Information card for entry 7054779

Structure parameters

• Formula: C37 H39 N3 O2 S
• Calculated formula: C37 H39 N3 O2 S
• Title of publication: Novel fluorescent probes based on rhodamine for naked-eye detection of Fe3+and their application of imaging in living cells
• Authors of publication: Yang, Meipan; Meng, Wenfei; Ding, Qingli; Su, Na; Liu, Xiaojing; Zhang, Ming; Yang, Bingqin
• Journal of publication: New J. Chem.
• Year of publication: 2015
• Journal volume: 39
• Journal issue: 6
• Pages of publication: 4790
• a: 9.0224 ± 0.0008 Å
• b: 11.6701 ± 0.001 Å
• c: 30.389 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3199.7 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0722
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for significantly intense reflections: 0.118
• Weighted residual factors for all reflections included in the refinement: 0.1245
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No