Information card for entry 1550174

Structure parameters

• Formula: C33 H33 N3 O2
• Calculated formula: C33 H33 N3 O2
• SMILES: N(c1c(cc2C3(N(Cc4ccccc4)C(=O)c4c3cccc4)c3cc(c(NCC)cc3Oc2c1)C)C)CC
• Title of publication: A differentially selective probe for trivalent chemosensor upon single excitation with cell imaging application: potential applications in combinatorial logic circuit and memory devices.
• Authors of publication: Das, Dipankar; Alam, Rabiul; Katarkar, Atul; Ali, Mahammad
• Journal of publication: Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology
• Year of publication: 2019
• Journal volume: 18
• Journal issue: 1
• Pages of publication: 242 - 252
• a: 9.0397 ± 0.0008 Å
• b: 12.5823 ± 0.0011 Å
• c: 12.8196 ± 0.0011 Å
• α: 86.214 ± 0.002°
• β: 73.428 ± 0.002°
• γ: 72.357 ± 0.002°
• Cell volume: 1331.5 ± 0.2 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 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: 0.0684
• Residual factor for significantly intense reflections: 0.0527
• Weighted residual factors for significantly intense reflections: 0.1388
• Weighted residual factors for all reflections included in the refinement: 0.1522
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No