Atomic charges for variable molecular conformations - Journal of the

Sunder Ramachandran, T. G. Lenz, W. M. Skiff, and A. K. Rappé. The Journal of .... Araz Jakalian , Bruce L. Bush , David B. Jack , Christopher I. Bay...
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J . Am. Chem. SOC.1992,114,9075-9079 (0.43 mmol) was then added and the reaction allowed continue for 1.5 h. The reaction was then quenched with 5 mL of 0.1 M hydrochloric acid with noticeable evolution Of gas, and the organic phase was extracted, dried over MgS04,and concentrated under vacuum. An NMR analysis

of the solid organic residue revealed unreacted naphthalene and minor impurities of tin-coupled vinylic C-CH- resonances (