Information card for entry 4062583

Structure parameters

• Formula: C37 H41 Cl4 Ir P2
• Calculated formula: C37 H41 Cl4 Ir P2
• SMILES: [Ir]1234([CH]5=[CH]1CC[CH]2=[CH]3CC5)(Cl)[P](CCCC[P]4(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.C(Cl)(Cl)Cl
• Journal of publication: Organometallics
• Year of publication: 2004
• a: 11.2689 ± 0.001 Å
• b: 20.7628 ± 0.0018 Å
• c: 14.9551 ± 0.0013 Å
• α: 90°
• β: 91.205 ± 0.002°
• γ: 90°
• Cell volume: 3498.3 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• 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