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卷 66, 编号 1 (2017)
Crystalline hydrates of calix[4]arene-para-sulfonic acid with n (n = 6–16) water molecules: a structure modeling
Zyubina T., Shmygleva L., Pisarev R., Zyubin A., Pisareva A., Dobrovolsky Y., Volokhov V.
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(Eng)
卷 65, 编号 7 (2016)
Quantum chemical studies of azoles 7. N-alkyl substituent effect on calculated thermodynamic parameters of the electrophilic substitution mechanism in 1H-tetrazole via elimination–addition scheme without preceding formation of N-protonated azolium salts
Chuvylkin N., Subbotin A., Belen’kii L.
PDF
(Eng)
卷 66, 编号 1 (2017)
Iron(II) and ruthenium(II) complexes with polypyridine derivatives as sensitizers for DSSC: the structure and spectral properties, as studied by quantum chemistry methods
Tsaturyan A., Shcherbakov I., Shvydko T., Kogan V.
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(Eng)
卷 65, 编号 4 (2016)
Coordination compounds of CuCl2 with 1-(N-heterylmethyl)silatranes
Bolgova Y., Belogolova E., Belyaeva V., Timofeeva E., Trofimova O.
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(Eng)
卷 65, 编号 4 (2016)
Cycloacylation of chloro-substituted hydroquinone dimethyl ethers with dichloromaleic anhydride
Novikov V., Balaneva N., Shestak O., Anufriev V., Glazunov V.
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(Eng)
卷 68, 编号 4 (2019)
On the relationship between the energy characteristics of the isodesmic reactions of polychlorinated dioxins and their toxicity
Abronin I., Volkova L.
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(Eng)
卷 65, 编号 4 (2016)
Synthesis and studies of new photochromic spiropyrans containing a formylcoumarin fragment
Nikolaeva O., Metelitsa A., Cheprasov A., Karlutova O., Starikov A., Dubonosov A., Bren´ V., Minkin V.
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(Eng)
卷 66, 编号 8 (2017)
Calculations of interaction energy between certain components of large multimolecular complexes
Ryzhkov M., Delley B.
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(Eng)
卷 65, 编号 4 (2016)
Quantum chemical studies of azoles 6. The effect of specific solvation on the calculated thermodynamic parameters of electrophilic substitution in tetrazole according to the elimination—addition scheme without preliminary formation of N-protonated azolium salts
Chuvylkin N., Subbotin A., Belen´kii L.
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(Eng)
卷 66, 编号 8 (2017)
Mechanism of the unusual substituent exchange in the reactions of alkylene oxides with organic compounds bearing β-hydroxyalkyl groups at heteroatoms S, Se, N, and P
Malievskii A.
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(Eng)
卷 65, 编号 7 (2016)
Cyclization of alk-4-ynals with o-diaminoarenes as a selective one-pot synthesis of arylmethylidene-substituted 2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazoles and 7,8-dihydro-6H-pyrrolo[1’,2’:1,2]imidazo[4,5-b]pyridines
Gvozdev V., Shavrin K., Baskir E., Egorov M., Nefedov O.
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(Eng)
卷 66, 编号 5 (2017)
Quantum chemical studies of azoles 10. Transition states in the routes of electrophilic substitution in 1H-tetrazole via the elimination—addition mechanism without preliminary formation of N-protonated azolium salts
Chuvylkin N., Subbotin A., Belen´kii L.
PDF
(Eng)
卷 65, 编号 7 (2016)
Quantum chemical studies of azoles 8. Effect of N(2)-methyl substituent on the calculated thermodynamic parameters of electrophilic substitution in tetrazole according to the elimination–addition scheme without preceding formation of N-protonated azolium salts
Belen’kii L., Subbotin A., Chuvylkin N.
PDF
(Eng)
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