Molecular and Electronic Structures of Mononuclear Iron Complexes Using Strongly Electron-Donating Ligands and their Oxidized Forms

2008 ◽  
Vol 47 (15) ◽  
pp. 6804-6824 ◽  
Author(s):  
Julia B. H. Strautmann ◽  
Serena DeBeer George ◽  
Eberhard Bothe ◽  
Eckhard Bill ◽  
Thomas Weyhermüller ◽  
...  
Keyword(s):  
Electronic Structures ◽  
Iron Complexes ◽  
Mononuclear Iron

scholarly journals Stabilities, Electronic Structures, and Bonding Properties of Iron Complexes (E 1 E 2 )Fe(CO) 2 (CNAr Tripp2 ) 2 (E 1 E 2 =BF, CO, N 2 , CN − , or NO + )**

ChemistryOpen ◽  
2020 ◽  
Vol 9 (11) ◽  
pp. 1195-1201
Author(s):  
Gerui Pei ◽  
Pei Zhao ◽  
Song Xu ◽  
Xintian Zhao ◽  
Chuncai Kong ◽  
...  
Keyword(s):  
Electronic Structures ◽  
Iron Complexes ◽  
Bonding Properties

Mononuclear Iron Complexes with Tetraazadentate Ligands as Water Oxidation Catalysts

2016 ◽  
Vol 2016 (20) ◽  
pp. 3262-3268 ◽  
Author(s):  
Gayatri Panchbhai ◽  
Wangkheimayum Marjit Singh ◽  
Biswanath Das ◽  
Reuben T. Jane ◽  
Anders Thapper
Keyword(s):  
Water Oxidation ◽  
Iron Complexes ◽  
Oxidation Catalysts ◽  
Mononuclear Iron

The Hei and HeH Photoelectron Spectra of [Fe*?3-C3H5(CO)3X] and [Fe^3-C4H7 (CO)3X] (X = Cl, Br, I) and [CoC3H5(CO)3]

1982 ◽  
Vol 37 (2) ◽  
pp. 179-185 ◽  
Author(s):  
Jaap N. Louwen ◽  
Jaap Hart ◽  
Derk J. Stufkens ◽  
Ad Oskam
Keyword(s):  
Photoelectron Spectroscopy ◽  
Electronic Structures ◽  
Lone Pair ◽  
Iron Complexes ◽  
Photoelectron Spectra ◽  
Pair Type ◽  
Ionization Energies ◽  
Uv Photoelectron Spectroscopy

Abstract By means of UV photoelectron spectroscopy (UPS) the electronic structures of [Feη3.C3H5(CO)3X], [Feη3-(2-CH3C3H4)(CO)3X] (X = Cl, Br, I) and [Co(C3H5)(CO)3] have been studied. Detailed assignments are possible and surprisingly low ionization energies (as low as 8.19 eV) are found for iodine lone pair type Orbitals. From the spectra a large difference in π backbonding is found between the cobalt and iron complexes

scholarly journals Coordination and conformational isomers in mononuclear iron complexes with pertinence to the [FeFe] hydrogenase active site

2014 ◽  
Vol 43 (11) ◽  
pp. 4537-4549 ◽  
Author(s):  
Andreas Orthaber ◽  
Michael Karnahl ◽  
Stefanie Tschierlei ◽  
Daniel Streich ◽  
Matthias Stein ◽  
...  
Keyword(s):  
Electronic Properties ◽  
Active Site ◽  
Iron Complexes ◽  
Computational Studies ◽  
Mononuclear Iron ◽  
Conformational Isomers ◽  
Ligand Modification ◽  
Fe Complexes ◽  
Ir Spectroscopic

6 Fe complexes of the type [Fe(X-bdt)(PR2NPh2)(CO)] were prepared and the possibility to tune their electronic properties by ligand modification was demonstrated. IR spectroscopic and computational studies suggest that the compounds exist as a mixture of isomers in solution.

Unraveling the Electronic Structures of Low-Valent Naphthalene and Anthracene Iron Complexes: X-ray, Spectroscopic, and Density Functional Theory Studies

2012 ◽  
Vol 51 (12) ◽  
pp. 6719-6730 ◽  
Author(s):  
Eva-Maria Schnöckelborg ◽  
Marat M. Khusniyarov ◽  
Bas de Bruin ◽  
František Hartl ◽  
Thorsten Langer ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Electronic Structures ◽  
Density Functional ◽  
Iron Complexes ◽  
Functional Theory ◽  
X Ray ◽  
Low Valent

Dinitrosyl–iron complexes with thiol-containing ligands: Spatial and electronic structures

Nitric Oxide ◽  
2007 ◽  
Vol 16 (1) ◽  
pp. 82-93 ◽  
Author(s):  
Anatoly F. Vanin ◽  
Natalia A. Sanina ◽  
Vladimir A. Serezhenkov ◽  
Dosymzhan Sh. Burbaev ◽  
Vladimir I. Lozinsky ◽  
...  
Keyword(s):  
Electronic Structures ◽  
Iron Complexes ◽  
Dinitrosyl Iron Complexes ◽  
Dinitrosyl Iron
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