5-Bromo-7-Pentofuranosyl-7H-Pyrrolo[2,3-D]Pyrimidin-4-Amine
Properties
Property | Value |
---|---|
Formula | C11H13BrN4O4 |
IUPAC Name | (2s,3s,4s,5s)-2-(4-amino-5-bromo-pyrrolo[2,3-d]pyrimidin-7-ium-7-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol |
Molecular Mass | 345.149 g·mol−1 |
Heat of Formation | -515.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.64 ± 1.08 D |
Volume | 318.37 Å 3 |
Surface Area | 276.42 Å 2 |
HOMO Energy | -8.97 ± 0.55 eV |
LUMO Energy | 2.26 ± eV |
Point Group Symmetry | C1 |
InChIKey | ZWTPRQXZXQEKFT-YRCUVVFSSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O Br N |