Information card for entry 7045108

Structure parameters

• Formula: C53 H50 Ag2 F12 N4 O P4
• Calculated formula: C53 H50 Ag2 F12 N4 O P4
• SMILES: [Ag]12([n]3c(c4[n]2c(C)ccc4)cccc3C)([P](c2ccccc2)(C#C[P]([Ag]2[n]3c(c4[n]2c(ccc4)C)cccc3C)(c2ccccc2)c2ccccc2)c2ccccc2)[F][P](F)(F)(F)(F)[F]1.[P](F)(F)(F)(F)(F)[F-].O=C(C)C
• Title of publication: Self-assembly of heteroleptic dinuclear silver(i) complexes bridged by bis(diphenylphosphino)ethyne.
• Authors of publication: Keller, Sarah; Camenzind, Timothy N.; Abraham, Johannes; Prescimone, Alessandro; Häussinger, Daniel; Constable, Edwin C.; Housecroft, Catherine E.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 3
• Pages of publication: 946 - 957
• a: 11.4217 ± 0.0007 Å
• b: 15.4399 ± 0.001 Å
• c: 16.5048 ± 0.001 Å
• α: 90.991 ± 0.002°
• β: 107.581 ± 0.002°
• γ: 101.888 ± 0.002°
• Cell volume: 2705.3 ± 0.3 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 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: 0.0366
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for all reflections: 0.081
• Weighted residual factors for significantly intense reflections: 0.0806
• Weighted residual factors for all reflections included in the refinement: 0.081
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9224
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No