Information card for entry 4334436

Structure parameters

• Formula: C60 H76 Ag4 F24 N16 P4
• Calculated formula: C60 H76 Ag4 F24 N16 P4
• SMILES: C12N(C=CN1CC)Cc1cc3c4CN5C(N(CC)C=C5)=[Ag]=C5N(C=CN5CC)Cc5c(CN6C(N(CC)C=C6)=[Ag]=C6N(C=CN6CC)C3)cc(c(CN3C(N(CC)C=C3)=[Ag]=C3N(C=CN3CC)Cc1c4)c5)CN1C(=[Ag]=2)N(CC)C=C1.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Role of Wingtip Substituents on Benzene-Platform-Based Tetrapodal Ligands toward the Formation of a Self-Assembled Silver Carbene Cage
• Authors of publication: B. Nisar Ahamed; Ranjan Dutta; Pradyut Ghosh
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 4269 - 4276
• a: 18.3487 ± 0.0018 Å
• b: 18.3487 ± 0.0018 Å
• c: 13.031 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4387.2 ± 0.8 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 136
• Hermann-Mauguin space group symbol: P 42/m n m
• Hall space group symbol: -P 4n 2n
• Residual factor for all reflections: 0.0358
• Residual factor for significantly intense reflections: 0.0334
• Weighted residual factors for significantly intense reflections: 0.1194
• Weighted residual factors for all reflections included in the refinement: 0.1221
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No