COMPOUND: C14729
Help
Entry
C14729 Compound
Name
2',3,3',4',5-Pentachloro-4-biphenylol
Formula
C12H5Cl5O
Exact mass
339.8783
Mol weight
342.4325
Structure
Mol file
KCF file
DB search
Other DBs
CAS:
149589-55-9
PubChem:
17395728
PDB-CCD:
NE1
[
PDBj
]
NIKKAJI:
J550.196B
LinkDB
All DBs
KCF data
Show
ATOM 18
1 C8x C 22.1574 -20.3340
2 C8y C 22.1574 -21.7314
3 C8y C 23.3676 -22.4301
4 C8y C 24.5779 -21.7314
5 C8y C 24.5779 -20.3340
6 C8x C 23.3676 -19.6353
7 C8y C 25.8067 -19.6243
8 C8x C 27.0097 -20.3187
9 C8y C 28.2198 -19.6199
10 C8y C 28.2198 -18.2225
11 C8y C 27.0168 -17.5280
12 C8x C 25.8066 -18.2268
13 O1a O 29.4355 -17.5203
14 X Cl 27.0170 -16.1421
15 X Cl 29.4492 -20.3294
16 X Cl 25.8067 -22.4411
17 X Cl 23.3676 -23.8274
18 X Cl 20.9473 -22.4301
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 11 14 1
16 9 15 1
17 4 16 1
18 3 17 1
19 2 18 1
» Japanese version
DBGET
integrated database retrieval system