Theoretical and experimental assesment of structural, spectroscopic, electronic and nonlinear optical properties of two aroylhydrazone derivative
Yazarlar (5)
Doç. Dr. Füreya Elif ÖZTÜRKKAN Kafkas Üniversitesi, Türkiye
Doç. Dr. Güventürk UĞURLU Kafkas Üniversitesi, Türkiye
Doç. Dr. Erbay KALAY Kafkas Üniversitesi, Türkiye
Prof. Dr. Hacali NECEFOĞLU Kafkas Üniversitesi, Türkiye
Tuncer Hökelek
Hacettepe Üniversitesi, Türkiye
Hacettepe Üniversitesi, Türkiye
| Makale Türü | Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale) | ||
| Dergi Adı | Journal of Molecular Structure (Q3) | ||
| Dergi ISSN | 0022-2860 Wos Dergi Scopus Dergi | ||
| Dergi Tarandığı Indeksler | SCI-Expanded | ||
| Makale Dili | Türkçe | Basım Tarihi | 01-2021 |
| Cilt / Sayı / Sayfa | 1223 / 1 / 128982–0 | DOI | 10.1016/j.molstruc.2020.128982 |
| Makale Linki | http://dx.doi.org/10.1016/j.molstruc.2020.128982 | ||
| Özet |
| Two aroylhydrazone, N'-(pyridine-4-ylmethylene)nicotic acid hydrazide (1) and N'-(pyridine-3-ylmethylene)nicotic acid hydrazide (2), were synthesized and their structures were determined by single-crystal X-ray diffraction analysis. The X-ray analysis indicated that the compound 1 was crystallized in triclinic crystal system with P -1 space group a = 8.7899 (2) Å, b = 10.8983 (3) Å, c = 11.7726 (3) Å, α= 89.952 (3)°, β = 88.684 (3)°, γ= 75.293 (2)°, V = 1090.50 (5) Å3 and Z = 4 and compound 2 was crystallized in monoclinic crystal system with P21/c space group, a = 11.9239 (3) Å, b = 8.6495 (2) Å, c = 11.1021 (3) Å, α= 90 (3)°, β = 111.664 (3) (3)°, γ= 90°, V = 1064.14 (5) Å3 and Z = 4. Intermolecular interactions of the compounds were determined by Hirhfeld Surface Analysis. The H ··· H interactions with 37.9% (for compound 1) and 37.5% (for compound 2) contributions are the most important interactions to the overall … |
| Anahtar Kelimeler |
| Aroylhydrazones | Energy gap | Hirshfeld surface analysis | Molecular electrostatic potential | Single crystal XRD | Spectroscopic characterization |
Science Direct
Theoretical and experimental assesment of structural, spectroscopic, electronic and nonlinear optical properties of two aroylhydrazone derivative
BM Sürdürülebilir Kalkınma Amaçları
| Atıf Sayıları | |
| WoS | 6 |
| SCOPUS | 8 |
| Google Scholar | 8 |