Energetics and Structural Properties, in the Gas Phase, of trans-Hydroxycinnamic Acids

2012 ◽  
Vol 116 (9) ◽  
pp. 2261-2267 ◽  
Author(s):  
Juan Z. Dávalos ◽  
Rebeca Herrero ◽  
Antonio Chana ◽  
Andrés Guerrero ◽  
Pilar Jiménez ◽  
...  
Keyword(s):  
Gas Phase ◽  
Structural Properties ◽  
Hydroxycinnamic Acids

Optical and Structural Properties of Copper−Oxytocin Dications in the Gas Phase

2009 ◽  
Vol 113 (32) ◽  
pp. 11293-11300 ◽  
Author(s):  
Laure Joly ◽  
Rodolphe Antoine ◽  
Florian Albrieux ◽  
Renaud Ballivian ◽  
Michel Broyer ◽  
...  
Keyword(s):  
Gas Phase ◽  
Structural Properties

scholarly journals Structural characterization of nucleotide 5′-triphosphates by infrared ion spectroscopy and theoretical studies

2018 ◽  
Vol 20 (44) ◽  
pp. 28319-28330 ◽  
Author(s):  
Rianne E. van Outersterp ◽  
Jonathan Martens ◽  
Giel Berden ◽  
Jeffrey D. Steill ◽  
Jos Oomens ◽  
...  
Keyword(s):  
Gas Phase ◽  
Structural Properties ◽  
Structural Characterization ◽  
Spectroscopic Studies ◽  
Theoretical Studies ◽  
Ion Spectroscopy ◽  
Ir Spectroscopic

Gas-phase IR spectroscopic studies and supporting theoretical studies have been performed on adenosine 5′-triphosphate, cytosine 5′-triphosphate and guanosine 5′-triphosphate to elucidate the structural properties of the NTPs by focusing on the influence of the nucleobase and the extent of deprotonation.

Neutral, Ion Gas-Phase Energetics and Structural Properties of Hydroxybenzophenones

2010 ◽  
Vol 75 (8) ◽  
pp. 2564-2571 ◽  
Author(s):  
Juan Z. Dávalos ◽  
Andrés Guerrero ◽  
Rebeca Herrero ◽  
Pilar Jimenez ◽  
Antonio Chana ◽  
...  
Keyword(s):  
Gas Phase ◽  
Structural Properties

Structural properties of CH3CN–SO2 in the gas phase and condensed-phase media via density functional theory and infrared spectroscopy

2009 ◽  
Vol 919 (1-3) ◽  
pp. 312-320 ◽  
Author(s):  
Audrey A. Eigner ◽  
John P. Wrass ◽  
Elizabeth L. Smith ◽  
Christopher C. Knutson ◽  
James A. Phillips
Keyword(s):  
Density Functional Theory ◽  
Infrared Spectroscopy ◽  
Gas Phase ◽  
Structural Properties ◽  
Condensed Phase ◽  
Density Functional ◽  
Functional Theory

scholarly journals Gas Phase Acidity Measurement of Local Acidic Groups in Multifunctional Species: Controlling the Binding Sites in Hydroxycinnamic Acids

2013 ◽  
Vol 135 (26) ◽  
pp. 9681-9690 ◽  
Author(s):  
Andres Guerrero ◽  
Tomas Baer ◽  
Antonio Chana ◽  
Javier González ◽  
Juan Z. Dávalos
Keyword(s):  
Gas Phase ◽  
Binding Sites ◽  
Hydroxycinnamic Acids ◽  
Gas Phase Acidity

scholarly journals Structural Properties of Gas Phase Molybdenum Sulfide Clusters [Mo3S13]2–, [HMo3S13]−, and [H3Mo3S13]+ as Model Systems of a Promising Hydrogen Evolution Catalyst

2018 ◽  
Vol 123 (13) ◽  
pp. 8177-8186 ◽  
Author(s):  
Aristeidis Baloglou ◽  
Milan Ončák ◽  
Marie-Luise Grutza ◽  
Christian van der Linde ◽  
Philipp Kurz ◽  
...  
Keyword(s):  
Gas Phase ◽  
Hydrogen Evolution ◽  
Structural Properties ◽  
Molybdenum Sulfide ◽  
Model Systems ◽  
Sulfide Clusters
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