THEORETICAL STUDY OF SITE OF PROTONATION OF FORMAMIDE USING NON-EMPIRICAL LCAO-MO-SCF CALCULATIONS

被引：39

作者：

HOPKINSO.AC

CSIZMADI.IG

机构：

[1] YORK UNIV,DEPT CHEM,DOWNSVIEW,ONTARIO,CANADA

[2] UNIV TORONTO,LASH MILLER CHEM LABS,TORONTO 181,ONTARIO,CANADA

来源：

CANADIAN JOURNAL OF CHEMISTRY-REVUE CANADIENNE DE CHIMIE | 1973年 / 51卷 / 09期

关键词：

D O I：

10.1139/v73-215

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：1432 / 1434

页数：3

共 33 条

[21] N-PROTONATION VERSUS O-PROTONATION - EVIDENCE FROM NUCLEAR MAGNETIC RESONANCE SPECTRA OF [N-15]ACETAMIDE IN FLUOROSULPHURIC ACID [J].

LILER, M .

JOURNAL OF THE CHEMICAL SOCIETY D-CHEMICAL COMMUNICATIONS, 1971, (02) :115-&

[22]

MARTIN RB, 1972, CHEM COMMUN, P73

[23]

MELY B, 1972, CR ACAD SCI C CHIM, V274, P1371

[24] AB-INITIO STUDY OF HYDROGEN-BOND IN [H3N-H...NH3]+ [J].

MERLET, P ;

PEYERIMH.SD ;

BUENKER, RJ .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1972, 94 (24) :8301-&

[25] NON-EMPIRICAL LCAO-MO-SCF-CI CALCULATIONS ON ORGANIC MOLECULES WITH GAUSSIAN TYPE FUNCTIONS .4. PRELIMINARY INVESTIGATIONS ON FORMAMIDE [J].

ROBB, MA ;

CSIZMADI.IG .

THEORETICA CHIMICA ACTA, 1968, 10 (03) :269-&

[26]

ROCHESTER CH, 1970, ACIDITY FUNCTIONS, pCH3

[27] ELECTRODE POTENTIALS AND HYDRATION ENERGIES - THEORIES AND CORRELATIONS [J].

ROSSEINSKY, DR .

CHEMICAL REVIEWS, 1965, 65 (04) :467-+

[28] KINETIC EVIDENCE FOR PREDOMINANT OXYGEN PROTONATION OF AMIDES [J].

SMITH, CR ;

YATES, K .

CANADIAN JOURNAL OF CHEMISTRY, 1972, 50 (05) :771-&

[29]

TAFT RW, 1960, J AM CHEM SOC, V82, P1965

[30]

VEILLARD A, IBMOL COMPUTATION WA

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