COMPOUND: C13753
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Entry
C13753 Compound
Name
6-Chloro-3,5-diaminopyrazine-3-carboxamide;
CDPC
Formula
C8H12ClN7O
Exact mass
257.0792
Mol weight
257.6802
Structure
Mol file
KCF file
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Other DBs
CAS:
1144-27-0
PubChem:
586342
ChEBI:
34467
NIKKAJI:
J2.786.241A
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KCF data
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ATOM 17
1 C1a C 32.9010 -20.2077
2 C8y C 26.8400 -19.5188
3 C5a C 28.0574 -20.2119
4 C8y C 26.8400 -18.1154
5 N5x N 25.6343 -20.2119
6 N1b N 29.2628 -19.5130
7 O5a O 28.0574 -21.6095
8 N5x N 25.6343 -17.4105
9 N1a N 28.0574 -17.4105
10 C8y C 24.4173 -19.5188
11 C2c C 30.4798 -20.2119
12 C8y C 24.4173 -18.1154
13 X Cl 23.2001 -20.2119
14 N1c N 31.6914 -19.5130
15 N2a N 30.4798 -21.6095
16 N1a N 23.2001 -17.4105
17 C1a C 31.6901 -18.1144
BOND 17
1 2 3 1
2 2 4 1
3 2 5 2
4 3 6 1
5 3 7 2
6 4 8 2
7 4 9 1
8 5 10 1
9 6 11 1
10 8 12 1
11 10 13 1
12 11 14 1
13 11 15 2
14 12 16 1
15 10 12 2
16 14 1 1
17 14 17 1
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