COMPOUND: C14199
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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
Mol file
KCF file
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Other DBs
CAS:
35693-99-3
PubChem:
7847009
ChEBI:
34206
NIKKAJI:
J147.956C
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KCF data
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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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