Information card for entry 4312350

Structure parameters

• Formula: C31 H30 Cl2 F6 Ir N7 O P
• Calculated formula: C31 H27.98 Cl2 F6 Ir N7 O P
• Title of publication: New Luminescent Cyclometalated Iridium(III) Diimine Complexes as Biological Labeling Reagents
• Authors of publication: Kenneth Kam-Wing Lo; Chi-Keung Chung; Terence Kwok-Ming Lee; Lok-Hei Lui; Keith Hing-Kit Tsang; Nianyong Zhu
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 6886 - 6897
• a: 22.772 ± 0.005 Å
• b: 18.227 ± 0.004 Å
• c: 17.728 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7358 ± 3 ų
• Cell temperature: 301 ± 2 K
• Ambient diffraction temperature: 301 ± 2 K
• Number of distinct elements: 8
• Space group number: 64
• Hermann-Mauguin space group symbol: C m c a
• Hall space group symbol: -C 2ac 2
• Residual factor for all reflections: 0.0781
• Residual factor for significantly intense reflections: 0.0526
• Weighted residual factors for significantly intense reflections: 0.1567
• Weighted residual factors for all reflections included in the refinement: 0.1682
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No