Information card for entry 7711206

Structure parameters

• Formula: C67 H64 Ag F3 N4 O5 S
• Calculated formula: C67 H64 Ag F3 N4 O5 S
• SMILES: [Ag]123[N]4(CC[N]1(CC[N]2(CC[N]3(CC4)Cc1ccccc1)Cc1ccc(OCc2c3ccccc3cc3ccccc23)cc1)Cc1ccccc1)Cc1ccc(OCc2c3ccccc3cc3ccccc23)cc1.S(=O)(=O)([O-])C(F)(F)F
• Title of publication: Argentivorous molecules with chromophores: dependence of fluorescence intensity on the distance between donor and acceptor
• Authors of publication: Ju, Huiyeong; Hiraoka, Takao; Horita, Hiroki; Lee, Eunji; Ikeda, Mari; Kuwahara, Shunsuke; Habata, Yoichi
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 14.5272 ± 0.0013 Å
• b: 14.529 ± 0.0014 Å
• c: 15.8434 ± 0.0015 Å
• α: 94.4274 ± 0.0019°
• β: 99.9833 ± 0.0018°
• γ: 116.599 ± 0.0015°
• Cell volume: 2898.9 ± 0.5 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 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: 0.0603
• Residual factor for significantly intense reflections: 0.0493
• Weighted residual factors for significantly intense reflections: 0.1134
• Weighted residual factors for all reflections included in the refinement: 0.1202
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No