Information card for entry 7009100

Structure parameters

• Formula: C276 H232 B4 Cl8 F16 P16 Pd2 S16
• Calculated formula: C278 H234 B4 Cl8 F16 P16 Pd2 S16
• Title of publication: Homoleptic complexes of Ag(I), Cu(I), Pd(II) and Pt(II) with tetrathiafulvalene-functionalized phosphine ligands †
• Authors of publication: Smucker, Bradley W.; Dunbar, Kim R.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 8
• Pages of publication: 1309
• a: 22.527 ± 0.004 Å
• b: 16.736 ± 0.003 Å
• c: 17.944 ± 0.004 Å
• α: 90°
• β: 112.4 ± 0.03°
• γ: 90°
• Cell volume: 6255 ± 3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.1552
• Residual factor for significantly intense reflections: 0.0764
• Weighted residual factors for significantly intense reflections: 0.1593
• Weighted residual factors for all reflections included in the refinement: 0.1959
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No