Details
| Original language | English |
|---|---|
| Pages (from-to) | 7876-7881 |
| Number of pages | 6 |
| Journal | Journal of Physical Chemistry A |
| Volume | 121 |
| Issue number | 41 |
| Early online date | 4 Oct 2017 |
| Publication status | Published - 19 Oct 2017 |
Abstract
1,1,1,2-Tetrafluoroethane dimer was investigated by pulsed jet Fourier transform microwave spectroscopy. One conformer, stabilized through a network of four C-H···F-C interactions, was observed, although several almost isoenergetic configurations were suggested by ab initio calculations. The measurements, extended to four 13C species in natural abundance, allowed determination of the carbon skeleton structures and evaluation of the weak hydrogen bond parameters. Information on the dissociation energy is also provided.
ASJC Scopus subject areas
- Chemistry(all)
- Physical and Theoretical Chemistry
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In: Journal of Physical Chemistry A, Vol. 121, No. 41, 19.10.2017, p. 7876-7881.
Research output: Contribution to journal › Article › Research › peer review
}
TY - JOUR
T1 - Weak Hydrogen Bond Network
T2 - A Rotational Study of 1,1,1,2-Tetrafluoroethane Dimer
AU - Li, Xiaolong
AU - Zheng, Yang
AU - Chen, Junhua
AU - Grabow, Jens Uwe
AU - Gou, Qian
AU - Xia, Zhining
AU - Feng, Gang
N1 - Funding Information: This work was supported by the Foundation of 100 Young Chongqing University (Grant 0220001104441) and the Fundamental Research Funds for the Central Universities (Grant 106112017CDJQJ228807). Publisher Copyright: © 2017 American Chemical Society. Copyright: Copyright 2017 Elsevier B.V., All rights reserved.
PY - 2017/10/19
Y1 - 2017/10/19
N2 - 1,1,1,2-Tetrafluoroethane dimer was investigated by pulsed jet Fourier transform microwave spectroscopy. One conformer, stabilized through a network of four C-H···F-C interactions, was observed, although several almost isoenergetic configurations were suggested by ab initio calculations. The measurements, extended to four 13C species in natural abundance, allowed determination of the carbon skeleton structures and evaluation of the weak hydrogen bond parameters. Information on the dissociation energy is also provided.
AB - 1,1,1,2-Tetrafluoroethane dimer was investigated by pulsed jet Fourier transform microwave spectroscopy. One conformer, stabilized through a network of four C-H···F-C interactions, was observed, although several almost isoenergetic configurations were suggested by ab initio calculations. The measurements, extended to four 13C species in natural abundance, allowed determination of the carbon skeleton structures and evaluation of the weak hydrogen bond parameters. Information on the dissociation energy is also provided.
UR - http://www.scopus.com/inward/record.url?scp=85032859156&partnerID=8YFLogxK
U2 - 10.1021/acs.jpca.7b07007
DO - 10.1021/acs.jpca.7b07007
M3 - Article
C2 - 28926244
AN - SCOPUS:85032859156
VL - 121
SP - 7876
EP - 7881
JO - Journal of Physical Chemistry A
JF - Journal of Physical Chemistry A
SN - 1089-5639
IS - 41
ER -