| Makale Türü | Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale) | ||
| Dergi Adı | Journal of Molecular Structure | ||
| Dergi ISSN | 0022-2860 Wos Dergi Scopus Dergi | ||
| Dergi Tarandığı Indeksler | SCI | ||
| Makale Dili | İngilizce | Basım Tarihi | 08-2015 |
| Kabul Tarihi | 12-04-2026 | Yayınlanma Tarihi | – |
| Cilt / Sayı / Sayfa | 1094 / 1 / 237–245 | DOI | 10.1016/j.molstruc.2015.03.059 |
| Makale Linki | http://linkinghub.elsevier.com/retrieve/pii/S002228601500294X | ||
| Özet |
| A new N’-Acetyl propane sulfonic acid hydrazide, C3H7single bondSO2single bondNHsingle bondNHsingle bondCOCH3 (Apsh, an sulfon amide compound) has been synthesized for the first time. The structure of Apsh was investigated using elemental analysis, spectral (IR, 1H/13C NMR) measurements. In addition, molecular structure of the Apsh was determined by single crystal X-ray diffraction technique and found that the compound crystallizes in monoclinic, space group P 21/c. 1H and 13C shielding tensors for crystal structure were calculated with GIAO/DFT/B3LYP/6-311++G(d,p) methods in CDCl3. The structure of Apsh is optimized using Density Functional Theory (DFT) method. The vibrational band assignments were performed at B3LYP/6-311++G(d,p) theory level combined with scaled quantum mechanics force field (SQMFF) methodology. The theoretical IR frequencies are found to be in good … |
| Anahtar Kelimeler |
| Antibacterial activity | Biological activities | DFT | Propane sulfonic acid hydrazide | X-ray |
| Atıf Sayıları | |
| Google Scholar | 16 |
| Scopus | 1 |
| Web of Science | 13 |
| Dergi Adı | Journal of Molecular Structure |
| Yayıncı | Elsevier B.V. |
| Açık Erişim | Hayır |
| ISSN | 0022-2860 |
| E-ISSN | 1872-8014 |
| CiteScore | 8,0 |
| SJR | 0,628 |
| SNIP | 0,999 |