KEGG   COMPOUND: C14199
Entry
C14199                      Compound                               
Name
2,2',5,5'-Tetrachlorobiphenyl;
2,2',5,5'-TCB;
PCB 52
Formula
C12H6Cl4
Exact mass
289.9224
Mol weight
291.988
Structure
Other DBs
CAS: 35693-99-3
PubChem: 7847009
ChEBI: 34206
NIKKAJI: J147.956C
LinkDB
KCF data

ATOM        16
            1   C8x C    25.8055  -18.6479
            2   C8x C    31.8980  -15.2703
            3   C8y C    25.8297  -17.2548
            4   C8y C    31.9434  -16.6632
            5   C8y C    28.2183  -18.6898
            6   C8y C    29.4851  -15.2282
            7   C8x C    26.9998  -19.3654
            8   C8x C    30.7036  -14.5527
            9   C8x C    27.0482  -16.5793
            10  C8x C    30.6552  -17.3387
            11  C8y C    28.2425  -17.2968
            12  C8y C    29.4610  -16.6213
            13  X   Cl   29.4314  -19.4185
            14  X   Cl   24.6055  -16.5193
            15  X   Cl   28.2907  -14.5107
            16  X   Cl   33.1439  -17.3628
BOND        17
            1     1   3 2
            2     1   7 1
            3     2   4 2
            4     2   8 1
            5     3   9 1
            6     4  10 1
            7     5   7 2
            8     5  11 1
            9     6   8 2
            10    6  12 1
            11    9  11 2
            12   10  12 2
            13   11  12 1
            14    5  13 1
            15    3  14 1
            16    6  15 1
            17    4  16 1

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