How reliable are GIAO calculations of 1H and 13C NMR chemical shifts? A statistical analysis and empirical corrections at DFT (PBE/3z) level EY Pankratyev, AR Tulyabaev, LM Khalilov Journal of Computational Chemistry 32 (9), 1993-1997, 2011 | 89 | 2011 |
Synthesis, structure and photochromic properties of hybrid molecules based on fullerene C 60 and spiropyrans AR Tuktarov, AA Khuzin, AR Tulyabaev, OV Venidictova, TM Valova, ... RSC advances 6 (75), 71151-71155, 2016 | 31 | 2016 |
Catalytic multicomponent thiomethylation of aliphatic 1, 3-diketones as efficient one-pot synthesis of novel bis (1, 3-diketone-2-ylmethylsulphanyl) alkanes VR Akhmetova, NS Akhmadiev, ZA Starikova, AR Tulyabaev, ... Tetrahedron 71 (40), 7722-7728, 2015 | 28 | 2015 |
Covalent binding of fullerene C60 to dithienylethene as a promising approach to the preparation of new photochromic compounds AR Tuktarov, AA Khuzin, AR Akhmetov, LM Khalilov, AR Tulyabaev, ... Mendeleev Communications 26 (2), 143-145, 2016 | 24 | 2016 |
TaCl5-catalyzed reaction of 1-alkenes with n-alkyl Grignard reagents RM Sultanov, RR Ismagilov, R Natal'ya, AR Tulyabaev, UM Dzhemilev Journal of Organometallic Chemistry 724, 51-56, 2013 | 24 | 2013 |
On accuracy of the 13C NMR chemical shift GIAO calculations of fullerene C60 derivatives at PBE/3ζ approach AR Tulyabaev, LM Khalilov Computational and Theoretical Chemistry 976 (1-3), 12-18, 2011 | 23 | 2011 |
TaCl5-catalyzed carbomagnesiation of some norbornenes with ethyl Grignard reagents RM Sultanov, RR Ismagilov, R Natal'ya, AR Tulyabaev, DS Sabirov, ... Journal of Organometallic Chemistry 745, 120-125, 2013 | 22 | 2013 |
Synthesis of optically active spiro homo-and methanofullerenes AR Tuktarov, VV Korolev, AR Tulyabaev, LM Khalilov, UM Dzhemilev Tetrahedron Letters 52 (7), 834-836, 2011 | 22 | 2011 |
1H and 13C NMR chemical shift assignments of spiro‐cycloalkylidenehomo‐ and methanofullerenes by the DFT–GIAO method LM Khalilov, AR Tulyabaev, VM Yanybin, AR Tuktarov Magnetic Resonance in Chemistry 49 (6), 378-384, 2011 | 18 | 2011 |
Cycloaddition of diazocycloalkanes to [60] fullerene in the presence of Pd-containing complex catalyst AR Tuktarov, VV Korolev, AR Tulyabaev, VM Yanybin, LM Khalilov, ... Russian Chemical Bulletin 59, 977-983, 2010 | 16 | 2010 |
Are there reliable DFT approaches for 13C NMR chemical shift predictions of fullerene C60 derivatives? AR Tulyabaev, II Kiryanov, IS Samigullin, LM Khalilov International Journal of Quantum Chemistry 117 (1), 7-14, 2017 | 15 | 2017 |
Homo‐and methano [60] fullerenes with chiral attached moieties–1H and 13C NMR chemical shift assignments and diastereotopicity effects LM Khalilov, AR Tulyabaev, AR Tuktarov Magnetic Resonance in Chemistry, 2011 | 14 | 2011 |
Synthesis, photo and acidochromic properties of spiropyran-containing methanofullerenes AA Khuzin, AR Tuktarov, VA Barachevsky, TM Valova, AR Tulyabaev, ... RSC advances 10 (27), 15888-15892, 2020 | 13 | 2020 |
Synthesis of [60]fulleropyrrolidine–dithienylethene conjugates and DFT calculations of their photochromic properties DUM Tuktarov A. R., Khuzin A. A., Khalilov L. M., Tulyabaev A. R., Akhmetov ... Mendeleev Communications 25, 470-472, 2015 | 13 | 2015 |
Diastereotopic splitting in the 13C NMR spectra of sulfur homofullerenes and methanofullerenes with chiral fragments AR Tulyabaev, AR Tuktarov, LM Khalilov Magnetic Resonance in Chemistry 52 (1-2), 3-9, 2014 | 12 | 2014 |
Unusual pathway of the tantalum-catalyzed carboalumination reaction of alkenes with triethylaluminum RM Sultanov, EV Samoilova, AR Tulyabaev, DS Sabirov, UM Dzhemilev Tetrahedron Letters 54 (48), 6619-6623, 2013 | 11 | 2013 |
Synthesis of amino substituted methanofullerenes in the presence of Ti (Oi-Pr) 4 AR Tuktarov, ZR Shakirova, AA Khuzin, AR Tulyabaev, IR Ramazanov, ... Tetrahedron Letters 57 (38), 4314-4317, 2016 | 10 | 2016 |
Prediction of 13C NMR chemical shifts by artificial neural network. I. Partial charge model as atomic descriptor II Kiryanov, FH Mukminov, AR Tulyabaev, LM Khalilov Chemometrics and Intelligent Laboratory Systems 152, 62-68, 2016 | 8 | 2016 |
Neural network for prediction of 13C NMR chemical shifts of fullerene C60 mono‐adducts II Kiryanov, AR Tulyabaev, FK Mukminov, LM Khalilov Journal of Chemometrics 32 (9), e3037, 2018 | 7 | 2018 |
Structure of α, ω-bis-(pentane-2, 4-dione-3-ylmethylsulfanyl) alkanes and even/odd crystallization effects LM Khalilov, AR Tulyabaev, ES Mescheryakova, NS Akhmadiev, ... Journal of Crystal Growth 426, 214-220, 2015 | 7 | 2015 |