✦ LIBER ✦

Quantum chemical study of the tautomerism, geometry, and electronic structure of 1,2,3- and 1,2,4-triazoles

✍ Scribed by K. A. Davarski; N. K. Khalachev; R. Z. Yankova; S. Raikov

Publisher: Springer US
Year: 1998
Tongue: English
Weight: 348 KB
Volume: 34
Category: Article
ISSN: 0009-3122
DOI: 10.1007/bf02290940

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

A survey of the lone pair effect on the

A survey of the lone pair effect on the ring geometry of 1,2,4-triazoles and analogous 1,2,3-triazoles and imidazoles: The structures of 1-methyl-5-amino-3-methylthio-1,2,4-triazole, 1-phenyl-5-amino-3-methylthio-1,2,4-triazole and 1-(4-methylbenzyl)-3-amino-5-methylthio-1,2,4-triazole

✍ A. Kálmán; Gy. Argay 📂 Article 📅 1983 🏛 Elsevier Science 🌐 English ⚖ 661 KB

Tautomeric 2-arylquinolin-4(1H)-one deri

Tautomeric 2-arylquinolin-4(1H)-one derivatives- spectroscopic, X-ray and quantum chemical structural studies

✍ Malose J Mphahlele; Ahmed M El-Nahas 📂 Article 📅 2004 🏛 Elsevier Science 🌐 English ⚖ 161 KB

Quantum chemical investigation of the el

Quantum chemical investigation of the electronic structure of poly(2,4-dioxocyclobuta-1,3-diylidene)

✍ S. G. Semenov 📂 Article 📅 1998 🏛 SP MAIK Nauka/Interperiodica 🌐 English ⚖ 288 KB

An ab initio study of the structure, tau

An ab initio study of the structure, tautomerism and molecular properties of the C- and N-amino-1,2,4-triazoles

✍ Michael H. Palmer; Dines Christen 📂 Article 📅 2004 🏛 Elsevier Science 🌐 English ⚖ 232 KB

The tautomerism of 1,2,3-triazole, 3(5)-

The tautomerism of 1,2,3-triazole, 3(5)-methylpyrazole and their cations

✍ Javier Catalán; Marta Sánchez-Cabezudo; José Luis G. De Paz; José Elguero; Rober 📂 Article 📅 1989 🏛 John Wiley and Sons 🌐 English ⚖ 656 KB

The annular tautomerism of 1,2,3-triazole and 3(5)-methylpyrazole is discussed by means of a combination of theoretical calculations and experimental (ICR) gas-phase basicities and acidities. In the gas phase 1,2,3-triazole exists as the ZH-tautomer, whereas both tautomers of 3(5)-methylpyrazole are

Electronic structure, geometry, and reac

Electronic structure, geometry, and reactivity of arylsilenes: a quantum-chemical study

✍ L. M. Timofeeva; V. V. Volkova; L. E. Gusel'nikov 📂 Article 📅 1999 🏛 Springer 🌐 English ⚖ 447 KB