Information card for entry 4026579

Structure parameters

• Common name: Dan Eddings Ag-1
• Chemical name: Silver(I) chloride complex with chiral (all R) pyrazol
• Formula: C31 H28 Ag Cl N2
• Calculated formula: C31 H28 Ag Cl N2
• Title of publication: Design and Synthesis of C2-Symmetric N-Heterocyclic Carbene Precursors and Metal Carbenoids
• Authors of publication: Abigail Albright; Daniel Eddings; Regina Black; Christopher J. Welch; Nikolay N. Gerasimchuk; Robert E. Gawley
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2011
• Journal volume: 76
• Pages of publication: 7341 - 7351
• a: 34.92 ± 0.005 Å
• b: 9.8441 ± 0.0015 Å
• c: 16.837 ± 0.002 Å
• α: 90°
• β: 116.653 ± 0.002°
• γ: 90°
• Cell volume: 5172.8 ± 1.2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0634
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.0753
• Weighted residual factors for all reflections included in the refinement: 0.0857
• Goodness-of-fit parameter for all reflections included in the refinement: 0.998
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No