Information card for entry 4061454

Structure parameters

• Formula: C67 H67 N3 O2 P2 Ru
• Calculated formula: C72 H67 N3 O2 P2 Ru
• SMILES: [Ru]12([P](c3ccccc3)(c3ccccc3)c3ccccc3)([P](c3ccccc3)(c3ccccc3)c3ccccc3)O\C(=N/c3c(cccc3C(C)C)C(C)C)c3[n]2c(ccc3)C(=N/c2c(cccc2C(C)C)C(C)C)/O1.CCCCC
• Journal of publication: Organometallics
• Year of publication: 2005
• a: 11.724 ± 0.003 Å
• b: 14.298 ± 0.003 Å
• c: 19.268 ± 0.004 Å
• α: 89.156 ± 0.004°
• β: 80.866 ± 0.004°
• γ: 77.064 ± 0.004°
• Cell volume: 3107.3 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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