Formula |
C12H14N4O5S |
IUPAC Name |
(2s)-3-(1h-imidazol-5-yl)-2-[[(2r,6r)-6-methyl-5-oxo-3-thioxo-morpholine-2-carbonyl]amino]propanoic acid |
Molecular Mass |
326.328 g·mol−1 |
Heat of Formation |
-685.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.70 ± 1.08 D |
Volume |
360.33 Å 3 |
Surface Area |
299.82 Å 2 |
HOMO Energy |
-9.08 ± 0.55 eV |
LUMO Energy |
-1.38 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
MFRQILPBKHSQCZ-MHSYXAOVSA-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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