Solid-State and Gas-Phase Structures and Energetic Properties of the Dangerous Methyl and Fluoromethyl Nitrates

被引：14

作者：

Reichel, Marco ^{[1
]}

Krumm, Burkhard ^{[1
]}

Vishnevskiy, Yury V. ^{[2
]}

Blomeyer, Sebastian ^{[2
]}

Schwabedissen, Jan ^{[2
]}

Stammler, Hans-Georg ^{[2
]}

Karaghiosoff, Konstantin ^{[1
]}

Mitzel, Norbert W. ^{[2
]}

机构：

[1] Ludwig Maximilians Univ Munchen, Dept Chem, Butenandtstr 5-13 D, D-81377 Munich, Germany

[2] Univ Bielefeld, Lehrstuhl Anorgan Chem & Strukturchem, Fak Chem, Univ Str 25, D-33615 Bielefeld, Germany

来源：

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION | 2019年 / 58卷 / 51期

关键词：

energetic properties; fluoromethyl nitrate; gas electron diffraction; methyl nitrate; X-ray diffraction; NUCLEAR-MAGNETIC-RESONANCE; MICROWAVE-SPECTRUM; CRYSTAL PACKING; AB-INITIO; MOLECULES; MECHANISM; SALTS; ESTER; HEAT;

D O I：

10.1002/anie.201911300

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

An improved synthesis of the simplest nitric acid ester, methyl nitrate, and a new synthesis of fluoromethyl nitrate use the metathesis of the corresponding iodomethanes with silver nitrate. Both compounds were identified by spectroscopy and the structures determined for in situ grown crystals by X-ray diffraction as well as in the gas phase by electron diffraction. Fluorination leads to structures with shorter C-O and N-O bonds, has an energetically destabilizing effect and increases friction sensitivity, but decreases detonation performance.

引用

页码：18557 / 18561

页数：5

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