Information card for entry 7120324

Structure parameters

• Formula: C117 H120 Br8 N16 O19 Zn4
• Calculated formula: C117 H120 Br8 N16 O19 Zn4
• Title of publication: Halides Tuning Subcellular-Targeting in Two-Photon Emissive Complexes via Different Uptake Mechanisms
• Authors of publication: Tian, Xiaohe; Zhu, Yingzhong; Zhang, Qiong; Zhang, Ruilong; Wu, Jieying; Tian, Yupeng
• Journal of publication: Chem. Commun.
• Year of publication: 2017
• a: 27.37 ± 0.003 Å
• b: 15.939 ± 0.0015 Å
• c: 34.916 ± 0.003 Å
• α: 90°
• β: 118.79 ± 0.001°
• γ: 90°
• Cell volume: 13349 ± 2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1249
• Residual factor for significantly intense reflections: 0.0699
• Weighted residual factors for significantly intense reflections: 0.2098
• Weighted residual factors for all reflections included in the refinement: 0.2347
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No