Information card for entry 7004102

Structure parameters

• Formula: C42 H46 N14 S4 Zn2
• Calculated formula: C42 H46 N14 S4 Zn2
• Title of publication: Cellular confocal fluorescence studies and cytotoxic activity of new Zn(ii) bis(thiosemicarbazonato) complexes
• Authors of publication: Pascu, Sofia I.; Waghorn, Philip A.; Conry, Timothy D.; Lin, Bonita; Betts, Helen M.; Dilworth, Jonathan R.; Sim, Robert B.; Churchill, Grant C.; Aigbirhio, Franklin I.; Warren, John E.
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 16
• Pages of publication: 2107 - 2110
• a: 11.835 ± 0.002 Å
• b: 21.206 ± 0.005 Å
• c: 23.024 ± 0.005 Å
• α: 90°
• β: 98.524 ± 0.002°
• γ: 90°
• Cell volume: 5715 ± 2 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.113
• Residual factor for significantly intense reflections: 0.0755
• Weighted residual factors for all reflections: 0.1075
• Weighted residual factors for significantly intense reflections: 0.0795
• Weighted residual factors for all reflections included in the refinement: 0.0795
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.6709 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No