Information card for entry 7715190

Structure parameters

• Formula: C20.56 H19.8 N5 O1.13 Pd S2.84
• Calculated formula: C20.565 H19.804 N5 O1.134 Pd S2.837
• Title of publication: Role of the auxiliary ligand in determining the genotoxicity and mode of cell death of thiosemicarbazone Pd(II) complexes.
• Authors of publication: Mansour, Ahmed M.; Khaled, Rabaa M.; Radacki, Krzysztof; Abo-Zeid, Mona A M; Shehab, Ola R.; Mostafa, Gamal A. E.; Ali, Essam A.; Abo-Elfadl, Mahmoud T
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 11
• Pages of publication: 5073 - 5083
• a: 7.2577 ± 0.0002 Å
• b: 11.4312 ± 0.0003 Å
• c: 14.6611 ± 0.0004 Å
• α: 106.133 ± 0.002°
• β: 102.146 ± 0.002°
• γ: 102.844 ± 0.002°
• Cell volume: 1090.05 ± 0.06 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 0.1 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: 0.0409
• Residual factor for significantly intense reflections: 0.0367
• Weighted residual factors for significantly intense reflections: 0.0873
• Weighted residual factors for all reflections included in the refinement: 0.0892
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No