Information card for entry 4083713

Structure parameters

• Formula: C25 H37 O6 P Ru
• Calculated formula: C25 H37 O6 P Ru
• Title of publication: Ruthenium Hydroxycarbenes as Key Intermediates in Cycloisomerization and Decarbonylative Cyclization of Terminal Alkynals
• Authors of publication: Batuecas, María; Esteruelas, Miguel A.; Garc\?ía-Yebra, Cristina; González-Rodr\?íguez, Carlos; Oñate, Enrique; Saá, Carlos
• Journal of publication: Organometallics
• Year of publication: 2014
• Pages of publication: 140620141406003
• a: 7.7896 ± 0.001 Å
• b: 9.1182 ± 0.0012 Å
• c: 18.376 ± 0.003 Å
• α: 82.101 ± 0.002°
• β: 86.235 ± 0.002°
• γ: 79.204 ± 0.002°
• Cell volume: 1268.9 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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 all reflections: 0.0458
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for significantly intense reflections: 0.0806
• Weighted residual factors for all reflections included in the refinement: 0.0867
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No