N-[4-(1,3-Diamino-5,6,6A,7,8,9-Hexahydropyrimido[5,4-E]Indolizin-8-Yl)Benzoyl]Glutamic Acid
Properties
| Property | Value |
|---|---|
| Formula | C22H26N6O5 |
| IUPAC Name | (2s)-2-[[4-[(6ar,8s)-1,3-diamino-5,6,6a,7,8,9-hexahydropyrimido[5,4-e]indolizin-8-yl]benzoyl]amino]pentanedioic acid |
| Molecular Mass | 454.479 g·mol−1 |
| Heat of Formation | -757.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.56 ± 1.08 D |
| Volume | 523.38 Å 3 |
| Surface Area | 451.79 Å 2 |
| HOMO Energy | -8.30 ± 0.55 eV |
| LUMO Energy | -0.54 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | LCGIJUUGFUFBDH-FMKPAKJESA-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 |