Browsing by Author Tsipis, A. C.

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TitleAuthor(s)Issue date???itemlist.???
Ab initio and Density Functional Electronic Structure Study of Molybdenum Oxide ClustersTsipis, A. C.24-Nov-2015-
Ab initio Quantum Chemical Study of the Coordination Preferences and Catalytic Role of Cu+ Ions in the Dehydration Reactions of Hydroxyformaldoxime Conformers and the oxidation of HCN to Hydroxyformaldoxime by Hydrogen PeroxidePantazis, D. A.; Tsipis, A. C.; Tsipis, C. A.24-Nov-2015-
All-Organometallic Analogues of Zeise's Salt for the Three Group 10 MetalsForniΓ©s, J.; Martin, A.; Martin, L. F.; MenjΓ³n, B.; Tsipis, A. C.24-Nov-2015-
Aromatic gold and silver 'rings': Hydrosilver(I) and hydrogold(I) analogues of aromatic hydrocarbonsTsipis, C. A.; Karagiannis, E. E.; Kladou, P. F.; Tsipis, A. C.24-Nov-2015-
Benzoquinolateplatinum(II) complexes as building blocks in the synthesis of Pt-Ag extended structuresFornies, J.; Ibáñez, S.; Lalinde, E.; Martin, A.; Moreno, M. T.; Tsipis, A. C.24-Nov-2015-
Conformational preferences, rotational barriers and energetics of purine nucleobase rotation and dissociation in square planar platinum(II) antitumour complexes: Structure-activity correlationTsipis, A. C.; Katsoulos, G. A.24-Nov-2015-
Copper(I) Halide Complexes with 1,3-bis(diphenylphosphino)propane and Heterocyclic Thione Ligands: Crystal and Electronic Structures (DFT) of [CuCl(pymtH)(dppp)], [CuBr(pymtH)(dppp)] and [CuI(dppp)]2Aslanidis, P.; Cox, P. J.; Divanides, S.; Tsipis, A. C.24-Nov-2015-
Deciphering the bonding mode of the trihalide ligands in a series of halogen carrier homo- and hetero-trihalide Cu(II) Schiff base complexesTsipis, A. C.; Karipidis, P. A.24-Nov-2015-
Density functional study of configurational, conformational, energetic, electronic and spectroscopic properties of fluorohydroxyformaldoxime and its dehydration productsTsipis, A. C.; Tsipis, C. A.24-Nov-2015-
Density Functional Study of the Electronic Structure and Related Properties of Pt(NO)/Pt(NO2) Redox CoupleKaripidis, P.; Tsipis, A. C.; Tsipis, C. A.24-Nov-2015-
Development of a Ligand Knowledge Base, Part 1: Computational Descriptors for Phosphorus Donor LigandsFey, N.; Tsipis, A. C.; Harris, S. E.; Harvey, J. N.; Orpen, A. G.; Mansson, R. A.24-Nov-2015-
Diagnosis of Magnetoresponsive Aromatic and Antiaromatic Zones in Three-Membered Rings of d- and f-Block ElementsTsipis, A. C.; Depastas, I. G.; Karagiannis, E. E.; Tsipis, C. A.24-Nov-2015-
Diagnosis of the Οƒ-, Ο€- and (Οƒ+Ο€)-Aromaticity by the Shape of the NICSzz-Scan Curves and Symmetry-Based Selection RulesTsipis, A. C.; Depastas, I. G.; Tsipis, C. A.24-Nov-2015-
DNA interaction studies and evaluation of biological activity of homo- and hetero-trihalide mononuclear Cu(II) Schiff base complexes. Quantitative structure-activity relationshipsChaviara, A. T.; Kioseoglou, E. E.; Pantazaki, A. A.; Tsipis, A. C.; Karipidis, P. A.; Kyriakidis, D. A.; Bolos, C. A.24-Nov-2015-
Efficiency of the NICS(zz)-scan curves to probe the antiaromaticity of organic and inorganic rings/cagesTsipis, A. C.24-Nov-2015-
Electronic Structure and Optical Properties of Mixed Phenylene Vinylene/Phenylene Ethynylene Conjugated OligomersSchening, A. P. H. J.; Tsipis, A. C.; Meskers, S. C. J.; Beljonne, D.; Meijer, E. W.24-Nov-2015-
Electronic structure calculations on multiply charged anions containing M-S bonds (M = Cr, Mo, W) and their heterobimetallic cluster complexesGili, P.; Tsipis, A. C.24-Nov-2015-
An experimental and density functional study of the interaction of Cu-II complexes of diethylenetriamine (dien) with pyridine, nicotinic acid, and nicotinamide: The crystal structure of [Cu(dien)(nicotinamide)(NO3)(2)]Papanikolaou, P. A.; Christidis, P. C.; Chaviara, A. T.; Bolos, C. A.; Tsipis, A. C.24-Nov-2015-
Experimental and quantum chemical study of the mechanism of an unexpected intramolecular reductive coupling of a bridging phosphido ligand and a C6F5 group and the reversible oxidative addition of PPh2C6F5Chaouche, N.; Fornies, J.; Fortuno, C.; Kribii, A.; Martin, A.; Karipidis, P.; Tsipis, A. C.; Tsipis, C. A.24-Nov-2015-
An experimental and theoretical (DFT) investigation of the coordination mode of 2,4-dithiouracil (2,4-dtucH(2)) in copper(I) complexes with 1,2-bis(diphenylphosphanyl)benzene (dppbz): The crystal structures of [Cu(mu-Br)(dppbz)](2) and [CuBr(dppbz)(2,4-dtucH(2))]Aslanidis, P.; Cox, P. J.; Kaltzoglou, A.; Tsipis, A. C.24-Nov-2015-