Regioisomer-specific electron affinities and electronic structures of C70para-adducts at polar and equatorial positions with (bromo)benzyl radicals: photoelectron spectroscopy and theoretical study

2016 ◽  
Vol 18 (28) ◽  
pp. 18683-18686
Author(s):  
Gao-Lei Hou ◽  
Lei-Jiao Li ◽  
Shu-Hui Li ◽  
Zhong-Ming Sun ◽  
Xiang Gao ◽  
...  
Keyword(s):  
Photoelectron Spectroscopy ◽  
Electronic Structures ◽  
Theoretical Study ◽  
Negative Ion ◽  
Electron Affinities ◽  
Benzyl Radicals

Negative ion photoelectron spectroscopy shows that the electron affinities of 2,5-polar adducts of C70 are higher than their 7,23-equatorial counterparts.

scholarly journals Electrospray ionization photoelectron spectroscopy of cryogenic [EDTA·M(ii)]2− complexes (M = Ca, V–Zn): electronic structures and intrinsic redox properties

2019 ◽  
Vol 217 ◽  
pp. 383-395 ◽  
Author(s):  
Qinqin Yuan ◽  
Xiang-Tao Kong ◽  
Gao-Lei Hou ◽  
Ling Jiang ◽  
Xue-Bin Wang
Keyword(s):  
Transition Metal ◽  
Electrospray Ionization ◽  
Photoelectron Spectroscopy ◽  
Electronic Structures ◽  
Theoretical Study ◽  
Redox Properties ◽  
Edta Complexes

A systematic photoelectron spectroscopy and theoretical study of divalent transition metal EDTA complexes illustrating the intrinsic correlations of redox properties in the gas and solution phases.

Fullerene cyanation does not always increase electron affinity: an experimental and theoretical study

2015 ◽  
Vol 17 (1) ◽  
pp. 551-556 ◽  
Author(s):  
Tyler T. Clikeman ◽  
Shihu H. M. Deng ◽  
Alexey A. Popov ◽  
Xue-Bin Wang ◽  
Steven H. Strauss ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Low Temperature ◽  
Electron Affinity ◽  
Photoelectron Spectroscopy ◽  
Density Functional ◽  
Theoretical Study ◽  
Electron Affinities ◽  
Functional Theory ◽  
Cyano Groups

The electron affinities of C70 derivatives with trifluoromethyl, methyl and cyano groups were studied experimentally and theoretically using low-temperature photoelectron spectroscopy (LT PES) and density functional theory (DFT).

scholarly journals Negative ion photoelectron spectroscopy of P2N3−: electron affinity and electronic structures of P2N3˙

2016 ◽  
Vol 7 (7) ◽  
pp. 4667-4675 ◽  
Author(s):  
Gao-Lei Hou ◽  
Bo Chen ◽  
Wesley J. Transue ◽  
David A. Hrovat ◽  
Christopher C. Cummins ◽  
...  
Keyword(s):  
Electronic Structure ◽  
Ab Initio ◽  
Electron Affinity ◽  
Photoelectron Spectroscopy ◽  
Electronic Structures ◽  
Electronic Structure Calculations ◽  
Negative Ion ◽  
Aromatic Molecule ◽  
High Level ◽  
Structure Calculations

The newly synthesized P2N3−, a planar all-inorganic aromatic molecule is investigated by negative ion photoelectron spectroscopy and high-level ab initio electronic structure calculations.

Photoelectron spectroscopy and computational investigations of the electronic structures and noncovalent interactions of cyclodextrin-closo-dodecaborate anion complexes χ-CD·B12X122− (χ = α, β, γ; X = H, F)

2020 ◽  
Vol 22 (14) ◽  
pp. 7193-7200 ◽  
Author(s):  
Zhipeng Li ◽  
Yanrong Jiang ◽  
Qinqin Yuan ◽  
Jonas Warneke ◽  
Zhubin Hu ◽  
...  
Keyword(s):  
Photoelectron Spectroscopy ◽  
Electronic Structures ◽  
Computational Study ◽  
Noncovalent Interactions ◽  
Negative Ion ◽  
Anion Complexes

We report a joint negative ion photoelectron spectroscopy and computational study on the electronic structures and noncovalent interactions of a series of cyclodextrin-closo-dodecaborate dianion complexes, χ-CD·B12X122− (χ = α, β, γ; X = H, F).

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