KEGG   COMPOUND: C19535
Entry
C19535                      Compound                               
Name
Trichloroacetonitrile;
2,2,2-Trichloro-acetonitrile
Formula
C2Cl3N
Exact mass
142.9096
Mol weight
144.38
Structure
Other DBs
CAS: 545-06-2
PubChem: 124490207
ChEBI: 82541
LinkDB
KCF data

ATOM        6
            1   C1d C    14.8400  -16.7300
            2   C3b C    16.2400  -16.7300
            3   X   Cl   13.4400  -16.7300
            4   X   Cl   14.8400  -15.3300
            5   X   Cl   14.8400  -18.1300
            6   N3a N    17.6400  -16.7300
BOND        5
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1
            5     2   6 3

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