✦ LIBER ✦

Ab initio and density functional investigation of the molecular geometries and Ch⋯N interactions in diamido chalcogenides, Ch(NR2)2 (Ch=S, Se, Te; R=H, CH3)

✍ Scribed by C Kontopoulos; M.P Sigalas

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Ab initio molecular orbital study on str

✍ Masao Masamura; Shigeru Ikuta 📂 Article 📅 1999 🏛 John Wiley and Sons 🌐 English ⚖ 181 KB 👁 2 views

than the C-O bond length of CH O in the gas phase by 0.044 A at the 3 MP2raug-cc-pVDZ level of theory. The structure of the CH S y moiety in

Intramolecular non-bonded interactions b

✍ George D. Markham; Cindy L. Bock; Mendel Trachtman; Charles W. Bock 📂 Article 📅 1999 🏛 Elsevier Science 🌐 English ⚖ 197 KB

The binding of water to the carboxylate

✍ George D. Markham; Mendel Trachtman; Cindy L. Bock; Charles W. Bock 📂 Article 📅 1998 🏛 Elsevier Science 🌐 English ⚖ 477 KB

AB initio calculations of the molecular

✍ Tae-Kyu Ha; M.-T. Nguyen; L.G. Vanquickenborne 📂 Article 📅 1982 🏛 Elsevier Science 🌐 English ⚖ 455 KB

Ab initio calculations of the molecular

✍ Tae-Kyu Ha; M.-T. Nguyen; L.G. Vanquickenborne 📂 Article 📅 1982 🏛 Elsevier Science 🌐 English ⚖ 443 KB

AB initio calculations of the molecular

✍ Tae-Kyu Ha; M.-T. Nguyen; L.G. Vanquickenborne 📂 Article 📅 1982 🏛 Elsevier Science 🌐 English ⚖ 454 KB