Information card for entry 7203925

Structure parameters

• Formula: C16 H32 Pd2 S2
• Calculated formula: C16 H32 Pd2 S2
• SMILES: C1[Pd]23([C]1(C)=[CH2]2)[S](C(C)(C)C)[Pd]12([C](C)(=[CH2]1)C2)[S]3C(C)(C)C
• Title of publication: Organochalcogenido-bridged dimeric 2-methylallylpalladium complexes: synthesis, structure and their transformation into palladium chalcogenides
• Authors of publication: Singhal, A.; Jain, V. K.; Mishra, R.; Varghese, Babu
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2000
• Journal volume: 10
• Journal issue: 5
• Pages of publication: 1121
• a: 12.369 ± 0.003 Å
• b: 13.674 ± 0.002 Å
• c: 12.38 ± 0.0016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2093.9 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 20
• Hermann-Mauguin space group symbol: C 2 2 21
• Hall space group symbol: C 2c 2
• Residual factor for all reflections: 0.0213
• Residual factor for significantly intense reflections: 0.0184
• Weighted residual factors for significantly intense reflections: 0.0448
• Weighted residual factors for all reflections included in the refinement: 0.047
• Goodness-of-fit parameter for all reflections included in the refinement: 1.189
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No