1-(2-Deoxy-β-D-Erythro-Pentofuranosyl)-4-Thioxo-3,4-Dihydro-2(1H)-Pyrimidinone
Properties
Property | Value |
---|---|
Formula | C9H12N2O4S |
IUPAC Name | 1-[(2s,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-thioxo-pyrimidin-2-one |
Molecular Mass | 244.268 g·mol−1 |
Heat of Formation | -609.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.19 ± 1.08 D |
Volume | 267.71 Å 3 |
Surface Area | 248.3 Å 2 |
HOMO Energy | -8.66 ± 0.55 eV |
LUMO Energy | -1.16 ± eV |
Point Group Symmetry | C1 |
InChIKey | PHNDUXLWAVSUAL-BBVRLYRLSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O N |