European Journal of Chemistry

Vibrational spectra and normal coordinate analysis of lithium pyruvate monohydrate and its isotopic compounds



Main Article Content

Kazuhiko Hanai
Akio Kuwae
Ko-Ki Kunimoto
Soh-Ichi Kitoh

Abstract

IR and Raman spectra of lithium pyruvate monohydrate and its O- and C-deuterated and 13C- and 18O-substituted compounds have been recorded in the solid state, and the observed bands have been assigned by using the isotope effects and the normal coordinate calculations based on the gem-diol structure (lithium 2,2-dihydroxypropionate). The refined force constants have well reproduced the observed frequencies and the 13C- and 18O-shifts. These results support the structures of these compounds discussed by many authors. The potential energy distributions show that many vibrational modes are very complicated except for the well-known group vibrations. The additive property of the isotopic frequency shifts has also been discussed.


icon graph This Abstract was viewed 1228 times | icon graph Article PDF downloaded 545 times icon graph Article SUPPLEMENTARY FILE downloaded 0 times

How to Cite
(1)
Hanai, K.; Kuwae, A.; Kunimoto, K.-K.; Kitoh, S.-I. Vibrational Spectra and Normal Coordinate Analysis of Lithium Pyruvate Monohydrate and Its Isotopic Compounds. Eur. J. Chem. 2014, 5, 305-310.

Article Details

Share
Crossref - Scopus - Google - European PMC
References

[1]. Bayard, P. Compt. Rend. 1937, 204, 177-179.

[2]. Josien, M. L.; Joussot-Dubien, M.; Vizet, J. Bull. Soc. Chim. Fr. 1957, 1148-1152.

[3]. Bellamy, L. J.; Willams, R. L. Biochem. J. 1958, 68, 81-84.

[4]. Anderson, D. M. W.; Bellamy, L. J.; Williams, R. L. Spectrochim. Acta 1958, 12, 233-238.
http://dx.doi.org/10.1016/0371-1951(58)80037-5

[5]. Jencks, W. P.; Carriuolo, J. Nature 1958, 182, 598-599.
http://dx.doi.org/10.1038/182598b0

[6]. Long, D. A.; George, W. O. Trans. Faraday Soc. 1960, 56, 1570-1581.
http://dx.doi.org/10.1039/tf9605601570

[7]. Long, D. A.; George, W. O. Proc. Chem. Soc. London 1960, 242-243.

[8]. Gold, V.; Socrates, G.; Crampton, M. R. J. Chem. Soc. 1964, 5888-5889.

[9]. Becker, M.; Ber. Bunsenges. 1964, 68, 669-676.

[10]. Greenzaid, P.; Luz, Z.; Samuel, D. J. Am. Chem. Soc. 1967, 89, 749-756.
http://dx.doi.org/10.1021/ja00980a004

[11]. Öjelund, G.; Wadsö, I. Acta. Chem. Scand. 1967, 21, 1408-1414.
http://dx.doi.org/10.3891/acta.chem.scand.21-1408

[12]. Pocker, Y.; Meany, J. E.; Nist, B. J.; Zadorojny, C. J. Phys. Chem. 1969, 73, 2879-2882.
http://dx.doi.org/10.1021/j100843a015

[13]. Larsen, P. O.; Wieczorkowska, E. Acta. Chem. Scand. 1974, B28, 92-96.
http://dx.doi.org/10.3891/acta.chem.scand.28b-0092

[14]. Cooper, A. J. L.; Redfield, A. G. J. Biol. Chem. 1975, 250, 527-532.

[15]. Kokesh, F. C. J. Org. Chem. 1976, 41, 3593-3599.
http://dx.doi.org/10.1021/jo00884a025

[16]. Sciacovelli, O.; Dell'Atti, A.; De Giglio, A.; Cassidei, L. Z. Naturforsch. 1976, 31c, 5-11.

[17]. Cassidei, L.; Dell'Atti, A.; Sciacovelli, O. Z. Naturforsch. 1976, 31c, 641-645.

[18]. Cassidei, L.; Dell'Atti, A.; Sciacovelli, O. Z. Naturforsch. 1980, 35c, 1-5.

[19]. Hollenstein, H. Ber. Bunsenges. Phys. Chem. 1978, 82, 55-57.
http://dx.doi.org/10.1002/bbpc.19780820135

[20]. Hollenstein, H.; Akermann, F.; Günthard, Hs. H. Spectrochim. Acta 1978, 34A, 1041-1063.
http://dx.doi.org/10.1016/0584-8539(78)80127-5

[21]. Katon, J. E.; Covington, D. T. Spectrosc. Lett. 1979, 12, 761-766.
http://dx.doi.org/10.1080/00387017908069202

[22]. Ray, W. J.; Katon, J. E.; Phillips, D. B. J. Mol. Struct. 1981, 74, 75-84.
http://dx.doi.org/10.1016/0022-2860(81)80009-9

[23]. Hurley, T. J.; Carrell, H. L.; Gupta, R. K.; Schwartz, J.; Glusker, J. P. Arch. Biochem. Biophys. 1979, 193, 478-486.
http://dx.doi.org/10.1016/0003-9861(79)90054-7

[24]. Kakihana, M.; Okamoto, M. J. Phys. Chem. 1984, 88, 1797-1804.
http://dx.doi.org/10.1021/j150653a026

[25]. Fischer, G.; Flatau, S.; Schellenberger, A.; Zschunke, A. J. Org. Chem. 1988, 53, 214-216.
http://dx.doi.org/10.1021/jo00236a050

[26]. Rach, W.; Gattow, G. Z. Anorg. Allg. Chem. 1988, 562, 160-164.
http://dx.doi.org/10.1002/zaac.19885620120

[27]. Kivach, L. N.; Ksenofontov, M. A.; Podtynchenko, S. G.; Strekal, N. D. Dokl. Akad. Nauk BSSR 1989, 33, 321-324.

[28]. Hanai, K.; Kuwae, A.; Kawai, S.; Ono, Y. J. Phys. Chem. 1989, 93, 6013-6016.
http://dx.doi.org/10.1021/j100353a016

[29]. Hanai, K.; Kawai, S.; Kuwae, A. J. Mol. Struct. 1991, 245, 21-27.
http://dx.doi.org/10.1016/0022-2860(91)87003-Z

[30]. Kuwae, A.; Hanai, K.; Oyama, K.; Uchino, M. Lee, H.-H. Spectrochim. Acta 1993, 49A, 125-133.
http://dx.doi.org/10.1016/0584-8539(93)80267-E

[31]. Reva, I. D.; Stepanian, S. G.; Adamowicz, L.; Fausto, R. J. Phys. Chem. 2001, A105, 4773-4780.

[32]. Duczmal, K.; Darowska, M.; Raczyńska, E. D. Vib. Spectrosc. 2005, 37, 77-82.
http://dx.doi.org/10.1016/j.vibspec.2004.06.006

[33]. Hanai, K.; Kuwae, A.; Sugawa, Y.; Kunimoto, K.-K.; Maeda, S. J. Mol. Struct. 2007, 837, 101-106.
http://dx.doi.org/10.1016/j.molstruc.2006.10.006

[34]. Zhu, J.; Geris, A. J.; Wu, G. Phys. Chem. Chem. Phys. 2009, 11, 6972-6980.
http://dx.doi.org/10.1039/b906438a

[35]. Nemenoff, R. A.; Snir, J.; Scheraga, H. A. J. Phys. Chem. 1978, 82, 2521-2526.
http://dx.doi.org/10.1021/j100512a012

[36]. Murto, J.; Raaska, T.; Kunttu, H.; Räsänen, M. J. Mol. Struct. (Theochem) 1989, 200, 93-101.
http://dx.doi.org/10.1016/0166-1280(89)85046-8

[37]. Zhou, Z.; Du, D.; Fu, A. Vib. Spectrosc. 2000, 23, 181-186.
http://dx.doi.org/10.1016/S0924-2031(00)00061-8

[38]. Duczmal, K.; Hallmann, M.; Raczyńska, E. D.; Gal, J.-F.; Maria, P.-C. Polish J. Chem. 2007, 81, 1011-1020.

[39]. Hanai, K.; Kuwae, A.; Kunimoto, K.-K.; Kitoh, S. (E-mail: hanai@nsc.nagoya-cu.ac.jp). Unpublished data.

[40]. Margolis, S. A.; Coxon, B. Anal. Chem. 1986, 58, 2504-2510.
http://dx.doi.org/10.1021/ac00125a033

[41]. Burton, T. M.; Degering, Ed. F. J. Am. Chem. Soc. 1940, 62, 227-227.

[42]. Tschelinzeff, W.; Schmidt, W. Chem. Ber. 1929, 62, 2210-2212.
http://dx.doi.org/10.1002/cber.19290620855

[43]. Miyake, A. Bull. Chem. Soc. Jpn. 1959, 32, 1381-1383.
http://dx.doi.org/10.1246/bcsj.32.1381

[44]. Kakihana, M.; Akiyama, M. J. Phys. Chem. 1987, 91, 4701-4709.
http://dx.doi.org/10.1021/j100302a015

[45]. Rach, W.; Kiel, G.; Gattow, G. Z. Anorg. Allg. Chem. 1988, 563, 87-95.
http://dx.doi.org/10.1002/zaac.19885630113

[46]. Mizushima, S.; Shimanouchi, T. Sekigaisen Kyushu to Raman Koka (Infrared Absorptions and Raman Effects), Kyouritsu-Shuppan Co., Tokyo, 1970.

[47]. Tanaka, C. Nippon Kagaku Zasshi 1962, 83, 657-660.
http://dx.doi.org/10.1246/nikkashi1948.83.6_657

[48]. Wilson, E. B. Jr; Decius, J. C.; Cross, P. C. Molecular Vibrations. The Theory of Infrared and Raman Vibrational Spectra, McGraw-Hill Book Co., Inc., New York, 1955.

Most read articles by the same author(s)

Most read articles by the same author(s)

TrendMD

Dimensions - Altmetric - scite_ - PlumX

Downloads and views

Downloads

Download data is not yet available.

Metrics

Metrics Loading ...
License Terms

License Terms

by-nc

Copyright © 2024 by Authors. This work is published and licensed by Atlanta Publishing House LLC, Atlanta, GA, USA. The full terms of this license are available at https://www.eurjchem.com/index.php/eurjchem/terms and incorporate the Creative Commons Attribution-Non Commercial (CC BY NC) (International, v4.0) License (http://creativecommons.org/licenses/by-nc/4.0). By accessing the work, you hereby accept the Terms. This is an open access article distributed under the terms and conditions of the CC BY NC License, which permits unrestricted non-commercial use, distribution, and reproduction in any medium, provided the original work is properly cited without any further permission from Atlanta Publishing House LLC (European Journal of Chemistry). No use, distribution, or reproduction is permitted which does not comply with these terms. Permissions for commercial use of this work beyond the scope of the License (https://www.eurjchem.com/index.php/eurjchem/terms) are administered by Atlanta Publishing House LLC (European Journal of Chemistry).