(2S)-2-Amino-4-[(4-Cyanophenyl)Methylamino]-4-Oxo-Butanoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C12H13N3O3 |
| IUPAC Name | (2s)-2-amino-4-[(4-cyanophenyl)methylamino]-4-oxo-butanoic acid |
| Molecular Mass | 247.250 g·mol−1 |
| Heat of Formation | -354.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.31 ± 1.08 D |
| Volume | 296.29 Å 3 |
| Surface Area | 282.65 Å 2 |
| HOMO Energy | -10.02 ± 0.55 eV |
| LUMO Energy | -1.14 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZRGFVKOBJUGWGG-JTQLQIEISA-N |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |