4-Amino-7-(β-D-Xylofuranosyl)-7H-Pyrrolo[2,3-D]Pyrimidine-5-Carboxamide
Properties
Property | Value |
---|---|
Formula | C12H15N5O5 |
IUPAC Name | 4-amino-7-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrrolo[2,3-d]pyrimidine-1,3-diium-4a-ide-5-carboxamide |
Molecular Mass | 309.278 g·mol−1 |
Heat of Formation | -706.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.89 ± 1.08 D |
Volume | 332.19 Å 3 |
Surface Area | 289.22 Å 2 |
HOMO Energy | -9.09 ± 0.55 eV |
LUMO Energy | -0.73 ± eV |
Point Group Symmetry | C1 |
InChIKey | OBZJZDHRXBKKTJ-JCLYBXOESA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |