On the stability of the hydrogen chloride complexes with ethylene and acetylene. A high resolution gas phase and ab initio study
Författare
Summary, in English
The temperature dependencies of the intensities of the HCl stretching bands of the hydrogen chloride complexes with acetylene and ethylene have been used to obtain estimates of the dissociation enthalpies of the two complexes. Quantum chemical calculations on the Hartree Fock and DFT/B3LYP levels of theory have been combined with experimental data to give estimates of the intensities of the HCl stretching vibration in the two complexes.
Avdelning/ar
Publiceringsår
2003
Språk
Engelska
Sidor
733-741
Publikation/Tidskrift/Serie
Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy
Volym
59
Issue
4
Dokumenttyp
Artikel i tidskrift
Förlag
Elsevier
Ämne
- Atom and Molecular Physics and Optics
Nyckelord
- Hydrogen halide complexes
- Stabilities
- Quantum chemical calculations
- Ethylene
- Acetylene
Status
Published
ISBN/ISSN/Övrigt
- ISSN: 1386-1425