Formula |
C28H25NO4S |
IUPAC Name |
(2s)-2-[3-cyclopropyl-2-hydroxysulfanyl-4-(1-naphthylmethyl)-6-oxo-1-pyridyl]-3-phenyl-propanoic acid |
Molecular Mass |
471.567 g·mol−1 |
Heat of Formation |
-289.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.91 ± 1.08 D |
Volume |
549.89 Å 3 |
Surface Area |
388.09 Å 2 |
HOMO Energy |
-8.77 ± 0.55 eV |
LUMO Energy |
1.88 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
RDAFPBNHIKAVPQ-DEOSSOPVSA-N |
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Elements |
H
S
C
O
N
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