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Results: 1-14 |
Results: 14
Mapping the modification of ring currents induced by cyclopenta-fusion on a naphthalene core
Authors: Fowler, PW Steiner, E Acocella, A Jenneskens, LW Havenith, RWA
Citation: Pw. Fowler et al., Mapping the modification of ring currents induced by cyclopenta-fusion on a naphthalene core, J CHEM S P2, (7), 2001, pp. 1058-1065
The occurrence of through-bond orbital interactions in an alpha,omega donor-acceptor substituted bi(cyclohexylidene) and bi(cyclohexyl). X-Ray diffraction, UV-Vis absorption and photoelectron spectroscopy, ab initio SCF-MO and natural bond orbital analyses
Authors: Oosterbaan, WD Havenith, RWA van Walree, CA Jenneskens, LW Gleiter, R Kooijman, H Spek, AL
Citation: Wd. Oosterbaan et al., The occurrence of through-bond orbital interactions in an alpha,omega donor-acceptor substituted bi(cyclohexylidene) and bi(cyclohexyl). X-Ray diffraction, UV-Vis absorption and photoelectron spectroscopy, ab initio SCF-MO and natural bond orbital analyses, J CHEM S P2, (7), 2001, pp. 1066-1074
Survival and extinction of delocalised ring currents in clamped benzenes
Authors: Fowler, PW Havenith, RWA Jenneskens, LW Soncini, A Steiner, E
Citation: Pw. Fowler et al., Survival and extinction of delocalised ring currents in clamped benzenes, CHEM COMMUN, (22), 2001, pp. 2386-2387
N,N-dialkylanilines: The S-1 state absorption spectrum and efficient intramolecular triplet-triplet energy transfer to an olefinic bond
Authors: Oosterbaan, WD Koeberg, M Piris, J Havenith, RWA van Walree, CA Wegewijs, BR Jenneskens, LW Verhoeven, JW
Citation: Wd. Oosterbaan et al., N,N-dialkylanilines: The S-1 state absorption spectrum and efficient intramolecular triplet-triplet energy transfer to an olefinic bond, J PHYS CH A, 105(25), 2001, pp. 5984-5989
Aromaticity of pyrene and its cyclopentafused congeners - Resonance and NICS criteria. An ab initio valence bond analysis in terms of Kekule resonance structures
Authors: Havenith, RWA van Lenthe, JH Dijkstra, F Jenneskens, LW
Citation: Rwa. Havenith et al., Aromaticity of pyrene and its cyclopentafused congeners - Resonance and NICS criteria. An ab initio valence bond analysis in terms of Kekule resonance structures, J PHYS CH A, 105(15), 2001, pp. 3838-3845
Mobius aromaticity in small [n] trans-annulenes?
Authors: Havenith, RWA Van Lenthe, JH Jenneskens, LW
Citation: Rwa. Havenith et al., Mobius aromaticity in small [n] trans-annulenes?, INT J QUANT, 85(1), 2001, pp. 52-60
Unconventional ring currents in an 'all-metal aromatic', Al-4(2-)
Authors: Fowler, PW Havenith, RWA Steiner, E
Citation: Pw. Fowler et al., Unconventional ring currents in an 'all-metal aromatic', Al-4(2-), CHEM P LETT, 342(1-2), 2001, pp. 85-90
Through-bond orbital coupling in end-functionalized bicyclohexylidenes - Photoelectron spectroscopy and ab initio SCF-MO calculations
Authors: Marsman, AW Havenith, RWA Bethke, S Jenneskens, LW Gleiter, R van Lenthe, JH
Citation: Aw. Marsman et al., Through-bond orbital coupling in end-functionalized bicyclohexylidenes - Photoelectron spectroscopy and ab initio SCF-MO calculations, EUR J ORG C, (14), 2000, pp. 2629-2641
Infinite, undulating chains of intermolecularly hydrogen bonded (E,E)-2,2-dimethylcyclohexane-1,3-dione dioximes in the solid state. A single crystalX-ray, charge density distribution and spectroscopic study
Authors: Marsman, AW van Walree, CA Havenith, RWA Jenneskens, LW Lutz, M Spek, AL Lutz, ETG van der Maas, JH
Citation: Aw. Marsman et al., Infinite, undulating chains of intermolecularly hydrogen bonded (E,E)-2,2-dimethylcyclohexane-1,3-dione dioximes in the solid state. A single crystalX-ray, charge density distribution and spectroscopic study, J CHEM S P2, (3), 2000, pp. 501-510
Long-range sigma-pi interactions in Tetrahydro-4H-thiopyran end-capped oligo(cyclohexylidenes). Photo-electron spectroscopy, ab initio SCF MO calculations, and natural bond orbital analyses
Authors: Marsman, AW Havenith, RWA Bethke, S Jenneskens, LW Gleiter, R van Lenthe, JH Lutz, M Spek, AL
Citation: Aw. Marsman et al., Long-range sigma-pi interactions in Tetrahydro-4H-thiopyran end-capped oligo(cyclohexylidenes). Photo-electron spectroscopy, ab initio SCF MO calculations, and natural bond orbital analyses, J ORG CHEM, 65(15), 2000, pp. 4584-4592
Flash vacuum thermolysis of acenaphtho[1,2-a]acenaphthylene, fluoranthene,benzo[k]- and benzo[j]fluoranthene - Homolytic scission of carbon-carbon single bonds of internally fused cyclopenta moieties at T >= 1100 degrees C
Authors: Sarobe, M Kwint, HC Fleer, T Havenith, RWA Jenneskens, LW Vlietstra, EJ van Lenthe, JH Wesseling, J
Citation: M. Sarobe et al., Flash vacuum thermolysis of acenaphtho[1,2-a]acenaphthylene, fluoranthene,benzo[k]- and benzo[j]fluoranthene - Homolytic scission of carbon-carbon single bonds of internally fused cyclopenta moieties at T >= 1100 degrees C, EUR J ORG C, (5), 1999, pp. 1191-1200
Triscyclopenta[cd,fg,jk]pyrene: another congener of the externally cyclopenta-fused pyrene series
Authors: Sarobe, M Havenith, RWA Jenneskens, LW
Citation: M. Sarobe et al., Triscyclopenta[cd,fg,jk]pyrene: another congener of the externally cyclopenta-fused pyrene series, CHEM COMMUN, (11), 1999, pp. 1021-1022
The excitation energies of 1,1 '-bicyclohexylidene and 1,1 ': 4 ', 1 ''-tercyclohexylidene. A comparison of multi-reference configuration interactionand perturbation theory approaches
Authors: Havenith, RWA van Dam, HJJ van Lenthe, JH Jenneskens, LW
Citation: Rwa. Havenith et al., The excitation energies of 1,1 '-bicyclohexylidene and 1,1 ': 4 ', 1 ''-tercyclohexylidene. A comparison of multi-reference configuration interactionand perturbation theory approaches, CHEM PHYS, 246(1-3), 1999, pp. 49-56
Disrotatory versus conrotatory electrocyclic ring opening of Dewar benzene: the conrotatory pathway is preferred and does not involve trans-benzene
Authors: Havenith, RWA Jenneskens, LW van Lenthe, JH
Citation: Rwa. Havenith et al., Disrotatory versus conrotatory electrocyclic ring opening of Dewar benzene: the conrotatory pathway is preferred and does not involve trans-benzene, J MOL ST-TH, 492, 1999, pp. 217-224
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