Information card for entry 4060517

Structure parameters

• Formula: C52 H50 Cl2 O2 P2 Ru
• Calculated formula: C52 H50 Cl2 O2 P2 Ru
• SMILES: [Ru]12345([P](CCOC(=O)[c]61[c]2([cH]3[c]4([cH]56)C(C)(C)C)C)(c1ccccc1)c1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)C#Cc1ccccc1.ClCCl
• Journal of publication: Organometallics
• Year of publication: 2005
• a: 9.875 ± 0.002 Å
• b: 21.578 ± 0.002 Å
• c: 21.305 ± 0.002 Å
• α: 90°
• β: 101.92 ± 0.01°
• γ: 90°
• Cell volume: 4441 ± 1 ų
• Cell temperature: 203.1 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No