Ab Initio Study of Proton Affinities of Three Crown Ethers
- 1 January 1996
- journal article
- research article
- Published by American Chemical Society (ACS) in The Journal of Physical Chemistry
- Vol. 100 (18), 7367-7371
- https://doi.org/10.1021/jp951840g
Abstract
No abstract availableKeywords
This publication has 12 references indexed in Scilit:
- The Development of a Program Visualizing Results of Vibrational Analysis Calculation Using ab initio Molecular Orbital MethodChemistry Letters, 1995
- An Ab Initio Investigation of the Structure and Alkali Metal Cation Selectivity of 18-Crown-6Journal of the American Chemical Society, 1994
- A correlation between proton affinities and intramolecular hydrogen bonds in bifunctional organic compoundsThe Journal of Physical Chemistry, 1992
- Thermodynamic and kinetic data for macrocycle interactions with cations and anionsChemical Reviews, 1991
- A new configuration of 12-crown-4The Journal of Physical Chemistry, 1991
- Ab initio determination of the proton affinities of small neutral and anionic moleculesJournal of Computational Chemistry, 1986
- Protonation of polyethers, glymes, and crown ethers in the gas phaseJournal of the American Chemical Society, 1984
- The ionic hydrogen bond. 2. Intramolecular and partial bonds. Protonation of polyethers, crown ethers, and diketonesJournal of the American Chemical Society, 1983
- Gas-phase basicities of amines. Hydrogen bonding in proton-bound amine dimers and proton-induced cyclization of .alpha., .omega.-diaminesJournal of the American Chemical Society, 1973
- The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errorsMolecular Physics, 1970