Information card for entry 7013383

Structure parameters

• Formula: C74 H66 Ag2 F6 N8 O7 S2
• Calculated formula: C74 H66 Ag2 F6 N8 O7 S2
• SMILES: [Ag]12([n]3c4ccccc4c4ccccc4c3C=[N]1[C@@H]1CCCC[C@@H]1[N]([Ag]134)=Cc5[n]1c1c(c6c5cccc6)cccc1)[n]1c5ccccc5c5ccccc5c1C=[N]2C1CCCCC1[N]3=Cc1[n]4c2c(c3c1cccc3)cccc2.S(=O)(=O)([O-])C(F)(F)F.S(=O)(=O)([O-])C(F)(F)F.O(CC)CC.[Ag]12([n]3c4ccccc4c4ccccc4c3C=[N]1[C@H]1CCCC[C@H]1[N]([Ag]134)=Cc5[n]1c1c(c6c5cccc6)cccc1)[n]1c5ccccc5c5ccccc5c1C=[N]2C1CCCCC1[N]3=Cc1[n]4c2c(c3c1cccc3)cccc2.S(=O)(=O)([O-])C(F)(F)F.S(=O)(=O)([O-])C(F)(F)F.O(CC)CC
• Title of publication: Double helical and monomeric Ag(i) and Zn(ii) complexes of 1,2-cyclohexanediyl-bis(iminophenanthridine) ligands
• Authors of publication: Amendola, Valeria; Diaz Fernandez, Yuri; Mangano, Carlo; Montalti, Marco; Pallavicini, Piersandro; Prodi, Luca; Zaccheroni, Nelsi; Zema, Michele
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 22
• Pages of publication: 4340
• a: 12.317 ± 0.003 Å
• b: 16.705 ± 0.004 Å
• c: 17.211 ± 0.005 Å
• α: 91.09 ± 0.02°
• β: 97 ± 0.02°
• γ: 105.857 ± 0.018°
• Cell volume: 3376 ± 1.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1184
• Residual factor for significantly intense reflections: 0.0595
• Weighted residual factors for significantly intense reflections: 0.1231
• Weighted residual factors for all reflections included in the refinement: 0.144
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No