DOI: 10.1063/1.435022. Normal coordinate analyses of the neutral CO3 and SO4 molecules

Normal coordinate analyses of the neutral CO3 and SO4 molecules

10.1063/1.435022

Crossref journal-article

AIP Publishing

The Journal of Chemical Physics (317)

Abstract

Normal coordinate analyses for the neutral molecules CO3 and SO4 were made. For the CO3 molecule a trans Cs structure was found to be more suitable than the three-membered ring C2v bridged structure, based on frequency and isotopic fit and force constant transferability. Three structures were considered for the SO4 molecule: C3v, C2v bridged structure, and Cs. The Cs structure was preferred because of the agreement between observed and calculated frequencies and reasonable values for the force constants.

Bibliography

LaBonville, P., Kugel, R., & Ferraro, J. R. (1977). Normal coordinate analyses of the neutral CO3 and SO4 molecules. The Journal of Chemical Physics, 67(4), 1477â1481.

Authors 3

P. LaBonville (first)
R. Kugel (additional)
J. R. Ferraro (additional)

References 25 Referenced 19

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10.1021/es60060a001 / Environ. Sci. Technol. (1972)
10.1016/0045-6535(72)90008-2 / Chemosphere (1972)
10.1021/j100650a003 / J. Phys. Chem. (1972)
10.1016/0021-8502(72)90044-4 / J. Aerosol. Sci. (1972)
10.1021/ja01054a015 / J. Am. Chem. Soc. (1969)
{'key': '2024020915370784700_r10'}
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10.1063/1.1743420 / J. Chem. Phys. (1957)
{'key': '2024020915370784700_r13', 'first-page': '4060', 'volume': '87', 'year': '1965', 'journal-title': 'J. Am. Chem. Soc.'} / J. Am. Chem. Soc. (1965)
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{'key': '2024020915370784700_r24'}
{'key': '2024020915370784700_r25'}

Dates

Type	When
Created	22 years, 6 months ago (Feb. 12, 2003, 4:34 p.m.)
Deposited	1 year, 6 months ago (Feb. 9, 2024, 11:26 a.m.)
Indexed	1 month, 2 weeks ago (July 8, 2025, 7:30 a.m.)
Issued	48 years ago (Aug. 15, 1977)
Published	48 years ago (Aug. 15, 1977)
Published Print	48 years ago (Aug. 15, 1977)

Funders 0

None

BibTeX

@article{LaBonville_1977, title={Normal coordinate analyses of the neutral CO3 and SO4 molecules}, volume={67}, ISSN={1089-7690}, url={http://dx.doi.org/10.1063/1.435022}, DOI={10.1063/1.435022}, number={4}, journal={The Journal of Chemical Physics}, publisher={AIP Publishing}, author={LaBonville, P. and Kugel, R. and Ferraro, J. R.}, year={1977}, month=aug, pages={1477–1481} }

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