Information card for entry 7006031

Structure parameters

• Formula: C47 H62 Cl2 N4 Ru3
• Calculated formula: C47 H62 Cl2 N4 Ru3
• SMILES: [Ru]123456([N]7(C#N)[Ru]89%11%12%13([Cl][Ru]7%14%15%16%17([C]4(=[N]19)N)[c]1([c]%15([c]%16([c]%17([c]%141C)C)C)C)C)[c]1([c]%11([c]%12([c]%13([c]81C)C)C)C)C)[c]1([c]5([c]6([c]2([c]31C)C)C)C)C.[Cl-].c1ccccc1.c1ccccc1.c1ccccc1
• Title of publication: Synthesis and reactivities of a bis(cyanamido)-capped triruthenium complex.
• Authors of publication: Tanabe, Yoshiaki; Kajitani, Hidenobu; Iwasaki, Masakazu; Ishii, Youichi
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 41
• Pages of publication: 4701 - 4707
• a: 10.706 ± 0.003 Å
• b: 15.137 ± 0.005 Å
• c: 15.986 ± 0.005 Å
• α: 102.402 ± 0.002°
• β: 101.621 ± 0.002°
• γ: 107.735 ± 0.004°
• Cell volume: 2308.7 ± 1.2 ų
• Cell temperature: 123.1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0482
• Weighted residual factors for all reflections included in the refinement: 0.0505
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No