Information card for entry 7056050

Structure parameters

• Formula: C30 H40 Ag N4 O4 P
• Calculated formula: C30 H40 Ag N4 O4 P
• SMILES: c1cccc2c3c4cccc[n]4c(c4c(cccc4)O)[n]3[Ag]([n]12)[P](CCCC)(CCCC)CCCC.N(=O)(=O)[O-]
• Title of publication: Tuning the fluorescence emission in mononuclear heteroleptic trigonal silver(i) complexes
• Authors of publication: Durini, Sara; Ardizzoia, G. Attilio; Therrien, Bruno; Brenna, Stefano
• Journal of publication: New J. Chem.
• Year of publication: 2017
• Journal volume: 41
• Journal issue: 8
• Pages of publication: 3006
• a: 19.5618 ± 0.0005 Å
• b: 8.2302 ± 0.0011 Å
• c: 20.9709 ± 0.0011 Å
• α: 90°
• β: 112.52°
• γ: 90°
• Cell volume: 3118.8 ± 0.5 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 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: 0.0623
• Residual factor for significantly intense reflections: 0.0408
• Weighted residual factors for significantly intense reflections: 0.0922
• Weighted residual factors for all reflections included in the refinement: 0.0977
• Goodness-of-fit parameter for all reflections included in the refinement: 0.906
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No