N-[[(2S,3S,4R,5R)-5-(4-Amino-2-Oxo-Pyrimidin-3-Ium-1-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl]-3-(1H-Benzimidazol-3-Ium-7A-Id-2-Yl)Propanamide
Properties
| Property | Value |
|---|---|
| Formula | C19H23N6O5+ |
| IUPAC Name | n-[[(2s,3s,4r,5r)-5-(6-amino-2-oxo-1h-pyrimidin-3-ium-3-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl]-3-(1h-benzimidazol-2-yl)propanamide |
| Molecular Mass | 415.423 g·mol−1 |
| Heat of Formation | -623.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 9.07 ± 1.08 D |
| Volume | 460.71 Å 3 |
| Surface Area | 418.19 Å 2 |
| HOMO Energy | -9.06 ± 0.55 eV |
| LUMO Energy | -0.66 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BDVBQSYATPFDED-FCRVUTKVSA-O |
| QR Code | Generate QR Code |
| Links | |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |