5-[(E)-2-Bromovinyl]-1-(α-D-Ribofuranosyl)-2,4(1H,3H)-Pyrimidinedione
Properties
Property | Value |
---|---|
Formula | C11H15BrN2O6++ |
IUPAC Name | 5-[(e)-2-bromovinyl]-1-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1h-pyrimidine-1,3-diium-2,4-dione |
Molecular Mass | 351.151 g·mol−1 |
Heat of Formation | -974.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.89 ± 1.08 D |
Volume | 322.76 Å 3 |
Surface Area | 281.82 Å 2 |
HOMO Energy | -9.20 ± 0.55 eV |
LUMO Energy | 2.04 ± eV |
Point Group Symmetry | C1 |
InChIKey | GCQYYIHYQMVWLT-YPLKXGEDSA-P |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O Br N |