Ab mitio molecular-orbital calculations (SD CI/6-31G\*\*) confrrm that the most stable [CrH,O]+ tsomer is the distonic ton [CH2CH20H2]+. Mass spectrometrtc measurements give A HtlqX = 732k 5 kJ mol-'. Thts ion interconverts with a yet-un-Identified isomer, [CH,=CH.. H.. OH2 ]+. a hydrogen-bridged wa
✦ LIBER ✦
Long-lived distonic radical cations
✍ Scribed by Hilkka I. Kenttämaa
- Publisher
- John Wiley and Sons
- Year
- 1994
- Tongue
- English
- Weight
- 806 KB
- Volume
- 29
- Category
- Article
- ISSN
- 1076-5174
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Radical cations derived from the ethers ROCH,CH,OR (R, R = H, CH, , C,HJ were studied, since Bdistonic oxonium ions are often prepared from ionized ethers of glycol. The first step in the fragmentation is a 1,Stransfer of an a-hydrogen to oxygen of a terminal alkoxy group leading to a Wistonic oxoni
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