DETERMINATION OF THE H2O-NO2-NO2+ BOND STRENGTHS AND THE PROTON AFFINITIES OF NITRIC-ACID AND METHYL NITRATE( AND CH3O(H))

Citation
Ls. Sunderlin et Rr. Squires, DETERMINATION OF THE H2O-NO2-NO2+ BOND STRENGTHS AND THE PROTON AFFINITIES OF NITRIC-ACID AND METHYL NITRATE( AND CH3O(H)), Chemical physics letters, 212(3-4), 1993, pp. 307-311
Citations number
18
Categorie Soggetti
Physics, Atomic, Molecular & Chemical
Journal title
ISSN journal
00092614
Volume
212
Issue
3-4
Year of publication
1993
Pages
307 - 311
Database
ISI
SICI code
0009-2614(1993)212:3-4<307:DOTHBS>2.0.ZU;2-Z
Abstract
The binding energies of water and methanol to NO2+ have been measured to be 14.8 +/- 2.3 and 19.2 +/- 2.3 kcal/mol, respectively, using ener gy-resolved collision-induced dissociation of H2O-NO2+ and CH3O(H)-NO2 + in a flowing afterglow triple quadrupole apparatus. These values are used with literature thermochemistry to derive proton affinities for nitric acid and methyl nitrate: PA(HONO2) = 177.7 +/- 2.3 kcal/mol and PA(CH3ONO2) = 175.0 +/- 2.5 kcal/mol. These results are in good agree ment with recent calculations by Lee and Rice, but only the methyl nit rate result is in agreement with experimental results of Cacace and co workers.