Formula |
C22H21NO3S |
IUPAC Name |
3-[isopropyl-(4-methylbenzoyl)amino]-5-phenyl-thiophene-2-carboxylic acid |
Molecular Mass |
379.472 g·mol−1 |
Heat of Formation |
-321.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.11 ± 1.08 D |
Volume |
455.24 Å 3 |
Surface Area |
369.21 Å 2 |
HOMO Energy |
-8.80 ± 0.55 eV |
LUMO Energy |
-1.52 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 3-[(4-methylphenyl)carbonyl-propan-2-yl-amino]-5-phenyl-thiophene-2-carboxylic acid
- 3-[isopropyl(4-methylbenzoyl)amino]-5-phenylthiophene-2-carboxylic acid
- 3-[isopropyl-(4-methyl-benzoyl)-amino]-5-phenyl-thiophene-2-carboxylic acid
- 3-[isopropyl-(4-methylbenzoyl)amino]-5-phenyl-2-thenoic acid
- 3-[isopropyl-[(4-methylphenyl)-oxomethyl]amino]-5-phenyl-2-thiophenecarboxylic acid
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InChIKey |
LRHXIDOGMBZJFN-UHFFFAOYSA-N |
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Links |
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Elements |
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