Estimates of hydride ion stability in condensed systems: energy of formation and solvation in aqueous and polar-organic solvents

Citation
Ca. Kelly et Dr. Rosseinsky, Estimates of hydride ion stability in condensed systems: energy of formation and solvation in aqueous and polar-organic solvents, PHYS CHEM P, 3(11), 2001, pp. 2086-2090
Citations number
55
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
ISSN journal
14639076 → ACNP
Volume
3
Issue
11
Year of publication
2001
Pages
2086 - 2090
Database
ISI
SICI code
1463-9076(2001)3:11<2086:EOHISI>2.0.ZU;2-A
Abstract
Fundamental to its chemical and electrochemical-especially electrochromic-r eactions, energies of formation of the hydride anion in several solvents (a nd concomitant solvation energies) were re-evaluated via a radius estimate derived from differing theoretical approaches of satisfactory mutual consis tency. The values (Gibbs free energies-ions at the standard 1 mol dm(-3), g ases at 100 kPa; 25 degreesC) with subscripted error-estimates were, in kJ mol(-1), for water 141(4), acetonitrile 207(9), N,N-dimethylformamide 228(1 4), dimethyl sulfoxide 219(11), methanol 156(9) (a first estimate), and nit robenzene 183(11) (a first estimate). The aqueous, acetonitrile and N,N-dim ethylformamide values are substantial revisions.