5-(2-Bromovinyl)-1-[(1R,3R,4R)-3-Hydroxy-4-(Hydroxymethyl)Cyclopentyl]-2,4(1H,3H)-Pyrimidinedione
Properties
Property | Value |
---|---|
Formula | C12H15BrN2O4 |
IUPAC Name | 5-[(e)-2-bromovinyl]-1-[(1r,3r,4r)-3-hydroxy-4-(hydroxymethyl)cyclopentyl]pyrimidine-2,4-dione |
Molecular Mass | 331.163 g·mol−1 |
Heat of Formation | -661.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.01 ± 1.08 D |
Volume | 324.69 Å 3 |
Surface Area | 289.79 Å 2 |
HOMO Energy | -9.27 ± 0.55 eV |
LUMO Energy | 1.84 ± eV |
Point Group Symmetry | C1 |
InChIKey | KAVDAMFOTJIBCK-NJJACTBESA-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 |