Formula |
C18H20N8O6S3 |
IUPAC Name |
(6r,7s)-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-7-[[(2s)-2-(2-thienyl)-2-ureido-acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid |
Molecular Mass |
540.596 g·mol−1 |
Heat of Formation |
-362.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
9.33 ± 1.08 D |
Volume |
583.29 Å 3 |
Surface Area |
474.04 Å 2 |
HOMO Energy |
-9.10 ± 0.55 eV |
LUMO Energy |
-1.00 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
HPNPXNUAIRGSKT-TZOQJCELSA-N |
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Elements |
H
S
C
O
N
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