COMPOUND: C14756
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Entry
C14756 Compound
Name
2,2',3,6,6'-Pentachloro-4-biphenylol
Formula
C12H5Cl5O
Exact mass
339.8783
Mol weight
342.4325
Structure
Mol file
KCF file
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Other DBs
PubChem:
17395754
NIKKAJI:
J1.871.457D
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KCF data
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ATOM 18
1 C8x C 21.5480 -20.3505
2 C8x C 21.5480 -21.7492
3 C8x C 22.7592 -22.4486
4 C8y C 23.9706 -21.7492
5 C8y C 23.9706 -20.3505
6 C8y C 22.7592 -19.6512
7 C8y C 25.2006 -19.6402
8 C8y C 26.4047 -20.3352
9 C8x C 27.6158 -19.6358
10 C8y C 27.6158 -18.2371
11 C8y C 26.4118 -17.5420
12 C8y C 25.2005 -18.2415
13 O1a O 28.8326 -17.5343
14 X Cl 23.9821 -17.5380
15 X Cl 26.4112 -16.1702
16 X Cl 26.4052 -21.7699
17 X Cl 25.1685 -22.4413
18 X Cl 22.7591 -18.2700
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 10 13 1
15 12 14 1
16 11 15 1
17 8 16 1
18 4 17 1
19 6 18 1
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