Information card for entry 7711243

Structure parameters

• Formula: C40 H42 N10 O18 Zn2
• Calculated formula: C40 H42 N10 O18 Zn2
• Title of publication: A metal complex based fluorescent chemodosimeter for selective detection of 2,4-dinitrophenol and picric acid in aqueous media
• Authors of publication: Pramanik, Abhishek; Majumder, Samit; Sparkes, Hazel A.; Mohanta, Sasankasekhar
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 9.8225 ± 0.0014 Å
• b: 10.8321 ± 0.0016 Å
• c: 12.0244 ± 0.0018 Å
• α: 70.529 ± 0.002°
• β: 68.63 ± 0.002°
• γ: 76.18 ± 0.002°
• Cell volume: 1113.2 ± 0.3 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 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: 0.0335
• Residual factor for significantly intense reflections: 0.0308
• Weighted residual factors for significantly intense reflections: 0.1118
• Weighted residual factors for all reflections included in the refinement: 0.1153
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No