Information card for entry 4061748

Structure parameters

• Formula: C17 H22 Ir N O4
• Calculated formula: C17 H22 Ir N O4
• SMILES: [Ir]12([O]=C(C)C=C(O1)C)(OC(=CC(=[O]2)C)C)([n]1ccccc1)C=C
• Journal of publication: Organometallics
• Year of publication: 2005
• a: 8.2247 ± 0.0008 Å
• b: 8.2247 ± 0.0008 Å
• c: 22.586 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1323.2 ± 0.3 ų
• Cell temperature: 143 ± 2 K
• Ambient diffraction temperature: 143 ± 2 K
• Number of distinct elements: 5
• Space group number: 145
• Hermann-Mauguin space group symbol: P 32
• Hall space group symbol: P 32
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No