Yazarlar (5) |
![]() Erciyes Üniversitesi, Türkiye |
![]() Erciyes Üniversitesi, Türkiye |
![]() Erciyes Üniversitesi, Türkiye |
![]() Kastamonu Üniversitesi, Türkiye |
![]() Erciyes Üniversitesi, Türkiye |
Özet |
The 1H-pyrazole-3-carboxylic acids 2a-b were converted via reactions of acid chlorides 3a-b with various hydrazide derivatives 4a-k into the corresponding novel 1H-pyrazole-3-carbohydrazides 5a-k, in good yields (60-90%). It was demonstrated that with the variation in reaction conditions, the reaction changes leading to different products. All the newly synthesized compounds were characterized by elemental analyses, IR, 1H and 13C NMR spectroscopic data. All compounds were compared with their previous analogues. The highest occupied molecular orbital energy (EHOMO), lowest unoccupied molecular orbital energy (ELUMO), the energy gap between EHOMO and ELUMO, dipole moment (DM), sum of the total negative charge (TNC), global hardness (η), softness (σ), chemical potential (µ), and electronegativity (χ) values and Fukui functions were calculated. |
Anahtar Kelimeler |
Makale Türü | Özgün Makale |
Makale Alt Türü | Uluslararası alan indekslerindeki dergilerde yayınlanan tam makale |
Dergi Adı | Chem. Sci. Rev. Lett. |
Dergi ISSN | 2278-6783 |
Dergi Tarandığı Indeksler | Chemical Abstract Service (CAS, SciFinder, A division of the American Chemical Society) |
Makale Dili | İngilizce |
Basım Tarihi | 07-2015 |
Cilt No | 4 |
Sayı | 15 |
Sayfalar | 838 / 850 |
Makale Linki | http://www.chesci.com/articles/csrl/v4i15/10_CS07204607.pdf |