Formula |
C16H17N3O5S |
IUPAC Name |
(6s,7r)-7-[[(2r)-2-amino-2-(4-hydroxyphenyl)acetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid |
Molecular Mass |
363.388 g·mol−1 |
Heat of Formation |
-602.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.27 ± 1.08 D |
Volume |
404.27 Å 3 |
Surface Area |
357.7 Å 2 |
HOMO Energy |
-9.12 ± 0.55 eV |
LUMO Energy |
-0.68 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
BOEGTKLJZSQCCD-HFAKWTLXSA-N |
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Links |
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Elements |
H
S
C
O
N
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