Estimation of gas-phase hydroxyl radical rate constants of oxygenated compounds based on molecular orbital calculations

Chemosphere

Volumn 32, Issue 4, 1996, Pages 717-726

  Klamt, Andreas ^a  

^a BAYER AG   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

ALCOHOL DERIVATIVE; ALDEHYDE; ALKYNE; CARBONIC ACID; ETHER DERIVATIVE; HYDROXYL RADICAL; KETONE; ORGANIC COMPOUND;

ARTICLE; ASSAY; CHEMICAL REACTION KINETICS; REACTION ANALYSIS;

EID: 0030029591     PISSN: 00456535     EISSN: None     Source Type: Journal    
DOI: 10.1016/0045-6535(95)00352-5     Document Type: Article

References (8)

1. Atkinson, R.(1986), Chem. Rev. 86, 69; (1988), Envir. Toxicol. Chem. 7, 435
2. Atkinson, R.(1986), Chem. Rev. 86, 69; (1988), Envir. Toxicol. Chem. 7, 435
3. Atkinson, R., (1989), J. Phys. Chem. Reference Data. Monograph 1
4. Dagaut, P., T.J. Wallington, R. Liu, M.J. Kurylo (1988), J. Phys. Chem. 92, 4375,
5. Dewar, M.J.S., E.G. Zoebisch, E.F. Healy, J.J.P. Stewart (1985) , J. Am. Chem. Soc. 107, 3092
6. Klamt, A. (1993), Chemosphere 26, 1273
7. Rayez, M.T., D.J. Scollard, J.J. Treacy, H.W. Sidebottom, C. Balestra-Garcia, S. Teton, G. Le Bras (1994), Chem. Phys. Letters 223, 452
8. Wallington, T.J., P. Dagout, M.J. Kurylo (1988), J. Phys. Chem. 92, 5024