Information card for entry 7054420

Structure parameters

• Formula: C31 H49 N3 Pd S4
• Calculated formula: C31 H49 N3 Pd S4
• Title of publication: Vysotskite structured photoactive palladium sulphide thin films from dithiocarbamate derivatives
• Authors of publication: Ehsan, Muhammad Ali; Ming, Huang Nay; McKee, Vickie; Peiris, Thalge Anton Nirmal; Wijayantha-Kahagala-Gamage, Upul; Arifin, Zainudin; Mazhar, Muhammad
• Journal of publication: New Journal of Chemistry
• Year of publication: 2014
• Journal volume: 38
• Journal issue: 9
• Pages of publication: 4083
• a: 9.961 ± 0.0013 Å
• b: 14.0277 ± 0.0019 Å
• c: 12.1552 ± 0.0016 Å
• α: 90°
• β: 104.023 ± 0.002°
• γ: 90°
• Cell volume: 1647.8 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0519
• Residual factor for significantly intense reflections: 0.0348
• Weighted residual factors for significantly intense reflections: 0.0773
• Weighted residual factors for all reflections included in the refinement: 0.0832
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7054230
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No