Information card for entry 7121403

Structure parameters

• Formula: C35 H27 F1.5 Ir N7 P0.25
• Calculated formula: C37 H27 F1.5 Ir N5 P0.25
• Title of publication: A benzoic acid terpyridine-based cyclometalated iridium(iii) complex as a two-photon fluorescence probe for imaging nuclear histidine.
• Authors of publication: Zhang, Qiong; Lu, Xin; Wang, Hui; Tian, Xiaohe; Wang, Aidong; Zhou, Hongping; Wu, Jieying; Tian, Yupeng
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 30
• Pages of publication: 3771 - 3774
• a: 18.259 ± 0.004 Å
• b: 24.563 ± 0.006 Å
• c: 17.81 ± 0.004 Å
• α: 90°
• β: 104.946 ± 0.003°
• γ: 90°
• Cell volume: 7717 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 6
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0854
• Residual factor for significantly intense reflections: 0.0587
• Weighted residual factors for significantly intense reflections: 0.1646
• Weighted residual factors for all reflections included in the refinement: 0.1794
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No