KEGG   COMPOUND: C14362
Entry
C14362                      Compound                               
Name
2,3,4,5-Tetrachlorobiphenyl;
PCB 61
Formula
C12H6Cl4
Exact mass
289.9224
Mol weight
291.988
Structure
Other DBs
CAS: 33284-53-6
PubChem: 17395362
ChEBI: 34221
NIKKAJI: J150.410J
LinkDB
KCF data

ATOM        16
            1   C8x C    25.2171  -18.0142
            2   C8x C    25.2171  -19.4151
            3   C8x C    26.4303  -20.1155
            4   C8x C    27.6436  -19.4151
            5   C8y C    27.6436  -18.0142
            6   C8x C    26.4303  -17.3138
            7   C8y C    28.8754  -17.3027
            8   C8x C    30.0814  -17.9988
            9   C8y C    31.2945  -17.2983
            10  C8y C    31.2945  -15.8974
            11  C8y C    30.0885  -15.2013
            12  C8y C    28.8753  -15.9018
            13  X   Cl   27.6550  -15.1973
            14  X   Cl   32.5268  -18.0096
            15  X   Cl   30.0883  -13.8228
            16  X   Cl   32.4837  -15.2111
BOND        17
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     5   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11   10  11 1
            12   11  12 2
            13    7  12 1
            14   12  13 1
            15    9  14 1
            16   11  15 1
            17   10  16 1

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