3,6-Diamino-N-[(6Z)-3-(2-Amino-6-Hydroxy-1,4,5,6-Tetrahydropyrimidin-4-Yl)-6-[(Carbamoylamino)Methylene]-9,12-Bis(Hydroxymethyl)-2,5,8,11,14-Pentaoxo-1,4,7,10,13-Pentaazacyclohexadecan-15-Yl]Hexanamide
Properties
| Property | Value |
|---|---|
| Formula | C25H43N13O10 |
| IUPAC Name | (3s)-3,6-diamino-n-[(3s,6z,9s,12s,15s)-3-[(4r,6r)-2-amino-4-hydroxy-1,4,5,6-tetrahydropyrimidin-6-yl]-9,12-bis(hydroxymethyl)-2,5,8,11,14-pentaoxo-6-(ureidomethylene)-1,4,7,10,13-pentazacyclohexadec-15-yl]hexanamide |
| Molecular Mass | 685.690 g·mol−1 |
| Heat of Formation | 1668.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.66 ± 1.08 D |
| Volume | 687.87 Å 3 |
| Surface Area | 507.72 Å 2 |
| HOMO Energy | -9.63 ± 0.55 eV |
| LUMO Energy | -3.08 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | GXFAIFRPOKBQRV-KHIYRQCMSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |