Information card for entry 1515098

Structure parameters

• Formula: C132 H104 Ag4 F24 N16 P4
• Calculated formula: C132 H104 Ag4 F24 N16 P4
• SMILES: [Ag](=C1N2C(c3ccccc3)=C(c3ccccc3)N1CN1C(=[Ag]3)N(C(c4ccccc4)=C1c1ccccc1)CCN1C(c4ccccc4)=C(c4ccccc4)N(CN4C(c5ccccc5)=C(c5ccccc5)N(CC2)C=34)C1=[Ag]1)=C2N3CCN4C(c5ccccc5)=C(c5ccccc5)N(CN5C(c6ccccc6)=C(c6ccccc6)N(C=15)CCN1C(c5ccccc5)=C(c5ccccc5)N(C1=[Ag]1)CN2C(c2ccccc2)=C3c2ccccc2)C=14.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Exploiting a dimeric silver transmetallating reagent to synthesize macrocyclic tetracarbene complexes
• Authors of publication: Lu, Zheng; Cramer, S. Alan; Jenkins, David M.
• Journal of publication: Chemical Science
• Year of publication: 2012
• Journal volume: 3
• Journal issue: 10
• Pages of publication: 3081
• a: 14.122 ± 0.002 Å
• b: 17.707 ± 0.003 Å
• c: 32.571 ± 0.005 Å
• α: 93.111 ± 0.002°
• β: 97.694 ± 0.002°
• γ: 109.952 ± 0.002°
• Cell volume: 7543 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0648
• Residual factor for significantly intense reflections: 0.0447
• Weighted residual factors for significantly intense reflections: 0.1148
• Weighted residual factors for all reflections included in the refinement: 0.1231
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No