Preparation and structure characterization of 4-amino-1,2,4-triazol-5-one hydrate

被引:0
作者
Zhang, JG [1 ]
Zhang, TL
Yu, KB
机构
[1] Beijing Inst Technol, Dept Mech Engn, Beijing 100081, Peoples R China
[2] Chinese Acad Sci, Chengdu Branch, Ctr Anal & Measurement, Chengdu 610041, Peoples R China
来源
KHIMIYA GETEROTSIKLICHESKIKH SOEDINENII | 2003年 / 04期
关键词
4-amino-1,2,4-triazol-5-one; molecular structure; crystal structure; structure characterization;
D O I
暂无
中图分类号
O62 [有机化学];
学科分类号
070303 ; 081704 ;
摘要
4-Amino-1,2,4-triazol-5-one hydrate (ATO.H2O) was prepared and its structure was analyzed by four-circle diffraction measurement. The obtained results show that the crystal belongs to triclinic crystal system, space group P (1) over bar with crystal parameters of a = 6.432(1) Angstrom, b = 6.551(1) Angstrom, c = 6340(1) Angstrom, alpha = 68.04(1)degrees, beta = 82.18(1)degrees, gamma = 81.90(1)degrees, V = 259.7(7) Angstrom(3), Z = 2, D-c = 1.5 10 g/cm(3), mu = 0. 131 mm(-1), F(000) = 124. ATO.H2O was characterized by FT-IR analysis, X-ray diffraction analysis and single crystal diffraction analysis.
引用
收藏
页码:542 / 547
页数:6
相关论文
共 50 条
  • [31] Synthesis and crystal structure analysis of 2-(4-methyl-2′-biphenyl)-4-amino-1,2,4-triazole-3-thiol
    S. Nanjunda Swamy
    S. Basappa
    B. Naveen
    M. A. Prabhuswamy
    Javaregowda S. Sridhar
    Kanchugarakoppal S. Prasad
    Structural Chemistry, 2006, 17 : 91 - 95
  • [32] Crystal Structure 4-(2,4-Dihydroxybenzylideneamino)-5-methyl-2H-1,2,4-triazol-3(4H)-one
    Reşat Ustabaş
    Dilek Ünlüer
    Gülcan Kör
    Journal of Chemical Crystallography, 2011, 41 : 1237 - 1240
  • [33] Synthesis and crystal structure analysis of 2-(4-methyl-2′-biphenyl)-4-amino-1,2,4-triazole-3-thiol
    Swamy, S. Nanjunda
    Basappa
    Naveen, S.
    Prabhuswamy, B.
    Sridhar, M. A.
    Prasad, Javaregowda S.
    Rangappa, Kanchugarakoppal S.
    STRUCTURAL CHEMISTRY, 2006, 17 (01) : 91 - 95
  • [34] Crystal Structure 4-(2,4-Dihydroxybenzylideneamino)-5-methyl-2H-1,2,4-triazol-3(4H)-one
    Ustabas, Resat
    Unluer, Dilek
    Kor, Gulcan
    JOURNAL OF CHEMICAL CRYSTALLOGRAPHY, 2011, 41 (08) : 1237 - 1240
  • [35] Molecular structure, the quantum chemical investigation and the thermal behavior of the dimethylamine salt of 3-nitro-1,2,4-triazol-5-one, (CH3)2NH2+C2N4O3H-
    Ma, HX
    Song, JR
    Hu, RZ
    Zhai, GH
    Xu, KZ
    Wen, ZY
    JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 2004, 678 (1-3): : 217 - 222
  • [36] 4-(4-(( 5-Amino-1,3,4-thiadiazol-2-yl)methoxy) phenyl)-1-(( 5-amino-1,3,4-thiadiazol-2-yl)methyl)-3-benzyl-1H-1,2,4-triazol-5( H)-one: Synthesis, Characterization and Computational Studies
    Unluer, Dilek
    Unver, Yasemin
    Dugdu, Esra
    Akcay, Hakki Turker
    Sancak, Kemal
    LETTERS IN ORGANIC CHEMISTRY, 2016, 13 (08) : 604 - 617
  • [37] Synthesis and crystal structure of diaqua bis(4-amino-3-methyl-1,2,4-triazol-5-thione)cadmium(II) nitrate
    Hakimi, M
    Yazdanbakhsh, M
    Heravi, MM
    Ghassemzadeh, M
    Neumüller, B
    ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE, 2002, 628 (08): : 1899 - 1902
  • [38] Synthesis and crystal structural characterization of two new 3,5-disubstituted 4-amino-1,2,4-triazoles
    He, Xin
    Li, Bin
    Chen, Lang
    Shen, Xuan
    Zhu, Dun-Ru
    HETEROCYCLIC COMMUNICATIONS, 2014, 20 (04) : 201 - 206
  • [39] Synthesis and crystal structure of 4-salicylideneamino-3-methyl-1,2,4-triazol-5-thione
    Wen, LR
    Li, GQ
    Li, M
    Jing, SX
    Zhang, SS
    CHINESE JOURNAL OF STRUCTURAL CHEMISTRY, 2003, 22 (05) : 529 - 532
  • [40] Synthesis, Crystal Structure, and Characterization of a New Zinc Complex with Flexible Ligand (4-Amino-1,2,4-triazole-3,5-diyldithio)diacetic Acid and 4,4′-Bipyridine
    Yin, Mingcai
    Wu, Chaojun
    Yang, Xiumin
    Wang, Yuting
    Fan, Yaoting
    SYNTHESIS AND REACTIVITY IN INORGANIC METAL-ORGANIC AND NANO-METAL CHEMISTRY, 2010, 40 (10) : 798 - 804