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CNDO/2 calculation on gas-phase basicity of amines, alcohols and ethers

✍ Scribed by Mo Feng-Kui; Wang Zhi-Zhong; Jiang Yuan-Sun


Book ID
112058501
Publisher
John Wiley and Sons
Year
1983
Tongue
English
Weight
634 KB
Volume
1
Category
Article
ISSN
0256-7660

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Abstmct: The behaviour towards gas-phase protonation of a series of 2,6-dimethyl-4-X-acetophenones DMl exhibits strong similarities with that of the corresponding 4-X-acetophenones 1. A comparison with previous hasicity data in solution and AM1 semiempirical calculations suggest that the X-dependent