Information card for entry 7711315

Structure parameters

• Formula: C112 H108 B2 N6
• Calculated formula: C112 H108 B2 N6
• Title of publication: Triarylborane-triphenylamine based luminophore for the mitochondria targeted live cell imaging and colorimetric detection of aqueous fluoride
• Authors of publication: P, Chinna Ayya Swamy; Raveendran, Archana V.; Sivakrishna, Narra; Nandi, Rajendra Prasad
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 13.122 ± 0.002 Å
• b: 19.08 ± 0.004 Å
• c: 19.964 ± 0.004 Å
• α: 76.429 ± 0.004°
• β: 77.166 ± 0.004°
• γ: 76.851 ± 0.004°
• Cell volume: 4655.6 ± 1.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.247
• Residual factor for significantly intense reflections: 0.1235
• Weighted residual factors for significantly intense reflections: 0.3115
• Weighted residual factors for all reflections included in the refinement: 0.3456
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No