Information card for entry 7126883

Structure parameters

• Formula: C70 H66 F6 N O8.5 P4 Ru S2
• Calculated formula: C70 H66 F6 N O8.5 P4 Ru S2
• Title of publication: Conventional and unconventional alkyne activations by Ru and Os for unprecedented dimetalated quinolizinium complexes.
• Authors of publication: Yeung, Chi-Fung; Chung, Lai-Hon; Tse, Sheung-Ying; Shek, Hau-Lam; Tse, Man-Kit; Yiu, Shek-Man; Wong, Chun-Yuen
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 63
• Pages of publication: 8908 - 8911
• a: 22.978 ± 0.0008 Å
• b: 16.4419 ± 0.0006 Å
• c: 36.9317 ± 0.0013 Å
• α: 90°
• β: 104 ± 0.001°
• γ: 90°
• Cell volume: 13538.4 ± 0.8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0976
• Residual factor for significantly intense reflections: 0.0939
• Weighted residual factors for significantly intense reflections: 0.2618
• Weighted residual factors for all reflections included in the refinement: 0.2635
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No