Information card for entry 7057682

Structure parameters

• Formula: C37 H28 N2 O8 Zn
• Calculated formula: C37 H28 N2 O8 Zn
• Title of publication: Highly selective and sensitive recognition of Zn(ii) by a novel coumarinyl scaffold following spectrofluorometric technique and its application in living cells
• Authors of publication: Dey, Sunanda; Purkait, Rakesh; Patra, Chiranjit; Saha, Moumita; Mondal, Sanchaita; Das Saha, Krishna; Sinha, Chittaranjan
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 19
• Pages of publication: 16297
• a: 14.77 ± 0.008 Å
• b: 15.31 ± 0.008 Å
• c: 18.022 ± 0.012 Å
• α: 113.5 ± 0.018°
• β: 114.072 ± 0.012°
• γ: 90.059 ± 0.014°
• Cell volume: 3346 ± 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: 0.3186
• Residual factor for significantly intense reflections: 0.1294
• Weighted residual factors for significantly intense reflections: 0.2937
• Weighted residual factors for all reflections included in the refinement: 0.4109
• Goodness-of-fit parameter for all reflections included in the refinement: 0.913
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No