Structure and Internal Motions of a Multifunctional Alcohol–Water Complex: Rotational Spectroscopy of the Propargyl Alcohol···H2O Dimer

2021 ◽  
Author(s):  
Sharon Priya Gnanasekar ◽  
Elangannan Arunan
Keyword(s):  
Propargyl Alcohol ◽  
Rotational Spectroscopy ◽  
Water Complex ◽  
Internal Motions ◽  
Alcohol Water

Accessing different binding sites of a multifunctional molecule: IR spectroscopy of propargyl alcohol⋯water complexes in helium droplets

2019 ◽  
Vol 21 (37) ◽  
pp. 20582-20587 ◽  
Author(s):  
Devendra Mani ◽  
Nitish Pal ◽  
Mathias Smialkowski ◽  
Claudio Beakovic ◽  
Gerhard Schwaab ◽  
...  
Keyword(s):  
Ir Spectroscopy ◽  
Binding Sites ◽  
Local Minimum ◽  
Propargyl Alcohol ◽  
Helium Droplets ◽  
Water Complex ◽  
Alcohol Water

Helium droplets facilitate the formation of two distinct local minimum structures for 1 : 1 propargyl alcohol⋯water complex.

From the propargyl alcohol–water complex to the propargyl alcohol dimer: where does the propargyl alcohol–methanol complex fit in?

2019 ◽  
Vol 43 (9) ◽  
pp. 3969-3980 ◽  
Author(s):  
Jyoti Saini ◽  
K. S. Viswanathan
Keyword(s):  
Propargyl Alcohol ◽  
Water Complex ◽  
Alcohol Water

A correlation was recognized between the structures of PA–H2O, PA–MeOH and PA dimer complexes that could help predict the structures of larger systems in a systematic way.

ROTATIONAL SPECTROSCOPY OF THE METHYL GLYCIDATE-WATER COMPLEX

2017 ◽  
Author(s):  
Yunjie Xu ◽  
Wolfgang Jäger ◽  
Zhibo Wang ◽  
Javix Thomas ◽  
Jason Gall
Keyword(s):  
Rotational Spectroscopy ◽  
Water Complex

Chalcogen bond and internal dynamics of the 2,2,4,4-tetrafluoro-1,3-dithietane⋯water complex

2019 ◽  
Vol 21 (28) ◽  
pp. 15656-15661 ◽  
Author(s):  
Yan Jin ◽  
Xiaolong Li ◽  
Qian Gou ◽  
Gang Feng ◽  
Jens-Uwe Grabow ◽  
...  
Keyword(s):  
High Resolution ◽  
Rotational Spectroscopy ◽  
Rotational Spectrum ◽  
Internal Dynamics ◽  
Chalcogen Bond ◽  
Water Complex

The rotational spectrum of the 2,2,4,4-tetrafluoro-1,3-dithietane⋯water complex has been investigated by high resolution rotational spectroscopy. Inversion of the water around its C2 axis is hindered by a barrier determined to be 87.4(2) cm−1.

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