Information card for entry 7028510

Structure parameters

• Formula: C22 H28 Br2 N8 O2 S2 Zn
• Calculated formula: C22 H28 Br2 N8 O2 S2 Zn
• SMILES: Br[Zn](Br)([S]=C(N)NN=Cc1cccc2cc[nH]c12)[S]=C(N)NN=Cc1cccc2cc[nH]c12.OC.OC
• Title of publication: Indole-7-carbaldehyde thiosemicarbazone as a flexidentate ligand toward Zn(II), Cd(II), Pd(II) and Pt(II) ions: cytotoxic and apoptosis-inducing properties of the Pt(II) complex.
• Authors of publication: Ibrahim, Abeer A.; Khaledi, Hamid; Hassandarvish, Pouya; Mohd Ali, Hapipah; Karimian, Hamed
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 10
• Pages of publication: 3850 - 3860
• a: 8.2989 ± 0.0011 Å
• b: 12.4402 ± 0.0016 Å
• c: 14.7088 ± 0.0019 Å
• α: 74.448 ± 0.002°
• β: 83.939 ± 0.002°
• γ: 85.086 ± 0.002°
• Cell volume: 1452.2 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.043
• Residual factor for significantly intense reflections: 0.0322
• Weighted residual factors for significantly intense reflections: 0.0837
• Weighted residual factors for all reflections included in the refinement: 0.0881
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No