Exceeding the oxygen content of liquid oxygen: bis(2,2,2-trinitroethyl) carbonate

被引:13
作者
Goebel, Michael [1 ]
Klapoetke, Thomas M. [1 ]
机构
[1] Univ Munich, Dept Chem & Biochem, D-81377 Munich, Germany
来源
ACTA CRYSTALLOGRAPHICA SECTION C-STRUCTURAL CHEMISTRY | 2008年 / 64卷
关键词
CRYSTAL-STRUCTURES;
D O I
10.1107/S0108270107066632
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
Bis(2,2,2-trinitroethyl) carbonate, C5H4N6O15, is an oxygen-rich compound (61.83% of molecular weight) of interest with respect to energetic materials. The molecule adopts an s-cis-s-cis conformation of the carbonate group. Intra- as well as intermolecular C-H center dot center dot center dot O and dipolar nitro-group interactions account for its exceptionally high density of 1.975 Mg m(-3). As a consequence of the relationship between structure and crystal density, this polymorph contains available oxygen in amounts even superior to liquid oxygen.
引用
收藏
页码:O58 / O60
页数:3
相关论文
共 10 条
[1]   The Cambridge Structural Database: a quarter of a million crystal structures and rising [J].
Allen, FH .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 2002, 58 (3 PART 1) :380-388
[2]   COMPLETION AND REFINEMENT OF CRYSTAL-STRUCTURES WITH SIR92 [J].
ALTOMARE, A ;
CASCARANO, G ;
GIACOVAZZO, C ;
GUAGLIARDI, A .
JOURNAL OF APPLIED CRYSTALLOGRAPHY, 1993, 26 (pt 3) :343-350
[3]  
[Anonymous], LEHRBUCH ANORGANISCH
[5]   VAN DER WAALS VOLUMES + RADII [J].
BONDI, A .
JOURNAL OF PHYSICAL CHEMISTRY, 1964, 68 (03) :441-+
[6]   2,2,2-Trinitroethanol [J].
Goebel, Michael ;
Klapoetke, Thomas M. .
ACTA CRYSTALLOGRAPHICA SECTION C-STRUCTURAL CHEMISTRY, 2007, 63 (o562-o564) :O562-O564
[8]   CRYSTAL STRUCTURE OF N,N'-BIS-(BETA,BETA,BETA-TRINITROETHYL)UREA [J].
LIND, MD .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL CRYSTALLOGRAPHY AND CRYSTAL CHEMISTRY, 1970, B 26 :590-&
[9]   REVISED EFFECTIVE IONIC-RADII AND SYSTEMATIC STUDIES OF INTERATOMIC DISTANCES IN HALIDES AND CHALCOGENIDES [J].
SHANNON, RD .
ACTA CRYSTALLOGRAPHICA SECTION A, 1976, 32 (SEP1) :751-767
[10]   Single-crystal structure validation with the program PLATON [J].
Spek, AL .
JOURNAL OF APPLIED CRYSTALLOGRAPHY, 2003, 36 :7-13