Formula |
C21H27N5O9S2 |
IUPAC Name |
[(1s)-1-isopropoxycarbonyloxyethyl] (6r,7s)-7-[[(2e)-2-(2-aminothiazol-4-yl)-2-methoxyimino-acetyl]amino]-3-(methoxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate |
Molecular Mass |
557.597 g·mol−1 |
Heat of Formation |
-1050.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
8.51 ± 1.08 D |
Volume |
635.08 Å 3 |
Surface Area |
512.25 Å 2 |
HOMO Energy |
-8.92 ± 0.55 eV |
LUMO Energy |
-1.08 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
LTINZAODLRIQIX-ZFKKBBJLSA-N |
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Elements |
H
S
C
O
N
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