Formula |
C23H29NO3S |
IUPAC Name |
propyl 6-ethyl-5-ethylsulfanylcarbonyl-2-phenyl-4-propyl-pyridine-3-carboxylate |
Molecular Mass |
399.546 g·mol−1 |
Heat of Formation |
-486.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.16 ± 1.08 D |
Volume |
508.33 Å 3 |
Surface Area |
423.86 Å 2 |
HOMO Energy |
-9.23 ± 0.55 eV |
LUMO Energy |
-0.73 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 3-propyl-6-ethyl-5-[(ethylthio)carbonyl]-2 phenyl-4-propyl-3-pyridine carboxylate
- 6-ethyl-5-(ethylthio)carbonyl-2-phenyl-4-propyl-nicotinic acid propyl ester
- 6-ethyl-5-[(ethylthio)-oxomethyl]-2-phenyl-4-propyl-3-pyridinecarboxylic acid propyl ester
- mrs 1523
- mrs1523
- propyl 6-ethyl-5-ethylsulfanylcarbonyl-2-phenyl-4-propylpyridine-3-carboxylate
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InChIKey |
UUSHFEVEROROSP-UHFFFAOYSA-N |
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Links |
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Elements |
H
S
C
O
N
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