Information card for entry 1514737

Structure parameters

• Formula: C20 H18 F3 N3 O3
• Calculated formula: C20 H18 F3 N3 O3
• SMILES: C1(=O)c2cccc3c(ccc(C(=O)N1CCCC)c23)c1cc(C(F)(F)F)n[nH]1.O
• Title of publication: Naphthalimide trifluoroacetyl acetonate: a hydrazine-selective chemodosimetric sensor
• Authors of publication: Lee, Min Hee; Yoon, Byungkwon; Kim, Jong Seung; Sessler, Jonathan L.
• Journal of publication: Chemical Science
• Year of publication: 2013
• Journal volume: 4
• Journal issue: 11
• Pages of publication: 4121
• a: 27.371 ± 0.002 Å
• b: 7.0453 ± 0.0006 Å
• c: 18.8951 ± 0.0014 Å
• α: 90°
• β: 99.01 ± 0.007°
• γ: 90°
• Cell volume: 3598.7 ± 0.5 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• 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: 0.1192
• Residual factor for significantly intense reflections: 0.0421
• Weighted residual factors for significantly intense reflections: 0.0595
• Weighted residual factors for all reflections included in the refinement: 0.067
• Goodness-of-fit parameter for all reflections included in the refinement: 0.967
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No