Information card for entry 7702647

Structure parameters

• Formula: C19 H32 F12 N2 P2 Pd S2
• Calculated formula: C19 H32 F12 N2 P2 Pd S2
• Title of publication: New linked macrocyclic systems. Interaction of palladium(ii) and platinum(ii) with tri-linked N2S2-donor macrocycles and their single-ring analogues
• Authors of publication: Atkinson, Ian M.; Chartres, Jy D.; Groth, Andrew M.; Lindoy, Leonard F.; Lowe, Mark P.; Meehan, George V.; Skelton, Brian W.; White, Allan H.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2001
• Journal issue: 19
• Pages of publication: 2801
• a: 8.712 ± 0.003 Å
• b: 9.094 ± 0.002 Å
• c: 34.48 ± 0.02 Å
• α: 90°
• β: 92 ± 0.04°
• γ: 90°
• Cell volume: 2730.1 ± 1.9 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 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: 0.05
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for all reflections: 0.053
• Weighted residual factors for all reflections included in the refinement: 0.052
• Goodness-of-fit parameter for all reflections: 1.207
• Goodness-of-fit parameter for all reflections included in the refinement: 1.33
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No