Information card for entry 7047455

Structure parameters

• Formula: C24 H32 Cl3 Ir N2 O
• Calculated formula: C24 H32 Cl3 Ir N2 O
• Title of publication: Phenoxide chelated Ir(iii) N-heterocyclic carbene complexes: synthesis, characterization, and evaluation of their in vitro anticancer activity.
• Authors of publication: Zhang, Yujiao; Zhang, Shumiao; Tian, Zhenzhen; Li, Juanjuan; Xu, Zhishan; Li, Shanshan; Liu, Zhe
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 39
• Pages of publication: 13781 - 13787
• a: 9.2934 ± 0.0019 Å
• b: 11.622 ± 0.002 Å
• c: 13.674 ± 0.003 Å
• α: 65.73 ± 0.03°
• β: 80.57 ± 0.03°
• γ: 74.82 ± 0.03°
• Cell volume: 1296.7 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0566
• Residual factor for significantly intense reflections: 0.0475
• Weighted residual factors for significantly intense reflections: 0.1177
• Weighted residual factors for all reflections included in the refinement: 0.1213
• Goodness-of-fit parameter for all reflections included in the refinement: 0.998
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No