Information card for entry 4084908

Structure parameters

• Formula: C60 H102 As4 Cl4 N4 Ru2
• Calculated formula: C60 H86 As4 Cl4 N4 Ru2
• SMILES: [Ru]12([As](Cc3[n]2c(ccc3)C[As]1(C(C)(C)C)C(C)(C)C)(C(C)(C)C)C(C)(C)C)(Cl)(Cl)[N]#[N][Ru]12([As](Cc3[n]2c(C[As]1(C(C)(C)C)C(C)(C)C)ccc3)(C(C)(C)C)C(C)(C)C)(Cl)Cl.Cc1ccccc1.Cc1ccccc1
• Title of publication: Correction to Synthesis and Reactivity of Ruthenium Complexes Bearing Arsenic-Containing Arsenic-Nitrogen-Arsenic-Type Pincer Ligand
• Authors of publication: Tanabe, Yoshiaki; Kuriyama, Shogo; Arashiba, Kazuya; Nakajima, Kazunari; Nishibayashi, Yoshiaki
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 24
• Pages of publication: 7333
• a: 12.6675 ± 0.0003 Å
• b: 21.9658 ± 0.0004 Å
• c: 24.5172 ± 0.0005 Å
• α: 90°
• β: 97.6953 ± 0.0007°
• γ: 90°
• Cell volume: 6760.5 ± 0.2 ų
• Cell temperature: 198 K
• Ambient diffraction temperature: 198 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0478
• Weighted residual factors for all reflections included in the refinement: 0.0969
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No