Information card for entry 4062582

Structure parameters

• Formula: C31 H32 Cl Ir O P2
• Calculated formula: C31 H26 Cl Ir O P2
• SMILES: [Ir]1234([P](C[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(Cl)[CH](=[CH2]2)COC[CH]4=[CH2]3
• Journal of publication: Organometallics
• Year of publication: 2004
• a: 14.6479 ± 0.0013 Å
• b: 11.6123 ± 0.0011 Å
• c: 18.0017 ± 0.0016 Å
• α: 90°
• β: 101.389 ± 0.002°
• γ: 90°
• Cell volume: 3001.7 ± 0.5 ų
• Cell temperature: 446 ± 2 K
• Ambient diffraction temperature: 446 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No