Formula |
C4H6N2OS |
IUPAC Name |
5-(aminomethyl)isothiazol-3-one |
Molecular Mass |
130.168 g·mol−1 |
Heat of Formation |
-35.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.73 ± 1.08 D |
Volume |
145.22 Å 3 |
Surface Area |
151.96 Å 2 |
HOMO Energy |
-8.83 ± 0.55 eV |
LUMO Energy |
-1.44 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 5-(aminomethyl)- 3(2h)-isothiazolone
- 5-(aminomethyl)-1,2-thiazol-3-one
- 5-(aminomethyl)-3-isothiazolone
- 5-aminomethyl-3-isothiazolol
- thiomuscimol
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CAS Number(s) |
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InChIKey |
QVBUOPGWPXUAHT-UHFFFAOYSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
S
C
O
N
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