Formula |
C10H13NO4S2 |
IUPAC Name |
(5r,6s)-3-ethylsulfanyl-6-[(1r)-1-hydroxyethyl]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid |
Molecular Mass |
275.345 g·mol−1 |
Heat of Formation |
-547.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.48 ± 1.08 D |
Volume |
305.79 Å 3 |
Surface Area |
267.98 Å 2 |
HOMO Energy |
-8.74 ± 0.55 eV |
LUMO Energy |
-0.90 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
LDVDKTLZRGWFID-GLDDHUGJSA-N |
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Elements |
H
S
C
O
N
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