Information card for entry 7708133

Structure parameters

• Formula: C40 H62 N4 Ru2
• Calculated formula: C40 H62 N4 Ru2
• Title of publication: Synthesis, structures, and reactivity of isomers of [RuCp*(1,4-(Me₂N)₂C₆H₄)]₂.
• Authors of publication: Longhi, Elena; Risko, Chad; Bacsa, John; Khrustalev, Victor; Rigin, Sergei; Moudgil, Karttikay; Timofeeva, Tatiana V.; Marder, Seth R.; Barlow, Stephen
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 37
• Pages of publication: 13020 - 13030
• a: 14.2872 ± 0.0004 Å
• b: 8.62433 ± 0.00019 Å
• c: 15.3075 ± 0.0004 Å
• α: 90°
• β: 105.41 ± 0.003°
• γ: 90°
• Cell volume: 1818.34 ± 0.08 ų
• Cell temperature: 105 ± 8 K
• Ambient diffraction temperature: 105 ± 8 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0635
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for significantly intense reflections: 0.1462
• Weighted residual factors for all reflections included in the refinement: 0.1546
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0021
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No