Formula |
C21H21N3O4S |
IUPAC Name |
vinyl 2-[(2-phenylacetyl)amino]-6-(vinylcarbamoyl)-5,7-dihydro-4h-thieno[2,3-c]pyridine-3-carboxylate |
Molecular Mass |
411.474 g·mol−1 |
Heat of Formation |
-387.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.45 ± 1.08 D |
Volume |
473.49 Å 3 |
Surface Area |
420.87 Å 2 |
HOMO Energy |
-8.82 ± 0.55 eV |
LUMO Energy |
2.04 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
WQVFFOUZABKGIL-UHFFFAOYSA-N |
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Elements |
H
C
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N
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