Information card for entry 7101043

Structure parameters

• Formula: C26 H26 B F4 Ir N O3 P
• Calculated formula: C26 H26 B F4 Ir N O3 P
• SMILES: [Ir]123([P](Cc4[n]1cccc4)(c1ccccc1)c1ccccc1)(C(=O)OCC=C)(C#[O])C[CH]2=[CH2]3.[B](F)(F)(F)[F-]
• Journal of publication: Chemical Communications
• Year of publication: 2006
• a: 33.6 ± 0.01 Å
• b: 10.959 ± 0.002 Å
• c: 15.568 ± 0.005 Å
• α: 90°
• β: 112.406 ± 0.008°
• γ: 90°
• Cell volume: 5298 ± 2 ų
• Cell temperature: 213 K
• Ambient diffraction temperature: 213 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No