Information card for entry 4303734

Structure parameters

• Formula: C56 H40 Ag2 N16 O8 Re2
• Calculated formula: C56 H40 Ag2 N16 O8 Re2
• SMILES: c1[n]2c(c3[n]([Ag]452[n]2c(cccc2)c2ncc[n]6[Ag]7([n]8ccnc(c8c8[n]7cccc8)c7ccccn7)([n]7c(c26)cccc7)[n]2c(c6ncc[n]4c6c4[n]5cccc4)cccc2)cccc3)c(c2ccccn2)nc1.[O-][Re](=O)(=O)=O.O=[Re](=O)(=O)[O-]
• Title of publication: Ligand-Based Modification of the Structures and Optical Properties of New Silver(I)-Rhenate(VII) Oxide/Organic Hybrid Solids
• Authors of publication: Haisheng Lin; Xiaomeng Wu; Paul A. Maggard
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 11265 - 11276
• a: 9.7798 ± 0.0005 Å
• b: 10.9114 ± 0.0005 Å
• c: 14.0695 ± 0.001 Å
• α: 102.678 ± 0.003°
• β: 105.191 ± 0.003°
• γ: 104.828 ± 0.002°
• Cell volume: 1332.96 ± 0.14 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0623
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.0774
• Weighted residual factors for all reflections included in the refinement: 0.0867
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No