Information card for entry 7235116

Structure parameters

• Formula: C38 H30 F6 N P
• Calculated formula: C38 H30 F6 N P
• SMILES: [n+]1(ccc(/C=C/c2ccc(C(=C(c3ccccc3)c3ccccc3)c3ccccc3)cc2)c2c1cccc2)C.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: A highly sensitive fluorescent sensor with aggregation-induced emission characteristics for the detection of iodide and mercury ions in aqueous solution
• Authors of publication: Rui Xue Zhang; Peng Fei Li; Wen Juan Zhang; Nan Li; Na Zhao
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2016
• Journal volume: 4
• Pages of publication: 10479 - 10485
• a: 9.4059 ± 0.0004 Å
• b: 11.4024 ± 0.0005 Å
• c: 15.4542 ± 0.0005 Å
• α: 94.338 ± 0.003°
• β: 105.333 ± 0.003°
• γ: 92.789 ± 0.003°
• Cell volume: 1589.82 ± 0.11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.135
• Residual factor for significantly intense reflections: 0.1202
• Weighted residual factors for significantly intense reflections: 0.4019
• Weighted residual factors for all reflections included in the refinement: 0.4268
• Goodness-of-fit parameter for all reflections included in the refinement: 1.833
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No