Difluorocarbene Studied with Threshold Photoelectron Spectroscopy (TPES): Measurement of the First Adiabatic Ionization Energy (AIE) of CF2

2008 ◽  
Vol 14 (36) ◽  
pp. 11452-11460 ◽  
Author(s):  
Fabrizio Innocenti ◽  
Marie Eypper ◽  
Edmond P. F. Lee ◽  
Stefano Stranges ◽  
Daniel K. W. Mok ◽  
...  
Keyword(s):  
Photoelectron Spectroscopy ◽  
Ionization Energy ◽  
Adiabatic Ionization Energy

scholarly journals VUV photoionization of the CH2NC radical: adiabatic ionization energy and cationic vibrational mode wavenumber determinations

2020 ◽  
Vol 22 (22) ◽  
pp. 12496-12501
Author(s):  
Bérenger Gans ◽  
Sebastian Hartweg ◽  
Gustavo A. Garcia ◽  
Séverine Boyé-Péronne ◽  
Oliver J. Harper ◽  
...  
Keyword(s):  
Photoelectron Spectroscopy ◽  
Ionization Energy ◽  
Vibrational Mode ◽  
Radical Species ◽  
Vuv Photoionization ◽  
Adiabatic Ionization Energy ◽  
First Time

The photoelectron spectroscopy of CH2NC (isocyanomethyl) radical species is investigated for the first time between 9.3 and 11.2 eV in the vicinity of the first photoionizing transition X+1A1 ← X 2B1.

scholarly journals Corrigendum: Difluorocarbene studied with Threshold Photoelectron Spectroscopy (TPES): Measurement of the first Adiabatic Ionization Energy (AIE) of CF 2

2020 ◽  
Vol 26 (66) ◽  
pp. 15337-15337
Author(s):  
Fabrizio Innocenti ◽  
Marie Eypper ◽  
Edmond P. F. Lee ◽  
Stefano Stranges ◽  
Daniel K. W. Mok ◽  
...  
Keyword(s):  
Photoelectron Spectroscopy ◽  
Ionization Energy ◽  
Adiabatic Ionization Energy

Ionization Energy and Thermochemistry of CF2Cl2 Determined from Threshold Photoelectron Spectroscopy

2021 ◽  
pp. 138631
Author(s):  
Hanhui Zhang ◽  
Tongpo Yu ◽  
Xiangkun Wu ◽  
Yan Chen ◽  
Baokun Shan ◽  
...  
Keyword(s):  
Photoelectron Spectroscopy ◽  
Ionization Energy

Adiabatic ionization energy and electron affinity of CH2Br

1993 ◽  
Vol 99 (9) ◽  
pp. 6470-6473 ◽  
Author(s):  
Z.‐X. Ma ◽  
C.‐L. Liao ◽  
C. Y. Ng ◽  
Ngai Ling Ma ◽  
Wai‐Kee Li
Keyword(s):  
Electron Affinity ◽  
Ionization Energy ◽  
Adiabatic Ionization Energy

Application of photoelectron spectroscopy to substituent effects. Conformational analysis of some flexible allylic ethers and alcohols

1979 ◽  
Vol 57 (14) ◽  
pp. 1890-1896 ◽  
Author(s):  
R. S. Brown ◽  
R. W. Marcinko ◽  
A. Tse
Keyword(s):  
Conformational Analysis ◽  
Gas Phase ◽  
Photoelectron Spectroscopy ◽  
Ionization Energy ◽  
Substituent Effects ◽  
Allylic Alcohol ◽  
Tert Butyl ◽  
Cis And Trans ◽  
Allylic Ethers

He(I) photoelectron (pe) spectroscopy is applied to determine the preferred gas phase conformations of a limited number of flexible allylic ethers and alcohols. Based on earlier observations that the π-ionization energy is increased more when the allylic C—O bond is coplanar (with the π-system) than when it is perpendicular, the pe spectrum of cis and trans-4-tert-butyl-2-cyclohexanol and their corresponding ethers, and 5α-hydroxy(and methoxy)-10α-Δ3-octalin have been determined. The results indicate that when a coplanar arrangement of the allylic C—O bond can be attained, it is preferred, leading to a favored conformation of the allylic alcohol or ether.

scholarly journals Explicit solvent simulations of the aqueous oxidation potential and reorganization energy for neutral molecules: gas phase, linear solvent response, and non-linear response contributions

2015 ◽  
Vol 17 (22) ◽  
pp. 14811-14826 ◽  
Author(s):  
Jennifer J. Guerard ◽  
Peter R. Tentscher ◽  
Marianne Seijo ◽  
J. Samuel Arey
Keyword(s):  
Gas Phase ◽  
Ionization Energy ◽  
Linear Response ◽  
Reorganization Energy ◽  
Oxidation Potential ◽  
Adiabatic Ionization Potential ◽  
Explicit Solvent ◽  
Non Linear ◽  
Aqueous Oxidation ◽  
Adiabatic Ionization Energy

Explicit solvent simulations are used to partition the aqueous adiabatic ionization potential (AIEaq) into the gas phase adiabatic ionization energy (AIEgas), linear solvent response (ΔΔGLRAsolv), and non-linear solvent response (ΔΔΔGnon-LRsolv) contributions.

ChemInform Abstract: Adiabatic Ionization Energy of CH3SSCH3.

ChemInform ◽  
2010 ◽  
Vol 25 (8) ◽  
pp. no-no
Author(s):  
W.-K. LI ◽  
S.-W. CHIU ◽  
Z.-X. MA ◽  
C.-L. LIAO ◽  
C. Y. NG
Keyword(s):  
Ionization Energy ◽  
Adiabatic Ionization Energy
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