MASS-SPECTROMETRIC AND GAUSSIAN2 STUDIES OF THE DIAZENE (HNNH) AND ISODIAZENE (H2NN) MOLECULES AND THEIR RADICAL CATIONS

被引：15

作者：

GOLDBERG, N ^{[1
]}

HOLTHAUSEN, MC ^{[1
]}

HRUSAK, J ^{[1
]}

KOCH, W ^{[1
]}

SCHWARZ, H ^{[1
]}

机构：

[1] TECH UNIV BERLIN,INST ORGAN CHEM,D-10623 BERLIN,GERMANY

来源：

CHEMISCHE BERICHTE | 1993年 / 126卷 / 12期

关键词：

CHARGE-TRANSFER EXPERIMENTS; TANDEM MASS SPECTROMETRY; DIAZENE; POTENTIAL ENERGY SURFACE;

D O I：

10.1002/cber.19931261227

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

Collision experiments demonstrate that isodiazene (H2NN) and its radical cation are viable molecules in the gas phase, The mass-spectrometric experiments are complemented by extensive ab-initio MO calculations using the GAUSSIAN-2 procedure in order to map out relevant parts of the potential energy surface of H2N2 (singlet) and H2N2+ (doublet).

引用

页码：2753 / 2758

页数：6

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