Formula |
C25H29NO4S |
IUPAC Name |
(2s)-2-ethoxy-3-[4-[2-[2-methyl-5-(4-methylsulfanylphenyl)pyrrol-1-yl]ethoxy]phenyl]propanoic acid |
Molecular Mass |
439.567 g·mol−1 |
Heat of Formation |
-524.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.20 ± 1.08 D |
Volume |
541.9 Å 3 |
Surface Area |
405.46 Å 2 |
HOMO Energy |
-8.26 ± 0.55 eV |
LUMO Energy |
-0.65 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
MRWFZSLZNUJVQW-DEOSSOPVSA-N |
QR Code |
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Links |
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Elements |
H
S
C
O
N
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