Formula |
C6H5N3O2S |
IUPAC Name |
2-amino-4-methylsulfanyl-6-oxo-1,3-oxazine-5-carbonitrile |
Molecular Mass |
183.188 g·mol−1 |
Heat of Formation |
-103.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
9.32 ± 1.08 D |
Volume |
194.97 Å 3 |
Surface Area |
195.75 Å 2 |
HOMO Energy |
-9.27 ± 0.55 eV |
LUMO Energy |
1.63 ± eV |
Point Group Symmetry |
Cs
|
Synonyms
|
- 2-amino-4-(methylthio)-6-oxo-1,3-oxazine-5-carbonitrile
- 2-amino-6-keto-4-(methylthio)-1,3-oxazine-5-carbonitrile
|
InChIKey |
UOWFOHSDCUOIRV-UHFFFAOYSA-N |
QR Code |
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Links |
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Downloads |
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|
Elements |
H
C
S
O
N
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