Information card for entry 4127273

Structure parameters

• Formula: C27 H43 Ag Cl N
• Calculated formula: C27 H43 Ag Cl N
• SMILES: C1(C[C@]2([C@@H]([Ag]Cl)N1c1c(cccc1C(C)C)C(C)C)C[C@@H](CC[C@H]2C(C)C)C)(C)C
• Title of publication: "Quick-Silver" from a Systematic Study of Highly Luminescent, Two-Coordinate, d¹⁰ Coinage Metal Complexes.
• Authors of publication: Hamze, Rasha; Shi, Shuyang; Kapper, Savannah C.; Muthiah Ravinson, Daniel Sylvinson; Estergreen, Laura; Jung, Moon-Chul; Tadle, Abegail C.; Haiges, Ralf; Djurovich, Peter I.; Peltier, Jesse L.; Jazzar, Rodolphe; Bertrand, Guy; Bradforth, Stephen E.; Thompson, Mark E.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 21
• Pages of publication: 8616 - 8626
• a: 9.17 ± 0.002 Å
• b: 15.012 ± 0.003 Å
• c: 9.662 ± 0.002 Å
• α: 90°
• β: 93.909 ± 0.004°
• γ: 90°
• Cell volume: 1327 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0379
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for significantly intense reflections: 0.0814
• Weighted residual factors for all reflections included in the refinement: 0.0838
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No