Information card for entry 4060893

Structure parameters

• Formula: C53.5 H45 O2 P Ru
• Calculated formula: C53.5 H44.5 O2 P Ru
• Title of publication: The PPh3-Substituted Hydroxycyclopentadienyl Ruthenium Hydride [2,5-Ph2-3,4-Tol2(η5-C4COH)]Ru(CO)(PPh3)H Is a More Efficient Catalyst for Hydrogenation of Aldehydes
• Authors of publication: Casey, Charles P.; Strotman, Neil A.; Beetner, Sharon E.; Johnson, Jeffrey B.; Priebe, David C.; Vos, Thomas E.; Khodavandi, Babak; Guzei, Ilia A.
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 5
• Pages of publication: 1230 - 1235
• a: 10.8661 ± 0.001 Å
• b: 17.416 ± 0.0015 Å
• c: 22.728 ± 0.002 Å
• α: 81.676 ± 0.001°
• β: 89.139 ± 0.001°
• γ: 83.601 ± 0.001°
• Cell volume: 4229.2 ± 0.7 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
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No