(2S)-2-Amino-3-[4-Hydroxy-3-(4H-Pyrazol-1-Ium-4-Id-1-Yl)Phenyl]Propanoic Acid
Properties
Property | Value |
---|---|
Formula | C12H13N3O3 |
IUPAC Name | (2s)-2-amino-3-[4-hydroxy-3-(4h-pyrazol-1-ium-4-id-1-yl)phenyl]propanoic acid |
Molecular Mass | 247.250 g·mol−1 |
Heat of Formation | -251.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.24 ± 1.08 D |
Volume | 287.0 Å 3 |
Surface Area | 265.72 Å 2 |
HOMO Energy | -8.85 ± 0.55 eV |
LUMO Energy | -0.90 ± eV |
Point Group Symmetry | C1 |
InChIKey | OYFZMNFXVOYLDW-VIFPVBQESA-N |
QR Code | Generate QR Code |
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Elements | H C O N |