Information card for entry 7024263

Structure parameters

• Formula: C79 H67 B Co N2 P3 Pt S2
• Calculated formula: C79 H67 B Co N2 P3 Pt S2
• SMILES: [Pt]12([n]3c4c5[n]2cccc5ccc4ccc3)SC2=C([Co]342[P](c2ccccc2)(CC(C[P]3(c2ccccc2)c2ccccc2)(C)C[P]4(c2ccccc2)c2ccccc2)c2ccccc2)S1.c1cc(ccc1)[B-](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Acetylenedithiolate as directional bridging ligand in cobalt(I) alkyne platinum dithiolato bimetallic complexes.
• Authors of publication: Seidel, Wolfram W.; Meel, Matthias J.; Hupka, Florian; Weigand, Jan J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 2
• Pages of publication: 624 - 631
• a: 11.1143 ± 0.0006 Å
• b: 17.6581 ± 0.0012 Å
• c: 18.2065 ± 0.0011 Å
• α: 64.204 ± 0.004°
• β: 89.668 ± 0.004°
• γ: 89.378 ± 0.005°
• Cell volume: 3216.9 ± 0.4 ų
• Cell temperature: 153 ± 1 K
• Ambient diffraction temperature: 153 ± 1 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0876
• Residual factor for significantly intense reflections: 0.0688
• Weighted residual factors for significantly intense reflections: 0.16
• Weighted residual factors for all reflections included in the refinement: 0.1737
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No