Formula |
C7H12N2O4S |
IUPAC Name |
(2s)-2-acetamido-3-methyl-3-nitrososulfanyl-butanoic acid |
Molecular Mass |
220.246 g·mol−1 |
Heat of Formation |
-575.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.52 ± 1.08 D |
Volume |
253.82 Å 3 |
Surface Area |
227.36 Å 2 |
HOMO Energy |
-9.34 ± 0.55 eV |
LUMO Energy |
-0.89 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- (2s)-2-acetamido-3-methyl-3-(nitrosothio)butanoic acid
- (2s)-2-acetamido-3-methyl-3-(nitrosothio)butyric acid
- (2s)-2-acetamido-3-methyl-3-nitrososulfanyl-butanoic acid
- (2s)-2-acetamido-3-methyl-3-nitrososulfanylbutanoic acid
- tocris-0598
|
InChIKey |
ZIIQCSMRQKCOCT-YFKPBYRVSA-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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