Ivan VAKULİN, Elvira LATYPOVA, Rifkat FAATOVİCH, Gumer Yusupovich ISHMURATOV, Guzel Rafailovna TALIPOVA

1080

Influence of electronic structure of (R)-4-menten-3-one on its restricted rotation and inversion

Influence of electronic structure of (R)-4-menten-3-one on its restricted rotation and inversion

In this work we was study correlation between electronic structure of (R)-4-menthen-3-one and restricted transitions between its conformers. By NBO analysis, carried out in ab inition methods, we found special orbital interactions and sterical effects in conformers of (R)-4-menthen-3-one, which explained difficults of inversion and rotation.
Keywords:

Terpenoids, configuration determination NBO, B3LYP/6-311++G(2d, p), MP2/6-311++G(d, p).,

Tam Metin

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Bibtex @araştırma makalesi { tcandtc1168638, journal = {Turkish Computational and Theoretical Chemistry}, issn = {2587-1722}, eissn = {2602-3237}, address = {}, publisher = {Koray SAYIN}, year = {2023}, volume = {7}, number = {3}, pages = {1 - 9}, doi = {10.33435/tcandtc.1168638}, title = {Influence of electronic structure of (R)-4-menten-3-one on its restricted rotation and inversion}, key = {cite}, author = {Vakulin, Ivan and Latypova, Elvira and Faatovich, Rifkat and Ishmuratov, Gumer Yusupovich and Talıpova, Guzel Rafailovna} }
APA Vakulin, I. , Latypova, E. , Faatovich, R. , Ishmuratov, G. Y. & Talıpova, G. R. (2023). Influence of electronic structure of (R)-4-menten-3-one on its restricted rotation and inversion . Turkish Computational and Theoretical Chemistry , 7 (3) , 1-9 . DOI: 10.33435/tcandtc.1168638
MLA Vakulin, I. , Latypova, E. , Faatovich, R. , Ishmuratov, G. Y. , Talıpova, G. R. "Influence of electronic structure of (R)-4-menten-3-one on its restricted rotation and inversion" . Turkish Computational and Theoretical Chemistry 7 (2023 ): 1-9 <
Chicago Vakulin, I. , Latypova, E. , Faatovich, R. , Ishmuratov, G. Y. , Talıpova, G. R. "Influence of electronic structure of (R)-4-menten-3-one on its restricted rotation and inversion". Turkish Computational and Theoretical Chemistry 7 (2023 ): 1-9
RIS TY - JOUR T1 - Influence of electronic structure of (R)-4-menten-3-one on its restricted rotation and inversion AU - IvanVakulin, ElviraLatypova, RifkatFaatovich, Gumer YusupovichIshmuratov, Guzel RafailovnaTalıpova Y1 - 2023 PY - 2023 N1 - doi: 10.33435/tcandtc.1168638 DO - 10.33435/tcandtc.1168638 T2 - Turkish Computational and Theoretical Chemistry JF - Journal JO - JOR SP - 1 EP - 9 VL - 7 IS - 3 SN - 2587-1722-2602-3237 M3 - doi: 10.33435/tcandtc.1168638 UR - Y2 - 2023 ER -
EndNote %0 Turkish Computational and Theoretical Chemistry Influence of electronic structure of (R)-4-menten-3-one on its restricted rotation and inversion %A Ivan Vakulin , Elvira Latypova , Rifkat Faatovich , Gumer Yusupovich Ishmuratov , Guzel Rafailovna Talıpova %T Influence of electronic structure of (R)-4-menten-3-one on its restricted rotation and inversion %D 2023 %J Turkish Computational and Theoretical Chemistry %P 2587-1722-2602-3237 %V 7 %N 3 %R doi: 10.33435/tcandtc.1168638 %U 10.33435/tcandtc.1168638
ISNAD Vakulin, Ivan , Latypova, Elvira , Faatovich, Rifkat , Ishmuratov, Gumer Yusupovich , Talıpova, Guzel Rafailovna . "Influence of electronic structure of (R)-4-menten-3-one on its restricted rotation and inversion". Turkish Computational and Theoretical Chemistry 7 / 3 (Eylül 2023): 1-9 .
AMA Vakulin I. , Latypova E. , Faatovich R. , Ishmuratov G. Y. , Talıpova G. R. Influence of electronic structure of (R)-4-menten-3-one on its restricted rotation and inversion. Turkish Comp Theo Chem (TC&TC). 2023; 7(3): 1-9.
Vancouver Vakulin I. , Latypova E. , Faatovich R. , Ishmuratov G. Y. , Talıpova G. R. Influence of electronic structure of (R)-4-menten-3-one on its restricted rotation and inversion. Turkish Computational and Theoretical Chemistry. 2023; 7(3): 1-9.
IEEE I. Vakulin , E. Latypova , R. Faatovich , G. Y. Ishmuratov ve G. R. Talıpova , "Influence of electronic structure of (R)-4-menten-3-one on its restricted rotation and inversion", , c. 7, sayı. 3, ss. 1-9, Eyl. 2023, doi:10.33435/tcandtc.1168638
Turkish Computational and Theoretical Chemistry
  • ISSN: 2587-1722
  • Yayın Aralığı: Yılda Yılda 3 Sayı
  • Yayıncı: Koray SAYIN

6.5b70

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