Zobrazeno 1 - 4
of 4
pro vyhledávání: '"Nazmiye Öner"'
Publikováno v:
AIP Conference Proceedings.
In this paper, quantum chemical calculations of (2e)-3-(3-Bromo-4-methoxyphenyl) -1-(pyridin-2-yl)prop-2-en-1-one were performed by using B3LYP and CAMB3LYP levels of density functional theory (DFT) with 6-311++G(d, p) basis set. Geometric parameters
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::62dda1bbbed90ac1bb18ad1b909c129c
https://doi.org/10.1063/1.4976468
https://doi.org/10.1063/1.4976468
Publikováno v:
AIP Conference Proceedings.
Quantum mechanical calculations on cis-2, 6-bis (2-chlorophenyl)-3, 3-dimethylpiperidin-4-one were performed by using HSEH1PBE level of density functional theory (DFT) with 6-311++G (d, p) basis set. Geometric parameters of the title molecule in the
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::ec41cbdb91a04635bac8d49fcc0037a8
https://doi.org/10.1063/1.4944227
https://doi.org/10.1063/1.4944227
Publikováno v:
AIP Conference Proceedings.
This study reports the geometric parameters, vibration frequencies, 13C and 1H NMR chemical shifts of 3-(4-Methoxyphenyl)-1-(pyridin-2-yl) prop-2-en-1-one (MPP) molecule calculated by B3LYP level of density functional theory (DFT) with 6-311++G(d,p)
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::9f367ef08db3e8313ca3d9d243a53e05
https://doi.org/10.1063/1.4944226
https://doi.org/10.1063/1.4944226
The effective psychoactive properties of N,N-dimethyltryptamine (DMT) known as the near-death molecule have encouraged the imagination of many research disciplines for several decades. Although there is no theoretical study, a number of paper compose
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::e604f596cbca77b8e434558a5be6f5e4
https://hdl.handle.net/20.500.12619/32128
https://hdl.handle.net/20.500.12619/32128
