KEGG   COMPOUND: C11037Help
Entry
C11037                      Compound                               

Name
Chlorothalonil;
Tetrachloroisophthalonitrile;
Daconil;
TPN
Formula
C8Cl4N2
Exact mass
263.8816
Mol weight
265.911
Structure
Mol fileKCF fileDB searchJmolKegDraw
Comment
organochlorine fungicide
Brite
Pesticides [BR:br08007]
 Pesticides
  Fungicides
   Organochlorine fungicides
    C11037  Chlorothalonil
Carcinogens [BR:br08008]
 Group 2B: Possibly carcinogenic to humans
  Compounds
   C11037  Chlorothalonil
BRITE hierarchy
Other DBs
CAS: 
1897-45-6
PubChem: 
ChEBI: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        14
            1   C8y C    27.7570  -17.2844
            2   C8y C    26.5463  -17.9802
            3   C8y C    26.5448  -19.3844
            4   C8y C    27.7570  -20.0830
            5   C8y C    28.9677  -19.3802
            6   C8y C    28.9663  -17.9857
            7   X   Cl   30.1851  -17.2914
            8   C3b C    30.1822  -20.0869
            9   X   Cl   27.7551  -21.4848
            10  X   Cl   25.3349  -20.0889
            11  X   Cl   25.3315  -17.2856
            12  C3b C    27.8243  -15.8862
            13  N3a N    31.3958  -20.7830
            14  N3a N    27.7578  -14.4845
BOND        14
            1     6   7 1
            2     1   2 2
            3     5   8 1
            4     2   3 1
            5     4   9 1
            6     3   4 2
            7     3  10 1
            8     4   5 1
            9     2  11 1
            10    5   6 2
            11    1  12 1
            12    6   1 1
            13    8  13 3
            14   12  14 3

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