Information card for entry 4302560

Structure parameters

• Chemical name: Bis{(mu-adamantylimido)selane-N,N')silver(I)}(adamantylammonium)- tris(trifluoromethylsulfate)
• Formula: C64 H96 Ag2 F12 N6 O12 S4 Se2
• Calculated formula: C64 H96 Ag2 F12 N6 O12 S4 Se2
• SMILES: C(F)(F)(S(=O)(=O)[O-])F.C(F)(F)(F)S(=O)(=O)[O-].[NH3+]C12CC3CC(C1)CC(C2)C3.[Ag]12[N](C34CC5CC(C3)CC(C4)C5)=[Se]=[N]([Ag]2[N](C23CC4CC(C2)CC(C3)C4)=[Se]=[N]1C12CC3CC(C1)CC(C2)C3)C12CC3CC(C1)CC(C2)C3.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[NH3+]C12CC3CC(C1)CC(C2)C3
• Title of publication: Preparation, Structure, and Metallophilic Interactions of Dinuclear Silver(I) and Copper(I) Complexes of Selenium Diimides
• Authors of publication: Maarit Risto; Teemu T. Takaluoma; Tom Bajorek; Raija Oilunkaniemi; Risto S. Laitinen; Tristram Chivers
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 6271 - 6279
• a: 11.453 ± 0.002 Å
• b: 12.007 ± 0.002 Å
• c: 15.581 ± 0.003 Å
• α: 68.81 ± 0.03°
• β: 70.67 ± 0.03°
• γ: 74.18 ± 0.03°
• Cell volume: 1856.4 ± 0.7 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 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: 0.1471
• Residual factor for significantly intense reflections: 0.0743
• Weighted residual factors for significantly intense reflections: 0.1609
• Weighted residual factors for all reflections included in the refinement: 0.1882
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No