COMPOUND: C10917
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Entry
C10917 Compound
Name
7-N,N-Dimethylamino-1,2,3,4,5-pentathiocyclooctane;
PTCA
Formula
C5H11NS5
Exact mass
244.9495
Mol weight
245.4725
Structure
Mol file
KCF file
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Other DBs
PubChem:
13100
ChEBI:
2277
NIKKAJI:
J658.265F
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KCF data
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ATOM 11
1 S3x S 29.2800 -16.1621
2 S3x S 30.6767 -16.7066
3 S3x S 31.2939 -17.9347
4 S3x S 30.7541 -19.3209
5 S3x S 29.4386 -19.7790
6 C1x C 28.1295 -16.7816
7 C1y C 27.7447 -18.0113
8 C1x C 28.2838 -19.2401
9 N1c N 26.4641 -18.0831
10 C1a C 25.5132 -16.7808
11 C1a C 25.6675 -19.4003
BOND 11
1 1 6 1
2 1 2 1
3 6 7 1
4 7 8 1
5 3 4 1
6 5 8 1
7 7 9 1
8 4 5 1
9 9 10 1
10 2 3 1
11 9 11 1
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