Spectroscopic Study of the Semihydrate of the Dodecahydro-closo-dodecaborate of 2,4,6-Triamino-1,3,5-triazine

被引：1
|
作者：
Saldin, V. I. [1 ]
Slobodyuk, A. B. [1 ]
Savchenko, N. N. [1 ]
Ignat'eva, L. N. [1 ]
Buznik, V. M. [1 ]
机构：
[1] Russian Acad Sci, Inst Chem, Far Eastern Branch, Vladivostok 690022, Russia
来源：
RUSSIAN JOURNAL OF PHYSICAL CHEMISTRY A | 2018年 / 92卷 / 11期
关键词：
IR; NMR B-11; H-1; C; N; semihydrate of 2,4,6-triamino-1,3,5-triazine (melamine) dodecahydro-closo-dodecaborate; directed localized cation-anion interactions; Hartree-Fock method; FEATURES; MELAMINE; SALTS;
D O I：
10.1134/S0036024418110353
中图分类号：
O64 [物理化学（理论化学）、化学物理学];
学科分类号：
070304 ; 081704 ;
摘要：
The presence of directed localized cation-anion interactions in the semihydrate of 2,4,6-triamino-1,3,5-triazine (melamine) dodecahydro-closo-dodecaborate (C3H6N6H)(2)B12H12 <bold> </bold>0.5H(2)O is discovered by means of IR and NMR-spectroscopy (B-11, H-1, C, N). The hypothesis that melamine protonation proceeds on the ring atom of nitrogen is confirmed via quantum-chemical calculations.
引用
收藏
页码：2210 / 2214
页数：5
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