Formula |
C17H15N3O6S |
IUPAC Name |
(6r,7s)-3-methyl-8-oxo-7-[[2-(2-oxo-1,3-benzoxazol-3-yl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid |
Molecular Mass |
389.383 g·mol−1 |
Heat of Formation |
-675.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.30 ± 1.08 D |
Volume |
419.9 Å 3 |
Surface Area |
361.98 Å 2 |
HOMO Energy |
-9.23 ± 0.55 eV |
LUMO Energy |
-0.81 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
RRJMJOCOTPUQTQ-SWLSCSKDSA-N |
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Elements |
H
S
C
O
N
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