(E)-5-(2-Chlorophenyl)-7-ethyl-2-oxo-2,3-dihydro-1H-thieno[2,3-e][1,4]diazepin-4-ium 2,4,6-trinitrophenolate

被引:1
|
作者
Betz, Richard [1 ]
Gerber, Thomas [1 ]
Hosten, Eric [1 ]
Dayananda, Alaloor S. [2 ]
Yathirajan, Hemmige S. [2 ]
Ramesha, A. R. [3 ]
机构
[1] Nelson Mandela Metropolitan Univ, Dept Chem, Port Elizabeth, South Africa
[2] Univ Mysore, Dept Studies Chem, Mysore 570006, Karnataka, India
[3] RL Fine Chem, Bangalore 560064, Karnataka, India
关键词
GRAPH-SET ANALYSIS; CRYSTALS; PATTERNS;
D O I
10.1107/S1600536812002607
中图分类号
O7 [晶体学];
学科分类号
0702 ; 070205 ; 0703 ; 080501 ;
摘要
In the title molecular salt, C15H14ClN2OS+center dot C6H2N3O7-, protonation occurred on the double-bonded N atom. One of the nitro groups shows slight disorder over two orientations, with an occupancy ratio of 0.91:0.09. In the crystal, classical N-H center dot center dot center dot O hydrogen bonds, as well as C-H center dot center dot center dot O contacts connect the components into a three-dimensional network. The seven-membered ring adopts a boat-like conformation. The least-squares plane defined by its non-H atoms encloses an angle of 38.99 (6)degrees with the benzene ring bonded to it.
引用
收藏
页码:O516 / U1668
页数:13
相关论文
共 50 条
  • [21] New Cyclopenta[4′,5′] pyrido[3′,2′:4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidines and Cyclopenta[4′,5′]pyrido[3′,2′:4,5]thieno[2,3-e][1,2,4]triazolo[1,5-c]pyrimidines: Synthesis and Antimicrobial Activities
    Sirakanyan, Samvel N.
    Spinelli, Domenico
    Geronikaki, Athina
    Kartsev, Viktor G.
    Hakobyan, Elmira K.
    Panosyan, Henrik A.
    Stepanyan, Hrachya M.
    Zuppiroli, Luca
    Hovakimyan, Anush A.
    CURRENT ORGANIC CHEMISTRY, 2017, 21 (13) : 1227 - 1241
  • [22] 1,4-Diazoniabicyclo[2.2.2]octane bis(2,4,6-trinitrophenolate)
    SiMa, Weiwei
    ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE, 2010, 66 : O1584 - U685
  • [23] SYNTHESIS AND BIOLOGICAL-ACTIVITY OF PYRIDO[2,3-E]-1,4 DIAZEPINE AND PYRIDO[2,3-B][1,4]DIAZEPINE
    CARBONI, S
    DASETTIMO, A
    BERTINI, D
    FERRARINI, PL
    LIVI, O
    TONETTI, I
    FARMACO-EDIZIONE SCIENTIFICA, 1975, 30 (04): : 237 - 247
  • [24] SYNTHESIS OF 3-ALKYL-5-PHENYL-2-THIOXO-3H-1,2-DIHYDRO-CYCLOALKA[4,5]THIENO[2,3-E][1,2,4]TRIAZEPINES
    RICHTER, P
    OERTEL, D
    OERTEL, F
    PHARMAZIE, 1988, 43 (11): : 753 - 755
  • [26] 2-(2-Chlorophenyl)-2,3-dihydroquinazolin-4(1H)-one
    Li, Ming-Jian
    Feng, Chang-Jun
    ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE, 2009, 65 : O2145 - U1949
  • [27] SYNTHESIS AND REACTIVITY OF FURO[2,3-E]PYRROLO[1,2-A][1,4]DIAZEPIN-9-ONE
    POVAZANEC, F
    DECROIX, B
    MOREL, J
    JOURNAL OF HETEROCYCLIC CHEMISTRY, 1992, 29 (06) : 1507 - 1512
  • [28] 3-(2-Chloroethyl)-2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidinium 2,4,6-trinitrophenolate
    Jasinski, Jerry P.
    Butcher, Ray J.
    Al-Arique, Q. N. M. Hakim
    Yathirajan, H. S.
    Narayana, B.
    ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE, 2009, 65 : O2201 - U2434
  • [29] N-(4-Chlorophenyl)-5-(4,5-dihydro-1H-imidazol-2-yl)thieno[2,3-b]pyridin-4-amine
    Bernardino, Alice M. R.
    Pinheiro, Luiz C. S.
    Tiekink, Edward R. T.
    Wardell, James L.
    Wardell, Solange M. S. V.
    ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2012, 68 : O2135 - +
  • [30] 4-ethyl-2,3-dihydro-4H-pyrido[3,2-e]-1,2,4-thiadiazine 1,1-dioxide and 4-ethyl-2,3-dihydro-4H-pyrido[4,3-e]-1,2,4-thiadiazine 1,1-dioxide
    Dupont, L
    Pirotte, B
    Podona, T
    Diouf, O
    Delarge, J
    De Tullio, P
    ACTA CRYSTALLOGRAPHICA SECTION C-CRYSTAL STRUCTURE COMMUNICATIONS, 1999, 55 : 461 - 464