[(2R,3S,4R,5R)-5-(4-Amino-2-Oxo-Pyrimidin-3-Ium-1-Yl)-2-Azido-3,4-Bis(2-Methylpropanoyloxy)Tetrahydrofuran-2-Yl]Methyl 2-Methylpropanoate
Properties
Property | Value |
---|---|
Formula | C21H33N6O8+ |
IUPAC Name | [(2r,3s,4r,5r)-5-(4-amino-2-oxo-1h-pyrimidin-1-ium-1-yl)-2-[(imino-λ5-azanylidene)amino]-3,4-bis(2-methylpropanoyloxy)tetrahydrofuran-2-yl]methyl 2-methylpropanoate |
Molecular Mass | 497.522 g·mol−1 |
Heat of Formation | -1188.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.88 ± 1.08 D |
Volume | 584.15 Å 3 |
Surface Area | 452.03 Å 2 |
HOMO Energy | -9.39 ± 0.55 eV |
LUMO Energy | 2.73 ± eV |
Point Group Symmetry | C1 |
InChIKey | JSCGTQDHYQEDHZ-DXEZIKHYSA-O |
QR Code | Generate QR Code |
Links | |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |