(2S,3As,6As)-1-[(2S)-2-{[(1R)-1-Carboxy-3-Phenylpropyl]Amino}Propanoyl]Octahydrocyclopenta[B]Pyrrole-2-Carboxylic Acid
Properties
| Property | Value |
|---|---|
| Formula | C21H28N2O5 |
| IUPAC Name | (2s,3as,6as)-1-[(2s)-2-[[(1r)-1-carboxy-3-phenyl-propyl]amino]propanoyl]-3,3a,4,5,6,6a-hexahydro-2h-cyclopenta[b]pyrrole-2-carboxylic acid |
| Molecular Mass | 388.457 g·mol−1 |
| Heat of Formation | -936.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.13 ± 1.08 D |
| Volume | 475.36 Å 3 |
| Surface Area | 385.21 Å 2 |
| HOMO Energy | -9.39 ± 0.55 eV |
| LUMO Energy | -0.19 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KEDYTOTWMPBSLG-JFMONLCZSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |