A hydrogen bonded complex C2H2…HBr isolated and characterized in the gas phase using pulsed-jet, Fourier transform microwave spectroscopy

2003 ◽  
Vol 101 (4-5) ◽  
pp. 603-612 ◽  
Author(s):  
G. C. COLE ◽  
J. B. DAVEY ◽  
A. C. LEGON ◽  
A. F. LYNDON
Keyword(s):  
Fourier Transform ◽  
Gas Phase ◽  
Microwave Spectroscopy ◽  
Pulsed Jet ◽  
Fourier Transform Microwave Spectroscopy ◽  
Hydrogen Bonded

Competitive tetrel bond and hydrogen bond in benzaldehyde-CO2: Characterization by rotational spectroscopy

2021 ◽  
Author(s):  
Hao Wang ◽  
Xiujuan Wang ◽  
Xiao Tian ◽  
Wanying Cheng ◽  
Yang Zheng ◽  
...  
Keyword(s):  
Hydrogen Bond ◽  
Fourier Transform ◽  
Quantum Chemical Calculations ◽  
Quantum Chemical ◽  
Microwave Spectroscopy ◽  
Rotational Spectroscopy ◽  
Rotational Spectrum ◽  
Pulsed Jet ◽  
Tetrel Bond ◽  
Fourier Transform Microwave Spectroscopy

The rotational spectrum of the 1:1 benzaldehyde-CO2 complex has been investigated by pulsed-jet Fourier transform microwave spectroscopy complemented with quantum chemical calculations. Two isomers, both characterized by one C···O tetrel...

Conformational preference determined by inequivalent n-pairs: rotational studies on acetophenone and its monohydrate

2019 ◽  
Vol 21 (41) ◽  
pp. 22888-22894 ◽  
Author(s):  
Juncheng Lei ◽  
Jiaqi Zhang ◽  
Gang Feng ◽  
Jens-Uwe Grabow ◽  
Qian Gou
Keyword(s):  
Fourier Transform ◽  
Quantum Chemical Calculations ◽  
Quantum Chemical ◽  
Microwave Spectroscopy ◽  
Conformational Preference ◽  
Pulsed Jet ◽  
Fourier Transform Microwave Spectroscopy

Acetophenone and its complex with water have been investigated by using pulsed jet Fourier transform microwave spectroscopy complemented with quantum chemical calculations.

scholarly journals Unveiling epimerization effects: a rotational study of α-d-galactose

2015 ◽  
Vol 51 (50) ◽  
pp. 10115-10118 ◽  
Author(s):  
Isabel Peña ◽  
Carlos Cabezas ◽  
José L. Alonso
Keyword(s):  
Fourier Transform ◽  
Laser Ablation ◽  
Gas Phase ◽  
Microwave Spectroscopy ◽  
Fourier Transform Microwave Spectroscopy

Four conformers of α-d-galactose have been detected in the gas phase by laser ablation coupled with broadband Fourier transform microwave spectroscopy.

Competitive and cooperative n → π* and n → σ* interactions in benzaldehyde–formaldehyde: rotational characterization

2021 ◽  
Vol 23 (14) ◽  
pp. 8778-8783
Author(s):  
Hao Wang ◽  
Juan Wang ◽  
Junhua Chen ◽  
Sven Herbers ◽  
Huaili Zheng ◽  
...  
Keyword(s):  
Fourier Transform ◽  
Ab Initio ◽  
Microwave Spectroscopy ◽  
Rotational Spectrum ◽  
Pulsed Jet ◽  
Fourier Transform Microwave Spectroscopy

The rotational spectrum of the 1 : 1 benzaldehyde–formaldehyde complex has been investigated by pulsed jet Fourier transform microwave spectroscopy combined with ab initio calculations.

Rotational spectrum and properties of the hydrogen-bonded heterodimer H 2 O· · · HCN from pulsed-nozzle, Fourier-transform microwave spectroscopy

1984 ◽  
Vol 396 (1811) ◽  
pp. 405-423 ◽  
Keyword(s):  
Fourier Transform ◽  
Microwave Spectroscopy ◽  
Coupling Constants ◽  
Spectroscopic Constants ◽  
Rotational Spectrum ◽  
Quadrupole Coupling ◽  
Nuclear Quadrupole ◽  
Fourier Transform Microwave Spectroscopy ◽  
Pulsed Nozzle ◽  
Hydrogen Bonded

The ground state rotational spectrum of a hydrogen-bonded heterodimer formed from water and hydrogen cyanide has been detected and measured by using the technique of pulsed-nozzle, Fourier-transform microwave spectroscopy. Rotational constants ( B 0 , C 0 ) centrifugal distortion constants ( ∆ J , ∆ JK ) and, where appropriate, 14 N-, D- or 17 O-nuclear quadrupole coupling constants have been determined for the following isotopic species; H 2 16 O· · · HC 14 N, H 2 18 O· · · HC 14 N, H 2 16 O· · · HC 15 N, HD 16 O· · · HC 15 N, D 2 16 O· · · HC 15 N, H 2 16 O· · · DC 15 N, HD 16 O· · · DC 15 N and H 2 17 O· · · HC 15 N. An analysis of these spectroscopic constants indicates that the heterodimer is effectively planar, with a pair of equivalent protons and the arrangement H 2 O· · · HCN. The intermolecular interaction is through a hydrogen bond between HCN and H 2 O and the distance between the O and C nuclei r (O· · · C) is 3.157 Å (1Å = 10 -10 m). An interpretation of the nuclear quadrupole coupling constants leads to the conclusion that arccos <cos 2 Φ > ½ ≈ 51°, where Φ is the angle between the local C 2 axis of H 2 O and the a -axis of the complex; and that arccos <cos 2 θ > ½ ≈ 10°, where θ is the angle between the HCN axis and the a -axis. The intermolecular stretching force constant k σ = 11 Nm -1 has been determined from ∆ J .

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