Information card for entry 7062390

Structure parameters

• Formula: C12 H30 Br2 Cl6 N2 Pd2
• Calculated formula: C12 H30 Br2 Cl6 N2 Pd2
• Title of publication: A new supramolecular semiconductor palladium(ii) complex [(CH3)3N(CH2)3Br]2Pd2Cl6: structural study, optical and electrical properties
• Authors of publication: Dakhlaoui, Imen; Karoui, Karim; Hajlaoui, Fadhel; Zaghrioui, Mustapha; Audebrand, Nathalie; Dallon, Marie; Jomni, Fathi
• Journal of publication: New Journal of Chemistry
• Year of publication: 2023
• Journal volume: 47
• Journal issue: 17
• Pages of publication: 8042 - 8049
• a: 20.469 ± 0.004 Å
• b: 8.7255 ± 0.0014 Å
• c: 13.948 ± 0.002 Å
• α: 90°
• β: 95.129 ± 0.005°
• γ: 90°
• Cell volume: 2481.2 ± 0.7 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• 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: 0.1209
• Residual factor for significantly intense reflections: 0.1114
• Weighted residual factors for significantly intense reflections: 0.2528
• Weighted residual factors for all reflections included in the refinement: 0.2571
• Goodness-of-fit parameter for all reflections included in the refinement: 1.295
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No