Crystallographic and conformational analysis of E 2 isopropyl 4 p tolyldiazenyl phenol
Yazarlar (5)
Prof. Dr. Nazan Ocak Iskeleli Ondokuz Mayis Üniversitesi, Türkiye
Prof. Dr. Hasan Karabiyik Dokuz Eylül Üniversitesi, Türkiye
Prof. Dr. Çiğdem ALBAYRAK KAŞTAŞ Ondokuz Mayis Üniversitesi, Türkiye
Erbil Aǧar
Ondokuz Mayis Üniversitesi, Türkiye
Ondokuz Mayis Üniversitesi, Türkiye
Ismail Erdem Gümrükçüoǧlu
Ondokuz Mayis Üniversitesi, Türkiye
Ondokuz Mayis Üniversitesi, Türkiye
| Makale Türü | Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale) | ||
| Dergi Adı | Structural Chemistry (Q2) | ||
| Dergi ISSN | 1040-0400 Dergi Bilgileri (2008) | ||
| Dergi Tarandığı Indeksler | SCI-Expanded | ||
| Makale Dili | İngilizce | Basım Tarihi | 08-2008 |
| Kabul Tarihi | – | Yayınlanma Tarihi | 17-05-2008 |
| Cilt / Sayı / Sayfa | 19 / 4 / 565–570 | DOI | 10.1007/s11224-008-9326-7 |
| Makale Linki | http://link.springer.com/10.1007/s11224-008-9326-7 | ||
| UAK Araştırma Alanları |
Organik Kimya
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| Özet |
| The molecular and crystal structures of the title compound, C16H18N2O, were characterized and determined by single crystal X-ray diffraction method in addition to spectroscopic means such as IR, UV–VIS and 1H NMR. The compound crystallizes in orthorhombic space group P bca, with a = 9.3350(5) Å, b = 23.4878(13) Å, c = 26.5871(12) Å, Z = 16, Dcalc. = 1.1591(1) g/cm3, μ (MoKα) = 0.073 mm−1. Monomers of the compound in the crystal structure are linked into C(7) and C(8) chains generated by translation along the [1 0 0] direction with the aid of O–H···N type H-bonds which serve to the stabilization of periodic organization of the molecules beside major and minor component in the disordered azo fragment. In order to describe conformational flexibility and the crystal packing effects on the molecular conformation, potential barriers regarding the rotation along both Ar–N bonds were calculated by varying the … |
| Anahtar Kelimeler |
| Azo benzene | Conformational analysis | Crystal structure | DFT/B3LYP |
BM Sürdürülebilir Kalkınma Amaçları
| Atıf Sayıları | |
| Web of Science | 5 |
| Scopus | 5 |
| Google Scholar | 5 |