(2S)-3-Hydroxy-2-[[4-Methyl-2-[4-(Trifluoromethyl)Phenyl]Thiazole-5-Carbonyl]Amino]Propanoic Acid
Properties
Property | Value |
---|---|
Formula | C15H13F3N2O4S |
IUPAC Name | (2s)-3-hydroxy-2-[[4-methyl-2-[4-(trifluoromethyl)phenyl]thiazole-5-carbonyl]amino]propanoic acid |
Molecular Mass | 374.335 g·mol−1 |
Heat of Formation | -1189.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.56 ± 1.08 D |
Volume | 392.61 Å 3 |
Surface Area | 354.57 Å 2 |
HOMO Energy | -9.54 ± 0.55 eV |
LUMO Energy | -1.78 ± eV |
Point Group Symmetry | C1 |
InChIKey | YJGBVICLINVYSP-JTQLQIEISA-N |
QR Code | Generate QR Code |
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Elements | C F H O N S |