Search - Université Toulouse III

hal-01381837v1 Journal articles
Corentin Poidevin, Christine Lepetit, Nadia Ben Amor, Remi Chauvin. Truncated Transition Densities for Analysis of (Nonlinear) Optical Properties of carbo-Chromophores
Journal of Chemical Theory and Computation, American Chemical Society, 2016, 12 (8), pp.3727-3740. ⟨10.1021/acs.jctc.6b00484⟩

hal-00866164v1 Journal articles
Remi Chauvin, Christine Lepetit, Paul Fowler, Jean-Paul Malrieu. The chemical roots of the matching polynomial
Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2010, 12 (20), pp.5295-5306. ⟨10.1039/b923893j⟩

hal-00952085v1 Journal articles
Mickaël Gicquel, Jean-Louis Heully, Christine Lepetit, Remi Chauvin. Carbo-[3]oxocarbon and its isomers: evaluation of the stability and of the electron delocalization
Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2008, 10, pp.3578-3589. ⟨10.1039/B718817J⟩

hal-02947701v1 Journal articles
Hala Assi, Kévin Cocq, Jérémy Cure, Gérald Casterou, Kévin Castello Lux et al. Reorganization of a photosensitive carbo-benzene layer in a triptych nanocatalyst with enhancement of the photocatalytic hydrogen production from water
International Journal of Hydrogen Energy, Elsevier, 2020, 45 (46), pp.24765-24778. ⟨10.1016/j.ijhydene.2020.06.255⟩

hal-02335107v1 Journal articles
Pauline Rullière, François Lizeaux, Etienne Joly, Stéphanie Ballereau, Hafida Gaspard et al. Fluorinated analogues of lipidic dialkynylcarbinol pharmacophores: synthesis and cytotoxicity in HCT116 cancer cells
French-Ukrainian Journal of Chemistry, 2019, 7 (1), pp.1-9. ⟨10.17721/fujcV7I1P1-9⟩

hal-02613316v1 Journal articles
Zhenyu Yao, Xing Lin, Remi Chauvin, Lianhui Wang, Emmanuel Gras et al. Phosphine-phosphonium ylides as ligands in palladium-catalysed C2-H arylation of benzoxazoles
Chinese Chemical Letters, Elsevier, 2020, 31 (12), pp.3250-3254. ⟨10.1016/j.cclet.2020.04.008⟩

hal-02613327v1 Journal articles
Tingfang Li, Zi Yang, Zhenyu Song, Remi Chauvin, Xiuling Cui. Rhodium(III)-Catalyzed [4+3] Annulation of N -Aryl-pyrazolidinones and Propargylic Acetates: Access to Benzo[ c ][1,2]diazepines
Organic Letters, American Chemical Society, 2020, 22 (11), pp.4078-4082. ⟨10.1021/acs.orglett.0c01139⟩

hal-00990818v1 Journal articles
Iaroslav Baglai, Valérie Maraval, Zoia Vsevolodivna Voitenko, Carine Duhayon, Yulian Mikhailovich Volovenko et al. On the peculiar reactivity of a C,N-annelated isoindole core
Turkish Journal of Chemistry, Scientific and Technical Research Council of Turkey, 2014, 38, pp.121-126. ⟨10.3906/kim-1306-58⟩

hal-02612895v1 Journal articles
Cleve Dionel Mboyi, Albert Poater, Jordi Poater, Carine Duhayon, Remi Chauvin. Cyclopropenylidenephosphoranes: Rearrangement to Azetidinylidene-Methylphosphoniums
Journal of Organic Chemistry, American Chemical Society, 2020, 85 (11), pp.7452-7458. ⟨10.1021/acs.joc.0c00847⟩

hal-02947811v1 Journal articles
Edinilton Muniz Carvalho, Lionel Rechignat, Eduardo Henrique Silva De Sousa, Luiz Gonzaga de França Lopes, Remi Chauvin et al. Mechanistic insights into the in vitro metal-promoted oxidation of (di)azine hydroxamic acids: evidence of HNO release and N , O -di(di)azinoyl hydroxylamine intermediate
New Journal of Chemistry, Royal Society of Chemistry, 2020, 44 (28), pp.11965-11973. ⟨10.1039/D0NJ00753F⟩

hal-02612842v1 Journal articles
Dymytrii Listunov, Ole Hammerich, Irving Caballero-Quintana, Albert Poater, Cécile Barthes et al. Core carbo-mer of an extended tetrathiafulvalene: redox-controlled reversible conversion to a carbo-benzenic dication
Chemistry - A European Journal, Wiley-VCH Verlag, 2020, 26 (47), pp.10707-10711. ⟨10.1002/chem.202001700⟩

hal-02613333v1 Journal articles
Mustapha Ait El Had, Abdelouahd Oukhrib, Mohamed Zaki, Martine Urrutigoity, Ahmed Benharref et al. Versatile synthesis of cadalene and iso-cadalene from himachalene mixtures: Evidence and application of unprecedented rearrangements
Chinese Chemical Letters, Elsevier, 2020, 31 (7), pp.1851-1854. ⟨10.1016/j.cclet.2020.03.008⟩

hal-02612477v1 Journal articles
Diana Kelly Castro de Almeida, Marcos Reinaldo da Silva, Marcos Carlos de Mattos, Fátima Miranda Nunes, Stéphanie Ballereau et al. Lipase-catalysed enantioselective kinetic resolution of rac-lipidic alkynylcarbinols and a C5 synthon thereof via a hydrolysis approach
Molecular Catalysis, Elsevier, 2020, 488, pp.110926. ⟨10.1016/j.mcat.2020.110926⟩

hal-02273707v1 Journal articles
Iaroslav Baglai, Gabriel Ramos-Ortiz, José-Luis Maldonado, Zoia Voitenko, Valérie Maraval et al. A difluorenyl-carbo-cyclohexadiene: prospective chromophore for two-photon absorption
French-Ukrainian Journal of Chemistry, 2018, 6 (2), pp.9-17. ⟨10.17721/fujcV6I2P9-17⟩

hal-00993872v1 Journal articles
C. Barthes, Christine Lepetit, Yves Canac, Carine Duhayon, Davit Zargarian et al. P(CH)P pincer rhodium(I) complexes: the key role of electron-poor imidazoliophosphine extremities
Inorganic Chemistry, American Chemical Society, 2013, 52 (1), pp.48-58. ⟨10.1021/ic3006508⟩

hal-02948991v1 Journal articles
Edinilton Muniz Carvalho, Tercio de Freitas Paulo, Alix Sournia Saquet, Bruno Lopes Abbadi, Fernanda Souza Macchi et al. Pentacyanoferrate(II) complex of pyridine-4- and pyrazine-2-hydroxamic acid as source of HNO: investigation of anti-tubercular and vasodilation activities
Journal of Biological Inorganic Chemistry, Springer Verlag, 2020, 25 (6), pp.887-901. ⟨10.1007/s00775-020-01805-z⟩

hal-02948320v1 Journal articles
Albert Poater, Massimo Christian d'Alterio, Giovanni Talarico, Remi Chauvin. Arene vs. Alkene Substrates in Ru-Catalyzed Olefin Metathesis: a DFT Investigation
European Journal of Organic Chemistry, Wiley-VCH Verlag, 2020, 2020 (30), pp.4743-4749. ⟨10.1002/ejoc.202000725⟩

hal-02947857v1 Journal articles
Edinilton Muniz Carvalho, Lisa Ridnour, Florêncio Sousa Gouveia Júnior, Pedro Henrique Bezerra Cabral, Nilberto Robson Falcão Do Nascimento et al. A divergent mode of activation of a nitrosyl iron complex with unusual antiangiogenic activity
Journal of Inorganic Biochemistry, Elsevier, 2020, 210, pp.111133. ⟨10.1016/j.jinorgbio.2020.111133⟩

hal-02948286v1 Journal articles
Yihao Liu, Zi Yang, Remi Chauvin, Wei Fu, Zhenyu Yao et al. One-Pot Synthesis of Furo[3,4- c ]indolo[2,1- a ]isoquinolines through Rh(III)-Catalyzed Cascade Reactions of 2-Phenylindoles with 4-Hydroxy-2-alkynoates
Organic Letters, American Chemical Society, 2020, 22 (13), pp.5140-5144. ⟨10.1021/acs.orglett.0c01744⟩

hal-00994395v1 Journal articles
Iaroslav Baglai, Valérie Maraval, Christian Bijani, N. Saffon-Merceron, Zoia Vsevolodivna Voitenko et al. Enhanced π-frustration in carbo-benzenic chromophores
Chemical Communications, Royal Society of Chemistry, 2013, 49 (75), pp.8374-8376. ⟨10.1039/C3CC43204A⟩

hal-00952074v1 Journal articles
Jean-Paul Malrieu, Mickaël Gicquel, Paul Fowler, Christine Lepetit, Jean-Louis Heully et al. Direct Evaluation of Cyclic Contributions to the pi Energy of Conjugated Hydrocarbons from Strongly Localized Zero-Order Pictures
Journal of Physical Chemistry A, American Chemical Society, 2008, 112 (50), pp.13203-13214. ⟨10.1021/jp802839n⟩

hal-00975819v1 Journal articles
Christine Lepetit, Henry Chermette, Mickaël Gicquel, Jean-Louis Heully, Remi Chauvin. Description of Carbo-oxocarbons and Assessment of Exchange-Correlation Functionals for the DFT Description of Carbo-mers
Journal of Physical Chemistry A, American Chemical Society, 2007, 111 (11), pp.136-149. ⟨10.1021/jp064066d⟩

hal-01965636v1 Journal articles
Arnaud Rives, Iaroslav Baglai, Volodymyr Malytskyi, Valérie Maraval, Nathalie Saffon et al. Highly π electron-rich macro-aromatics: bis(p-aminophenyl)-carbo-benzenes and their DBA acyclic references
Chemical Communications, Royal Society of Chemistry, 2012, 48 (70), pp.8763. ⟨10.1039/C2CC34176J⟩

hal-00975767v1 Journal articles
Jean-Paul Malrieu, Christine Lepetit, Mickaël Gicquel, Jean-Louis Heully, Patrick Fowler et al. Evaluating the cyclic π-electron delocalization energy through a double cut of conjugated rings
New Journal of Chemistry, Royal Society of Chemistry, 2007, 31, pp.1918-1927. ⟨10.1039/B710550A⟩

hal-00982033v1 Journal articles
Juan Sanz Garcia, Christine Lepetit, Yves Canac, Remi Chauvin, Martial Boggio-Pasqua. Enantiomerization Pathway and Atropochiral Stability of the BINAP Ligand: A Density Functional Theory Study
Chemistry - An Asian Journal, Wiley-VCH Verlag, 2014, 9 (2), pp.462-465. ⟨10.1002/asia.201301265⟩

hal-00837998v1 Journal articles
Ibrahim Abdellah, Martial Boggio-Pasqua, Yves Canac, Christine Lepetit, Carine Duhayon et al. Towards the limit of atropochiral stability: H-MIOP, an N-heterocyclic carbene precursor and cationic analogue of the H-MOP ligand.
Chemistry - A European Journal, Wiley-VCH Verlag, 2011, 17 (18), pp.5110-5. ⟨10.1002/chem.201100205⟩

hal-02335955v1 Conference papers
Pauline Rulliere, Maroua Bourkhis, Dimitri Listunov, Hafida Gaspard, Valérie Maraval et al. Bio-inspired antitumor acetylenic lipids bearing alkynylcarbinol pharmacophores
Flash communication, Congrès SCF18, Jul 2018, Montpellier, France

hal-02335633v1 Poster communications
Rullière Pauline, Maroua Bourkhis, Dimitri Listunov, Hafida Gaspard, Valérie Maraval et al. Bio-inspired antitumor acetylenic lipids bearing alkynylcarbinol pharmacophores
10th International Chemistry Conference Toulouse-Kiev (ICTK-10), Jun 2019, Toulouse, France

hal-01383238v1 Journal articles
Patrick Chaquin, Yves Canac, Christine Lepetit, D Zargarian, Remi Chauvin. Estimating local bonding/antibonding character of canonical molecular orbitals from their energy derivatives. The case of coordinating lone pair orbitals
International Journal of Quantum Chemistry, Wiley, 2016, 116, pp.1285 - 1295. ⟨10.1002/qua.25174⟩

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