KEGG   COMPOUND: C14378
Entry
C14378                      Compound                               
Name
4-Hydroxy-2',3,3',4',6'-pentachlorobiphenyl;
2',3,3',4',6'-Pentachloro-4-biphenylol
Formula
C12H5Cl5O
Exact mass
339.8783
Mol weight
342.4325
Structure
Other DBs
PubChem: 17395378
NIKKAJI: J855.490K
LinkDB
KCF data

ATOM        18
            1   C8x C    25.8218  -17.2872
            2   C8y C    25.8218  -18.6862
            3   C8y C    27.0333  -19.3856
            4   C8y C    28.2449  -18.6862
            5   C8y C    28.2449  -17.2872
            6   C8y C    27.0333  -16.5879
            7   C8y C    29.4749  -16.5767
            8   C8x C    30.6793  -17.2720
            9   C8x C    31.8906  -16.5723
            10  C8y C    31.8906  -15.1734
            11  C8y C    30.6864  -14.4782
            12  C8x C    29.4748  -15.1778
            13  X   Cl   29.4801  -19.3997
            14  X   Cl   24.6143  -19.3834
            15  O1a O    33.1163  -14.4654
            16  X   Cl   27.0329  -20.8217
            17  X   Cl   30.6865  -13.1106
            18  X   Cl   27.0338  -15.2190
BOND        19
            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    4  13 1
            15    2  14 1
            16   10  15 1
            17    3  16 1
            18   11  17 1
            19    6  18 1

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