Information card for entry 7009186

Structure parameters

• Formula: C52 H58 Ag2 F12 N6 O2 P2
• Calculated formula: C52 H58 Ag2 F12 N6 O2 P2
• SMILES: [Ag]123[n]4c(cccc4c4cccc5[n]14[Ag]1([n]4c5cccc4C)[n]4c(cccc4c4[n]31c(ccc4)c1[n]2c(C)ccc1)O[C@H]1C[C@H]2CC[C@]1(C)C2(C)C)O[C@H]1C[C@H]2CC[C@]1(C)C2(C)C.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Regio- and diastereo-selective formation of dicopper(I) and disilver(I) double helicates with chiral 6-substituted 2,2'∶6',2″-terpyridines
• Authors of publication: Baum, Gerhard; Constable, Edwin C.; Fenske, Dieter; Housecroft, Catherine E.; Kulke, Torsten; Neuburger, Markus; Zehnder, Margareta
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 6
• Pages of publication: 945
• a: 24.641 ± 0.007 Å
• b: 12.669 ± 0.002 Å
• c: 8.39 ± 0.003 Å
• α: 90°
• β: 95.59 ± 0.03°
• γ: 90°
• Cell volume: 2606.7 ± 1.3 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 7
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0257
• Residual factor for significantly intense reflections: 0.0253
• Weighted residual factors for all reflections: 0.0702
• Weighted residual factors for significantly intense reflections: 0.0687
• Goodness-of-fit parameter for all reflections: 1.065
• Goodness-of-fit parameter for significantly intense reflections: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKa
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No