☰

Damian Moran - Publications

Affiliations: 
Chemistry Macquarie University, Macquarie Park, New South Wales, Australia 
Tree Info Similar researchers PubMed Report error

25 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2008 Menon AS, Wood GPF, Moran D, Radom L. Bond dissociation energies and radical stabilization energies: An assessment of contemporary theoretical procedures (Journal of Physical Chemistry A (2007) 111A) Journal of Physical Chemistry A. 112: 5554. DOI: 10.1021/Jp803933D  0.306
2007 Menon AS, Wood GP, Moran D, Radom L. Bond dissociation energies and radical stabilization energies: an assessment of contemporary theoretical procedures. The Journal of Physical Chemistry. A. 111: 13638-44. PMID 18047305 DOI: 10.1021/Jp076521R  0.334
2007 Merrick JP, Moran D, Radom L. An evaluation of harmonic vibrational frequency scale factors. The Journal of Physical Chemistry. A. 111: 11683-700. PMID 17948971 DOI: 10.1021/Jp073974N  0.301
2007 Woodcock HL, Moran D, Pastor RW, MacKerell AD, Brooks BR. Ab initio modeling of glycosyl torsions and anomeric effects in a model carbohydrate: 2-ethoxy tetrahydropyran. Biophysical Journal. 93: 1-10. PMID 17554075 DOI: 10.1529/Biophysj.106.099986  0.32
2007 Woodcock HL, Moran D, Brooks BR, Schleyer PVR, Schaefer HF. Carbene stabilization by aryl substituents. Is bigger better? Journal of the American Chemical Society. 129: 3763-3770. PMID 17326641 DOI: 10.1021/Ja068899T  0.408
2006 Hemelsoet K, Van Speybroeck V, Moran D, Marin GB, Radom L, Waroquier M. Thermochemistry and kinetics of hydrogen abstraction by methyl radical from polycyclic aromatic hydrocarbons. The Journal of Physical Chemistry. A. 110: 13624-31. PMID 17165891 DOI: 10.1021/Jp065141N  0.366
2006 Moran D, Simmonett AC, Leach FE, Allen WD, Schleyer PV, Schaefer HF. Popular theoretical methods predict benzene and arenes to be nonplanar. Journal of the American Chemical Society. 128: 9342-3. PMID 16848464 DOI: 10.1021/Ja0630285  0.334
2006 Hemelsoet K, Moran D, Van Speybroeck V, Waroquier M, Radom L. An assessment of theoretical procedures for predicting the thermochemistry and kinetics of hydrogen abstraction by methyl radical from benzene. The Journal of Physical Chemistry. A. 110: 8942-51. PMID 16836458 DOI: 10.1021/Jp061823Z  0.366
2006 Moran D, Jacob R, Wood GPF, Coote ML, Davies MJ, O'Hair RAJ, Easton CJ, Radom L. Rearrangements in model peptide-type radicals via intramolecular hydrogen-atom transfer Helvetica Chimica Acta. 89: 2254-2272. DOI: 10.1002/Hlca.200690210  0.382
2005 Wood GP, Moran D, Jacob R, Radom L. Bond dissociation energies and radical stabilization energies associated with model peptide-backbone radicals. The Journal of Physical Chemistry. A. 109: 6318-25. PMID 16833974 DOI: 10.1021/Jp051860A  0.36
2005 Paddon-Row MN, Moran D, Jones GA, Sherburn MS. On the origin of cis/trans stereoselectivity in intramolecular Diels-Alder reactions of substituted pentadienyl acrylates: a comprehensive density functional study. The Journal of Organic Chemistry. 70: 10841-53. PMID 16356007 DOI: 10.1021/Jo051973Q  0.329
2005 Cayzer TN, Paddon-Row MN, Moran D, Payne AD, Sherburn MS, Turner P. Intramolecular Diels-Alder reactions of ester-linked 1,3,8-nonatrienes. The Journal of Organic Chemistry. 70: 5561-70. PMID 15989338 DOI: 10.1021/Jo0505829  0.354
2003 Moran D, Woodcock HL, Chen Z, Schaefer HF, Schleyer PV. On the viability of small endohedral hydrocarbon cage complexes: X@C4H4, X@C8H8, X@C8H14, X@C10H16, X@C12H12, AND X@C16H16. Journal of the American Chemical Society. 125: 11442-51. PMID 16220967 DOI: 10.1021/Ja0345470  0.346
2003 Sukcharoenphon K, Moran D, Schleyer Pv, McDonough JE, Abboud KA, Hoff CD. Increased reactivity of the *Cr(CO)3(C5Me5) radical with thiones versus thiols: a theoretical and experimental investigation. Inorganic Chemistry. 42: 8494-503. PMID 14658905 DOI: 10.1021/Ic034791S  0.346
2003 Chen Z, Sutton LR, Moran D, Hirsch A, Thiel W, Schleyer Pv. A theoretical and structural investigation of thiocarbon anions. The Journal of Organic Chemistry. 68: 8808-14. PMID 14604348 DOI: 10.1021/Jo035144L  0.37
2003 Wannere CS, Moran D, Allinger NL, Hess BA, Schaad LJ, Schleyer Pv. On the stability of large [4n]annulenes. Organic Letters. 5: 2983-6. PMID 12916961 DOI: 10.1021/Ol034979F  0.329
2003 Moran D, Stahl F, Bettinger HF, Schaefer HF, Schleyer P. Towards graphite: magnetic properties of large polybenzenoid hydrocarbons. Journal of the American Chemical Society. 125: 6746-52. PMID 12769585 DOI: 10.1021/Ja034497Z  0.337
2003 Moran D, Manoharan M, Heine T, Schleyer Pv. Sigma-antiaromaticity in cyclobutane, cubane, and other molecules with saturated four-membered rings. Organic Letters. 5: 23-6. PMID 12509881 DOI: 10.1021/Ol027159W  0.317
2003 Chen Z, Jiao H, Moran D, Hirsch A, Thiel W, Schleyer PvR. Structures and Stabilities of Endo- and Exohedral Dodecahedrane Complexes (X@C20H20and XC20H20, X = H+, H, N, P, C-, Si-, O+, S+) The Journal of Physical Chemistry A. 107: 2075-2079. DOI: 10.1021/Jp0273631  0.324
2003 Larkin JD, Moran D, Schaefer HF. Molecular structures and energetics of the neutral aluminum-trimethylaluminum complex: An Al-Al bonded global minimum? Chemical Physics Letters. 378: 65-70. DOI: 10.1016/S0009-2614(03)01185-0  0.305
2003 Chen Z, Jiao H, Moran D, Hirsch A, Thiel W, Ragué Schleyer Pv. Aromatic stabilization in heterofullerenes C48X12(X = N, P, B, Si) Journal of Physical Organic Chemistry. 16: 726-730. DOI: 10.1002/Poc.631  0.311
2002 Moran D, Sukcharoenphon K, Puchta R, Schaefer HF, Schleyer PV, Hoff CD. 2-Pyridinethiol/2-pyridinethione tautomeric equilibrium. A comparative experimental and computational study. The Journal of Organic Chemistry. 67: 9061-9. PMID 12467429 DOI: 10.1021/Jo0263768  0.391
2002 Stahl F, Moran D, von Ragué Schleyer P, Prall M, Schreiner PR. Aromaticity of the Bergman, Myers-Saito, Schmittel, and directly related cyclizations of enediynes. The Journal of Organic Chemistry. 67: 1453-61. PMID 11871873 DOI: 10.1021/Jo015728S  0.329
2002 Moran D, Stahl F, Jemmis ED, Schaefer HF, Schleyer PvR. Structures, Stabilities, and Ionization Potentials of Dodecahedrane Endohedral Complexes The Journal of Physical Chemistry A. 106: 5144-5154. DOI: 10.1021/Jp014471Z  0.311
2001 Woodcock HL, Moran D, von Ragué Schleyer P, Schaefer HF. The almost bottleable triplet carbene: 2,6-dibromo-4-tert-butyl-2',6'-bis(trifluoromethyl)-4'-isopropyldiphenylcarbene. Journal of the American Chemical Society. 123: 4331-5. PMID 11457200 DOI: 10.1021/Ja003552Q  0.382
Show low-probability matches.