)
• Authors of publication: Saha, K.; Kaur, U.; Borthakur, R.; Ghosh, S.
• Journal of publication: Inorganics
• Year of publication: 2019
• Journal volume: 7
• Pages of publication: 21
• a: 31.732 ± 0.002 Å
• b: 10.7145 ± 0.0007 Å
• c: 17.6302 ± 0.0014 Å
• α: 90°
• β: 116.019 ± 0.003°
• γ: 90°
• Cell volume: 5386.6 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0667
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.0772
• Weighted residual factors for all reflections included in the refinement: 0.088
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No