✦ LIBER ✦

Nature of coordination bond in silatranes and its formation dynamics according to the ab initio calculations

✍ Scribed by Feshin, V. P.; Feshina, E. V.

Book ID: 121552859
Publisher: Springer
Year: 2014
Tongue: English
Weight: 157 KB
Volume: 84
Category: Article
ISSN: 1070-3632
DOI: 10.1134/S1070363214010101

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Structure of the CCl3CCl=NCH2C6H5molecul

Structure of the CCl3CCl=NCH2C6H5molecule and reorientations of its CCl3group, according to ab initio calculations

✍ G. B. Soifer; V. P. Feshin 📂 Article 📅 2007 🏛 Springer 🌐 English ⚖ 39 KB

Nature of the bonding in bromine oxides

Nature of the bonding in bromine oxides and fluorides from the results of ab initio calculations

✍ Yu. B. Kirillov; N. M. Klimenko 📂 Article 📅 1980 🏛 SP MAIK Nauka/Interperiodica 🌐 English ⚖ 439 KB

Ab initio calculations related to the fo

Ab initio calculations related to the formation of propynal and propadienone in interstellar clouds

✍ Robert G.A.R. Maclagan; Murray J. McEwan; Graham.B.I. Scott 📂 Article 📅 1995 🏛 Elsevier Science 🌐 English ⚖ 487 KB

The proposal that propynal, CHCCHO, observed in interstellar clouds is formed by the ion molecule reaction of C2H ~and CO has been investigated in a G2 study. The calculations show that propadienone CH2CCO could be formed by this reaction but not propynal. At the G2 level of theory, propadienone is

Effect of the Carbonyl Group on the C-Cl

Effect of the Carbonyl Group on the C-Cl Bonds in 2,2-Dichlorocyclohexanone and Some Model Molecules, According to ab initio Calculations

✍ V. P. Feshin; E. V. Feshina; L. I. Zhizhina 📂 Article 📅 2001 🏛 Springer 🌐 English ⚖ 40 KB

Ab initio SCF calculations of the barrie

Ab initio SCF calculations of the barrier to internal rotation in formamidine and its derivatives

✍ Wojciech Kinasiewicz; Andrzej Leś; Iwona Wawer 📂 Article 📅 1988 🏛 Elsevier Science 🌐 English ⚖ 883 KB

Geometrical consequences of intermolecul

Geometrical consequences of intermolecular hydrogen bond formation in the formic acid and acetic acid dimers from ab initio MO calculations

✍ Konstantin B. Borisenko; Charles W. Bock; István Hargittai 📂 Article 📅 1995 🏛 Elsevier Science 🌐 English ⚖ 571 KB