Information card for entry 7112567

Structure parameters

• Formula: C49 H63 Cl N2 O6 Zn
• Calculated formula: C49 H63 Cl N2 O6 Zn
• Title of publication: DNA binding and cytotoxicity of fluorescent curcumin-based Zn(ii) complexes
• Authors of publication: Pucci, Daniela; Bellini, Tommaso; Crispini, Alessandra; D'Agnano, Igea; Liguori, Paola F.; Garcia-Orduña, Pilar; Pirillo, Sante; Valentini, Alessandra; Zanchetta, Giuliano
• Journal of publication: MedChemComm
• Year of publication: 2012
• Journal volume: 3
• Journal issue: 4
• Pages of publication: 462
• a: 9.608 ± 0.001 Å
• b: 14.966 ± 0.001 Å
• c: 17.648 ± 0.001 Å
• α: 112.645 ± 0.001°
• β: 98.126 ± 0.001°
• γ: 90.686 ± 0.002°
• Cell volume: 2312.4 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.099
• Residual factor for significantly intense reflections: 0.0733
• Weighted residual factors for significantly intense reflections: 0.2035
• Weighted residual factors for all reflections included in the refinement: 0.2275
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.7378 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No