Information card for entry 4116128

Structure parameters

• Formula: C102 H94 Cl F6 N4 O15 P4 Pt2 S2
• Calculated formula: C102 H83 Cl F6 N4 O14 P4 Pt2 S2
• SMILES: [Pt]([P](c1ccccc1)(c1ccccc1)c1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)([n]1cc(C(=O)N)ccc1)c1ccc(cc1)C(=O)c1ccc([Pt]([P](c2ccccc2)(c2ccccc2)c2ccccc2)([P](c2ccccc2)(c2ccccc2)c2ccccc2)[n]2cc(C(=O)N)ccc2)cc1.Clc1ccccc1Cl.S(=O)(=O)([O-])C(F)(F)F.S(=O)(=O)([O-])C(F)(F)F.O.O.O.O.O
• Title of publication: Dinuclear Platinum Complexes with Hydrogen-Bonding Functionality: Noncovalent Assembly of Nanoscale Cyclic Arrays
• Authors of publication: Nathan C. Gianneschi; Edward R. T. Tiekink; Louis M. Rendina
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2000
• Journal volume: 122
• Pages of publication: 8474 - 8479
• a: 23.7736 ± 0.0005 Å
• b: 33.099 ± 0.0004 Å
• c: 28.179 ± 0.0006 Å
• α: 90°
• β: 108.096 ± 0.001°
• γ: 90°
• Cell volume: 21076.8 ± 0.7 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 9
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 0.084
• Weighted residual factors for all reflections included in the refinement: 0.11
• Goodness-of-fit parameter for all reflections included in the refinement: 2.52
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No