Information card for entry 4101201

Structure parameters

• Formula: C22 H29 Cl4 Ir N2
• Calculated formula: C22 H29 Cl4 Ir N2
• SMILES: [Ir]1234(Cl)(=C5N(C)C=CN5Cc5ccccc5)(Cl)[c]5([c]4([c]3([c]2([c]15C)C)C)C)C.C(Cl)Cl
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• a: 17.5521 ± 0.0009 Å
• b: 12.609 ± 0.0006 Å
• c: 11.3366 ± 0.0005 Å
• α: 90°
• β: 93.004 ± 0.001°
• γ: 90°
• Cell volume: 2505.5 ± 0.2 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• 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