Access the full text.
Sign up today, get DeepDyve free for 14 days.
Young-chul Kim, N. Park, Jae-Soon Shin, Sang Lee, Yong Lee, D. Moon (2003)
Partial oxidation of ethylene to ethylene oxide over nanosized Ag/α-Al2O3 catalystsCatalysis Today, 87
Simone Hauser, M. Cokoja, F. Kühn (2013)
Epoxidation of olefins with homogeneous catalysts – quo vadis?Catalysis Science & Technology, 3
J. Jankowiak, M. Barteau (2005)
Ethylene epoxidation over silver and copper-silver bimetallic catalysts: I. Kinetics and selectivityJournal of Catalysis, 236
D. Parker, M. Stiddard (1970)
Vibrational and electronic spectra of transition-metal carbonyl complexes. Part VII. Infrared spectra of some cyclopentadienyl-metal carbonyl complexesJournal of The Chemical Society A: Inorganic, Physical, Theoretical
R. Wiest, T. Leininger, G. Jeung, M. Bénard (1992)
Trioxorhenium as a strong acceptor group : Ab initio CI investigations on the Re-L bonding in L-ReO3 complexes (L = C5H5, CH3, Cl, F, CF3)The Journal of Physical Chemistry, 96
Patrick Huston, J. Espenson, A. Bakac (1993)
Methyltrioxorhenium-catalyzed oxidation of a (thiolato)cobalt(III) complex by hydrogen peroxideInorganic Chemistry, 32
M. Abrantes, A. Santos, J. Mink, F. Kühn, C. Romão (2003)
A Simple Entry to (η5-C5R5)chlorodioxomolybdenum(VI) Complexes (R = H, CH3, CH2Ph) and Their Use as Olefin Epoxidation CatalystsOrganometallics, 22
D. Parker (1970)
Infrared spectra (700–200 cm.–1) of some π-cyclopentadienyl–metal carbonyls and their substituted derivativesJournal of The Chemical Society A: Inorganic, Physical, Theoretical
Hui Huang, R. Hughes, A. Rheingold (2010)
Synthesis and Structural Characterization of New Perfluoroacyl and Perfluoroalkyl Group 6 Transition Metal CompoundsOrganometallics, 29
L. Hajba, J. Mink, F. Kühn, I. Gonçalves (2006)
Raman and infrared spectroscopic and theoretical studies of dinuclear rhenium and osmium complexes, M2(O2CCH3)4X2 (M = Re, Os; X = Cl, Br)Inorganica Chimica Acta, 359
Philipp Altmann, M. Cokoja, F. Kühn (2012)
Fluorinated Solvents in Methyltrioxorhenium-Catalyzed Olefin EpoxidationsEuropean Journal of Inorganic Chemistry, 2012
K. Sharpless, J. Townsend, D. Williams (1972)
Mechanism of epoxidation of olefins by covalent peroxides of molybdenum(VI)Journal of the American Chemical Society, 94
C. Romão, F. Kühn, W. Herrmann (1997)
Rhenium(VII) Oxo and Imido Complexes: Synthesis, Structures, and Applications.Chemical reviews, 97 8
R. King, M. Bisnette (1964)
Preparation and decarbonylation of acyl derivatives of cyclopentadienyl metal carbonylsJournal of Organometallic Chemistry, 2
I. Markovits, M. Anthofer, H. Kolding, M. Cokoja, A. Pöthig, A. Raba, W. Herrmann, R. Fehrmann, F. Kühn (2014)
Efficient epoxidation of propene using molecular catalystsCatalysis Science & Technology, 4
A. Bergner, M. Dolg, W. Küchle, H. Stoll, H. Preuss (1993)
Ab initio energy-adjusted pseudopotentials for elements of groups 13-17Molecular Physics, 80
C. Kraihanzel, F. Cotton (1962)
Vibrational Spectra and Bonding in Metal Carbonyls. I. Infrared Spectra of Phosphine-substituted Group VI Carbonyls in the CO Stretching RegionInorganic Chemistry, 2
A. Comas‐Vives, A. Lledós, R. Poli (2010)
A computational study of the olefin epoxidation mechanism catalyzed by cyclopentadienyloxidomolybdenum(VI) complexes.Chemistry, 16 7
M. Drees, Simone Hauser, M. Cokoja, F. Kühn (2013)
DFT studies on the reaction pathway of the catalytic olefin epoxidation with CpMoCF3 dioxo and oxo–peroxo complexesJournal of Organometallic Chemistry, 748
S. Huber, M. Cokoja, F. Kuehn (2014)
Historical Landmarks of the Application of Molecular Transition Metal Catalysts for Olefin EpoxidationChemInform, 45
C. Hall, R. Perutz (1996)
Transition Metal Alkane ComplexesChemical Reviews, 96
W. Hehre, R. Ditchfield, J. Pople (1972)
Self—Consistent Molecular Orbital Methods. XII. Further Extensions of Gaussian—Type Basis Sets for Use in Molecular Orbital Studies of Organic MoleculesJournal of Chemical Physics, 56
A. Valente, J. Seixas, I. Gonçalves, M. Abrantes, M. Pillinger, C. Romão (2005)
CpMo(CO)3Cl as a precatalyst for the epoxidation of olefinsCatalysis Letters, 101
P. Chaumette, H. Mimoun, L. Saussine, J. Fischer, A. Mitschler (1983)
Peroxo and alkylperoxidic molybdenum(VI) complexes as intermediates in the epoxidation of olefins by alkyl hydroperoxidesJournal of Organometallic Chemistry, 250
R. King, L. Houk (1969)
Carbonyl stretching frequencies and force constants in cyclopentadienylmolybdenum tricarbonyl derivativesCanadian Journal of Chemistry, 47
Paulo Costa, M. Calhorda, F. Kühn (2010)
Olefin Epoxidation Catalyzed by η5-Cyclopentadienyl Molybdenum Compounds: A Computational StudyOrganometallics, 29
Philipp Altmann, F. Kühn (2009)
Methyltrioxorhenium catalysed epoxidations: A comparative study of different N-donor ligandsJournal of Organometallic Chemistry, 694
Chengteh Lee, Weitao Yang, R. Parr (1988)
Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density.Physical review. B, Condensed matter, 37 2
M. Lein, A. Hammerl, H. Hermann, P. Schwerdtfeger (2007)
Theoretical investigations into trioxo group 7 compounds LRO3 with perfluorated ligandsPolyhedron, 26
N. Grover, A. Pöthig, F. Kühn (2014)
Cyclopentadienyl molybdenum alkyl ester complexes as catalyst precursors for olefin epoxidationCatalysis Science & Technology, 4
S. Köstlmeier, O. Häberlen, N. Rösch, W. Herrmann, B. Solouki, H. Bock (1996)
Density Functional Study on the Electronic Structure of Trioxorhenium OrganylsOrganometallics, 15
W. Thiel, Thomas Priermeier (1995)
The First Olefin‐Substituted Peroxomolybdenum Complex: Insight into a New Mechanism for the Molybdenum‐Catalyzed Epoxidation of OlefinsAngewandte Chemie, 34
J. Koola, D. Roddick (1991)
Synthesis and molecular structure of a molybdenum difluorocarbene complex, [(.eta.5-C5Me5)Mo(CO)3(CF2)]OSO2CF3Organometallics, 10
C. Mealli, José López, M. Calhorda, C. Romão, W. Herrmann (1994)
Multiple Bonds between Main-Group Elements and Transition Metals. 123. Re-C Bond Homolysis in Alkyl- and Arylrhenium Trioxides: A Qualitative MO InterpretationInorganic Chemistry, 33
É. Bencze, J. Mink, C. Németh, W. Herrmann, B. Lokshin, F. Kühn (2002)
Vibrational spectroscopic and force field studies of (η5-Cp)ML3-type complexes (M=Mn, Re; L=CO, O)Journal of Organometallic Chemistry, 642
Nidhi Kuhn (2012)
Catalytic Olefin Epoxidation with η5-Cyclopentadienyl Molybdenum ComplexesCurrent Organic Chemistry, 16
Simone Hauser, M. Cokoja, M. Drees, F. Kühn (2012)
Catalytic olefin epoxidation with a fluorinated organomolybdenum complexJournal of Molecular Catalysis A-chemical, 363
A. Al-Ajlouni, D. Veljanovski, A. Capapé, Jin Zhao, E. Herdtweck, M. Calhorda, F. Kühn (2009)
Kinetic Studies on the Oxidation of η5-Cyclopentadienyl Methyl Tricarbonyl Molybdenum(II) and the Use of Its Oxidation Products as Olefin Epoxidation CatalystsOrganometallics, 28
R. King, M. Bisnette (1967)
Organometallic chemistry of the transition metals XXI. Some π-pentamethylcyclopentadienyl derivatives of various transition metalsJournal of Organometallic Chemistry, 8
H. Mimoun, I. Roch, L. Sajus (1970)
Epoxydation des olefines par les complexes peroxydiques covalents du molybdene—VITetrahedron, 26
A. Raith, Philipp Altmann, M. Cokoja, W. Herrmann, F. Kühn, F. Kühn (2010)
η5,η1-Coordinated cyclopentadienyl transition metal complexes featuring σ-metal-carbon ansa bridgesCoordination Chemistry Reviews, 254
M. Galakhov, P. Gómez-Sal, T. Pedraz, M. Pellinghelli, P. Royo, A. Tiripicchio, A. Miguel (1999)
Cyclopentadienyl dithiocarbamate and dithiophosphate molybdenum and tungsten complexesJournal of Organometallic Chemistry, 579
F. Kühn, Ana Santos, M. Abrantes (2006)
Mononuclear organomolybdenum(VI) dioxo complexes: synthesis, reactivity, and catalytic applications.Chemical reviews, 106 6
P. Gisdakis, I. Yudanov, N. Rösch (2001)
Olefin epoxidation by molybdenum and rhenium peroxo and hydroperoxo compounds: a density functional study of energetics and mechanisms.Inorganic chemistry, 40 15
A. Becke (1993)
Density-functional thermochemistry. III. The role of exact exchangeJournal of Chemical Physics, 98
Six compounds of the type (CpMo(CO) 3 R) (R = Cl ( 1 ), CH 3 ( 2 ), CF 3 ( 3 )) and (CpMo(O 2 )(O)R) (R = Cl ( 4 ), CH 3 ( 5 ), CF 3 ( 6 ) (Cp = η 5 -cyclopentadienyl)) have been synthesised and characterised. The crystal structures of (CpMo(CO) 3 CF 3 ) and (CpMo(O 2 )(O)CF 3 ) are compared to their literature known chloro and methyl derivatives. The influence of the groups R on the performance as epoxidation catalysts is examined. DFT calculations, IR-spectroscopy and X-ray crystallography help to explain differences in reactivity and enable a rational design of active molybdenum tricarbonyl and oxo-peroxo complexes.
Catalysis Science & Technology – Royal Society of Chemistry
Published: Jan 15, 2015
Read and print from thousands of top scholarly journals.
Already have an account? Log in
Bookmark this article. You can see your Bookmarks on your DeepDyve Library.
To save an article, log in first, or sign up for a DeepDyve account if you don’t already have one.
Copy and paste the desired citation format or use the link below to download a file formatted for EndNote
Access the full text.
Sign up today, get DeepDyve free for 14 days.
All DeepDyve websites use cookies to improve your online experience. They were placed on your computer when you launched this website. You can change your cookie settings through your browser.