Information card for entry 7060013

Structure parameters

• Formula: C15 H19 Cl2 N7 O Pd S4
• Calculated formula: C15 H19 Cl2 N7 O Pd S4
• Title of publication: Unprecedented palladium(ii) complex containing dipodal 1,3,4-thiadiazole derivatives: synthesis, structure, and biological and thermal investigations
• Authors of publication: Heidari, Leila; Ghassemzadeh, Mitra; Fenske, Dieter; Fuhr, Olaf; Saeidifar, Maryam; Mohsenzadeh, Farshid
• Journal of publication: New Journal of Chemistry
• Year of publication: 2020
• Journal volume: 44
• Journal issue: 39
• Pages of publication: 16769 - 16775
• a: 8.1386 ± 0.0001 Å
• b: 23.0128 ± 0.0004 Å
• c: 12.3047 ± 0.0002 Å
• α: 90°
• β: 96.063 ± 0.001°
• γ: 90°
• Cell volume: 2291.68 ± 0.06 ų
• Cell temperature: 180.15 K
• Ambient diffraction temperature: 180.15 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0301
• Residual factor for significantly intense reflections: 0.0279
• Weighted residual factors for significantly intense reflections: 0.0756
• Weighted residual factors for all reflections included in the refinement: 0.077
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.34143 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No