Information card for entry 4507666

Structure parameters

• Formula: C36 H34 Ag F6 N6 P
• Calculated formula: C36 H34 Ag F6 N6 P
• SMILES: [Ag]([n]1c(/C=C/C2=CC(=C(C#N)C#N)CC(C2)(C)C)cccc1)[n]1c(/C=C/C2=CC(=C(C#N)C#N)CC(C2)(C)C)cccc1.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Diverse Structural Ag(I) Supramolecular Complexes Constructed from Multidentate Dicyanoisophorone-Based Ligands: Structures and Enhanced Luminescence
• Authors of publication: Jin, Feng; Zhang, Ying; Wang, Hui-Zhen; Zhu, Hui-Zhi; Yan, Yan; Zhang, Jun; Wu, Jie-Ying; Tian, Yu-Peng; Zhou, Hong-Ping
• Journal of publication: Crystal Growth & Design
• Year of publication: 2013
• Journal volume: 13
• Journal issue: 5
• Pages of publication: 1978
• a: 15.619 ± 0.005 Å
• b: 16.746 ± 0.005 Å
• c: 14.115 ± 0.005 Å
• α: 90 ± 0.005°
• β: 102.196 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 3609 ± 2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0828
• Residual factor for significantly intense reflections: 0.0446
• Weighted residual factors for significantly intense reflections: 0.1139
• Weighted residual factors for all reflections included in the refinement: 0.1439
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No