Information card for entry 7053776

Structure parameters

• Common name: [AgCl(IBp)].CH2Cl2
• Formula: C28 H22 Ag Cl3 N2
• Calculated formula: C28 H22 Ag Cl3 N2
• SMILES: [Ag](Cl)=C1N(C=CN1c1c(cccc1)c1ccccc1)c1c(cccc1)c1ccccc1.ClCCl
• Title of publication: Preparation of a super bulky silver N-heterocyclic carbene complex
• Authors of publication: Alexander, Sean G.; Cole, Marcus L.; Morris, Jonathan C.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2009
• Journal volume: 33
• Journal issue: 4
• Pages of publication: 720
• a: 9.4785 ± 0.0019 Å
• b: 10.348 ± 0.002 Å
• c: 14.088 ± 0.003 Å
• α: 69.73 ± 0.03°
• β: 76.14 ± 0.03°
• γ: 82.22 ± 0.03°
• Cell volume: 1256.4 ± 0.5 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0343
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.0772
• Weighted residual factors for all reflections included in the refinement: 0.0791
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No