Formula |
C20H12N2O3S |
IUPAC Name |
4-hydroxy-3-[4-(2-hydroxyphenyl)phenyl]-6-oxo-7h-thieno[2,3-b]pyridine-5-carbonitrile |
Molecular Mass |
360.386 g·mol−1 |
Heat of Formation |
-59.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.03 ± 1.08 D |
Volume |
401.39 Å 3 |
Surface Area |
352.68 Å 2 |
HOMO Energy |
-9.29 ± 0.55 eV |
LUMO Energy |
-1.29 ± eV |
Point Group Symmetry |
Cs
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Synonyms
|
- 6-hydroxy-3-[4-(2-hydroxyphenyl)phenyl]-4-keto-7h-thieno[3,2-e]pyridine-5-carbonitrile
|
InChIKey |
CTESJDQKVOEUOY-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
S
C
O
N
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