Research Output 1988 2019

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2002

In Situ Formation of Allyl Ketones via Hiyama-Nozaki Reactions Followed by a Chromium-Mediated Oppenauer Oxidation

Schrekker, H. S., de Bolster, M. W. G., Orru, R. V. A. & Wessjohann, L. A., 2002, In : Journal of Organic Chemistry. 67, 7, p. 1975-1981 6 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Chromium
Ketones
Oxidation
Aldehydes
Substitution reactions

Intensive care nurse consultancy decreases the readmission rate after ICU discharge

Jurrjens, F., Slootweg, J. C., Rommes, J. H. & Spronk, P. E., 2002, In : Intensive Care Medicine. 28, p. S205-S205

Research output: Contribution to JournalArticleAcademicpeer-review

Medium perturbations on the molecular polarizability calculated within a localized dipole interaction model

Jensen, L., Swart, M., van Duijnen, P. T. & Snijders, J. G., 2002, In : Journal of Chemical Physics. 117, 7, p. 3316-3320 4 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Open Access
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dipoles
perturbation
Molecules
Water
solutes

Metal-template-directed synthesis of diphosphorus compounds through intramolecular phosphinidene additions

Vlaar, M. J. M., van Assema, S. G. A., De Kanter, F. J. J., Schakel, M., Spek, A. L., Lutz, M. & Lammertsma, K., 2002, In : Chemistry: A European Journal. 8, p. 58-65 7 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Nucleophilic or electrophilic phosphinidene Complex MLn=PH; what makes the difference ?

Ehlers, A. W., Baerends, E. J. & Lammertsma, K., 2002, In : Journal of the American Chemical Society. 124, p. 2831-2838 7 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Local density approximation
Coordination Complexes
Transition metals

Oligomeric 1,2-dihydro-1-magnesacyclobuta[a]naphthalene

Nijbacker, T., Schreuder Goedheijt, M., De Kanter, F. J. J., Akkerman, O. S. & Bickelhaupt, F., 2002, In : Main Group Metal Chemistry. 25, p. 121-127 6 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Polarizabilities in the condensed phase and the local fields problem: A direct reaction field formulation

van Duijnen, P. T., de Vries, A. H., Swart, M. & Grozema, F. C., 2002, In : Journal of Chemical Physics. 117, 18, p. 8442-8453 11 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Open Access
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Self-propagating reactions for environmental protection: state of the art and future directions

Cao, G. & Orru, R. V. A., 2002, In : Chemical Engineering Journal. 87, 2, p. 239-249

Research output: Contribution to JournalArticleAcademicpeer-review

State-to-state photodissociation of OCS (nu(2)=0,1 vertical bar JlM). I. The angular recoil distribution of CO (X (1)Sigma(+);v=0 vertical bar J)

van den Brom, A. J., Rakitzis, T. P., van Heyst, J., Kitsopoulos, T. N., Jezowski, S. & Janssen, M. H. M., 2002, In : Journal of Chemical Physics. 117, 9, p. 4255-4263

Research output: Contribution to JournalArticleAcademicpeer-review

Open Access
File
Photodissociation
Angular distribution
Carbon Monoxide
photodissociation

State-to-state photodissociation of OCS (v2=0,1�|JIM): 1.The angular recoil distribution of CO (X1S+ ; v=0|J)

van den Brom, A. J., Rakitzis, T. P., van Heyst, J., Kitsopoulos, T. N., Jezowski, S. & Janssen, M. H. M., 2002, In : Journal of Chemical Physics. 117, p. 4255-4263

Research output: Contribution to JournalArticleAcademicpeer-review

Open Access
File
Photodissociation
Angular distribution
Carbon Monoxide
photodissociation

Structural properties of azaphosphirane and its W(CO)5 complex. A density functional study

Goumans, T. P. M., Ehlers, A. W., Vlaar, M. J. M., Strand, S. J. & Lammertsma, K., 2002, In : Journal of Organometallic Chemistry. 643-644, p. 369-375 7 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Carbon Monoxide
Structural properties
rings
Phenyl-P adhesion promoting monomer

Synthesis, Structures and Strain Energies of Dispirophosphiranes. Comparisons with Dispirocyclopropanes

Vlaar, M. J. M., Lor, M. H., Ehlers, A. W., Schakel, M., Lutz, M., Spek, A. L. & Lammertsma, K., 2002, In : Journal of Organic Chemistry. 67, p. 2485-2493 8 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Carbon Monoxide
Strain energy

Synthesis of Novel Terminal Iridium Phosphinidene Complexes

Termaten, A. T., Nijbacker, T., Schakel, M., Lutz, M., Spek, A. L. & Lammertsma, K., 2002, In : Organometallics. 21, p. 3196-3202 6 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Iridium
iridium
Crystalline materials
synthesis

Tetraalkylammonium pentaorganosilicates: the first highly stable silicates with five hydrocarbon ligands

Deerenberg, S., Schakel, M., de Keijzer, A. H. J. F., Kranenburg, M., Lutz, M., Spek, A. L. & Lammertsma, K., 2002, In : Chemical Commununications. p. 348-349 2 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Silicates
Hydrocarbons
Lithium
Melting
Ligands

Theoretical and experimental studies of the opto-electronic properties of positively charged oligo (phenylene vinylene)s: Effects of chain length and alkoxy substitution

Grozema, F. C., Candeias, L. P., Swart, M., van Duijnen, P. T., Wildeman, J., Hadziioanou, G., Siebbeles, L. D. A. & Warman, J. M., 2002, In : Journal of Chemical Physics. 117, p. 11366-11378 12 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Open Access
File
Chain length
Electronic properties
Cations
Substitution reactions
substitutes

The stable silylene Si[((NCH2Bu)-Bu-t)(2)C6H4-1,2]: insertion into Li-C or Li-Si bonds of lithium alkyls LiR or [LiSi(SiMe3)(3)(THF)(3)] [R = Me, Bu-t or CH(SiMe3)(2)]

Cai, X. P., Gehrhus, B., Hitchcock, P. B., Lappert, M. F. & Slootweg, J. C., 2002, In : Journal of Organometallic Chemistry. 643-644, p. 272-277

Research output: Contribution to JournalArticleAcademicpeer-review

The stable silylene Si[((NCH2Bu)-Bu-t)(2)-C6H4-1,2]: insertion into Li-C or Li-Si bonds of lithium alkyls LiR or [LiSi(SiMe3)(3)(THF)(3)] [R = Me, Bu-t or CH(SiMe3)(2)] (vol 643, pg 272, 2002)

Cai, X. P., Gehrhus, B., Hitchcock, P. B., Lappert, M. F. & Slootweg, J. C., 2002, In : Journal of Organometallic Chemistry. 651, 1-2, p. 149-156

Research output: Contribution to JournalArticleAcademicpeer-review

Unusual reactions of halo[5]metacyclophanes

Wijsman, G. W., Boesveld, W. M., Beekman, M. C., Schreuder Goedheijt, M., van Baar, B. L. M., De Kanter, F. J. J., De Wolf, W. H. & Bickelhaupt, F., 2002, In : European Journal of Organic Chemistry. p. 614-629 15 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Vinylphosphirane-phospholene rearrangements: Pericyclic [1,3]-sigmatropic shifts or not ?

Bulo, R. E., Ehlers, A. W., Grimme, W. & Lammertsma, K., 2002, In : Journal of the American Chemical Society. 124, p. 13903-13910 7 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Carbon Monoxide
2003

6-Phenyldibenzo[b,d]phosphine

de Koe, P. & Bickelhaupt, F., 2003, In : Zeitschrift für Naturforschung. Section B: A Journal of Chemical Sciences. 58b, p. 782782-782786 5 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Ab initio study of the thermal isomerization of tricyclo[3.1.0.0(2,6)]hexane to (Z,Z)-1,3-cyclohexadiene through the (E,Z)-1,3-cyclohexadiene intermediate

Davis, S. R., Nguyen, K. A., Lammertsma, K., Mattern, D. L. & Walker, J. P., 2003, In : Journal of Physical Chemistry A. 107, 1, p. 198-203

Research output: Contribution to JournalArticleAcademicpeer-review

Hexanes
Isomerization
isomerization
1,3-cyclohexadiene
Hot Temperature

A biomimetic approach towards the stereoselective synthesis of acetogenins

Orru, R. V. A., de Greef, M., van Heijst, J., Hunting, M., Wessling, C. & Schmitz, R. F., 2003, In : Pure and Applied Chemistry. 75, p. 259

Research output: Contribution to JournalArticleAcademicpeer-review

Accuracy of geometries: Influence of basis set, exchange-correlation potential, inclusion of core electrons, and relativistic corrections

Swart, M. & Snijders, J. G., 2003, In : Theoretical Chemistry Accounts. 110, p. 34-41 7 p.

Research output: Contribution to JournalArticleAcademicpeer-review

inclusions
Geometry
Electrons
geometry
electrons

Add Remove: A new link model for use in QM/MM studies

Swart, M., 2003, In : International Journal of Quantum Chemistry. 91, p. 177-183 6 p.

Research output: Contribution to JournalArticleAcademicpeer-review

A novel four-component reaction for the synthesis of functionalised dihydropyrimidines

Vugts, D. J., Jansen, H., Schmitz, R. F., de Kanter, F. J. J. & Orru, R. V. A., 2003, In : Chemical Commununications. 20, p. 2594-5

Research output: Contribution to JournalArticleAcademicpeer-review

A Novel Four-component Reaction for the Synthesis of Functionalized Dihydropyrimidines

Vugts, D. J., Jansen, H., Schmitz, R. F., De Kanter, F. J. J. & Orru, R. V. A., 2003, In : Organic Letters. p. 2594

Research output: Contribution to JournalArticleAcademicpeer-review

A novel macrokinetic approach for mechanochemical reactions

Delogu, F., Orru, R. V. A. & Cao, G., 2003, In : Chemical Engineering Science. 58, 3-6, p. 815-821

Research output: Contribution to JournalArticleAcademicpeer-review

A review on combustion synthesis of novel materials: recent experimental and modeling results

Cincotti, A., Licheri, R., Locci, A. M., Orru, R. V. A. & Cao, G., 2003, In : Journal of Chemical Technology and Biotechnology. 78, 2-3, p. 122-127

Research output: Contribution to JournalArticleAcademicpeer-review

A Short and Selective Synthetic Route to (S)-Acyloins via Lipase Catalyzed Hydrolysis (+)-Acyloin Acetates

Scheid, G. O., Orru, R. V. A., Kuit, W., Henke, E., Bornscheuer, U. & Wessjohann, L. A., 2003, In : European Journal of Organic Chemistry.

Research output: Contribution to JournalArticleAcademicpeer-review

Copper(I) chloride initiated decomposition of 7-phosphanorbornadiene. Evidence for a solvent-assisted catalytic mechanism

Lammertsma, K., Ehlers, A. W. & McKee, M., 2003, In : Journal of the American Chemical Society. 125, 48, p. 14750-9

Research output: Contribution to JournalArticleAcademicpeer-review

Carbon Monoxide
Density functional theory
Decomposition
cuprous chloride

Development of processes for environmental protection based on self-propagating reactions

Orru, R. V. A., Cincotti, A., Concas, A. & Cao, G., 2003, In : Environmental Science and Pollution Research International. 10, 6, p. 385-9

Research output: Contribution to JournalArticleAcademicpeer-review

Effect of phase transformation during high energy milling on field activated synthesis of dense MoSi2

Sannia, M., Orru, R. V. A., Garay, J. E., Cao, G. & Munir, Z. A., 2003, In : Materials Science and Engineering A. Structural Materials Properties Microstructure and Processing. 345, 1-2, p. 270-277

Research output: Contribution to JournalArticleAcademicpeer-review

Endo/Exo preferences for double bonds in three-membered rings including phosphorus compounds

Goumans, T. P. M., Ehlers, A. W., Lammertsma, K. & Wuerthwein, E-U., 2003, In : European Journal of Organic Chemistry. p. 2941-2946 5 p.

Research output: Contribution to JournalArticleAcademicpeer-review

endolexo preferences for double bonds in three-membered rings including phosphorus compounds

Goumans, T. P. M., Ehlers, A. W., Lammertsma, K. & Wurthwein, E. U., 2003, In : European Journal of Organic Chemistry. 15, p. 2941-2946

Research output: Contribution to JournalArticleAcademicpeer-review

Field-activated pressure-assisted synthesis of NiTi

Locci, A. M., Orru, R. V. A., Cao, G. & Munir, Z. A., 2003, In : Intermetallics. 11, 6, p. 555-571

Research output: Contribution to JournalArticleAcademicpeer-review

Investigations on 1-Metallaindanes

Schreuder Goedheijt, M., Nijbacker, T., Horton, A. D., De Kanter, F. J. J., Akkerman, O. S. & Bickelhaupt, F., 2003, In : European Journal of Inorganic Chemistry. p. 638-643 5 p.

Research output: Contribution to JournalArticleAcademicpeer-review

N-Heterocyclic Carbene Functionalized Iridium Phsophinidene Complex Cp*(NHC)Ir=PMes*. Comparison of Phosphinidene, Imido, and Carbene Complexes

Termaten, A. T., Schakel, M., Ehlers, A. W., Lutz, M., Spek, A. L. & Lammertsma, K., 2003, In : Chemistry: A European Journal. 9, p. 3577-3582 5 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Iridium
carbene

Non-planarity at tri-coordinated aluminum and gallium ! Novel structures for X3Hnm (X=B, Al, Ga; n = 3, m =-2; n = 4, m = -1; n = 5, m = 0; n = 6, m = +1)

Srinivas, G. N., Anoop, A., Jemmis, E. D., Hamilton, T. P., Lammertsma, K., Leszczynski, J. & Schaefer, H. F., 2003, In : Journal of the American Chemical Society. 125, p. 16397-16407 10 p.

Research output: Contribution to JournalArticleAcademicpeer-review

gallium
aluminum
energy

Novel Multicomponent Reaction for the Combinatorial Synthesis 0f 2-Imidazolines

Bon, R. S., Hong, C., Bouma, M. J., Schmitz, R. F., De Kanter, F. J. J., Lutz, M., Spek, A. L. & Orru, R. V. A., 2003, In : Organic Letters. 5, 20, p. 3759-3762 4 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Cyanides
aldehydes
Aldehydes
Amines
Condensation

OM/MM study of cytochrome P450: The influence of the enzyme environment on specific steps in the catalytic cycle

Swart, M., Groenhof, A. R., Ehlers, A. W. & Lammertsma, K., 2003, In : Abstracts of Papers - American Chemical Society. 225, p. U9-U9

Research output: Contribution to JournalArticleAcademicpeer-review

Photodissociation of phosphine substituted transition metal carbonyls. A theoretical study.

Goumans, T. P. M., Ehlers, A. W., van Hemert, M. C., Rosa, A., Baerends, E. J. & Lammertsma, K., 2003, In : Journal of the American Chemical Society. 125, p. 3558-3567 9 p.

Research output: Contribution to JournalArticleAcademicpeer-review

phosphine
Photodissociation
Photochemical reactions
Carbon Monoxide
Transition metals

Photoexcitation energy loss in molecular semiconductors

Bongiovanni, G., Cordella, F., Orru, R. V. A. & Mura, A., 2003, In : Synthetic Metals. 139, 3, p. 723-726

Research output: Contribution to JournalArticleAcademicpeer-review

Rapid Combinatorial Access to Macrocyclic Ansa-Peptoids with a Natural Product Like Core Structure

de Greef, M., De Kanter, F. J. J., Doemling, A., Orru, R. V. A. & Wessjohann, L. A., 2003, In : Organic Letters.

Research output: Contribution to JournalArticleAcademicpeer-review

Recent advances in solution-phase multicomponent methodology for the synthesis of heterocyclic compounds

Orru, R. V. A. & de Greef, M., 2003, In : Synthesis. p. 1471

Research output: Contribution to JournalArticleAcademicpeer-review

Recent advances in the chemistry of a stable silylene.

Gehrhus, B., Pongtavornpinyo, R., Slootweg, J. C. & Zhang, L. L., 2003, In : Abstracts of Papers - American Chemical Society. 226, p. U722-U722

Research output: Contribution to JournalArticleAcademicpeer-review

Self-propagating combustion synthesis and plasma spraying deposition of TiC-Fe powders

Licheri, R., Orru, R. V. A., Cao, G., Crippa, A. & Scholz, R., 2003, In : Ceramics International. 29, 5, p. 519-526

Research output: Contribution to JournalArticleAcademicpeer-review

Syntheses and reactions of terminal Osmium and Ruthenium complexed phosphinidenes n6-Ar(L)M=PMes*

Termaten, A. T., Nijbacker, T., Schakel, M., Lutz, M., Spek, A. L. & Lammertsma, K., 2003, In : Chemistry: A European Journal. 9, p. 2200-2208 8 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Osmium
Ruthenium

Terminal phosphinidene complexes Cp-R(L)M=PAr of the group 9 transition metals cobalt, rhodium, and iridium. Synthesis, structures, and properties

Termaten, A. T., Aktas, H., Schakel, M., Ehlers, A. W., Lutz, M., Spek, A. L. & Lammertsma, K., 2003, In : Organometallics. 22, 9, p. 1827-1834

Research output: Contribution to JournalArticleAcademicpeer-review

Iridium
Rhodium
Cobalt
iridium
rhodium

The facile synthesis of chiral oxazoline catalysts for the diethylzinc addition to aldehydes

Braga, A. L., Rubim, R. M., Schrekker, H. S., Wessjohann, L. A., de Bolster, M. W. G., Zeni, G. & Sehnem, J. A., 2003, In : Tetrahedron: Asymmetry. 14, p. 3291-3295 4 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Aldehydes
aldehydes
catalysts
Catalysts
synthesis

Theoretical study of molecular structure, tautomerism, and geometrical isomerism of N-methyl and N-phenyl substituted cyclic imidazolines, oxalines and thiazolines

Dr. Remko, M., van Duijnen, P. T. & Swart, M., 2003, In : Structural Chemistry. 14, p. 271-278 7 p.

Research output: Contribution to JournalArticleAcademicpeer-review

Imidazolines
tautomers
Isomers
Molecular structure
molecular structure