4-Amino-6-Bromo-7-(β-L-Xylofuranosyl)-7H-Pyrrolo[2,3-D]Pyrimidine-5-Carboxamide
Properties
Property | Value |
---|---|
Formula | C12H15BrN5O5 |
IUPAC Name | 4-amino-6-bromo-7-[(2s,3s,4s,5s)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrrolo[2,3-d]pyrimidine-1,3-diium-4a-ide-5-carboxamide |
Molecular Mass | 389.182 g·mol−1 |
Heat of Formation | -682.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.48 ± 1.08 D |
Volume | 359.89 Å 3 |
Surface Area | 305.93 Å 2 |
HOMO Energy | -9.05 ± 0.55 eV |
LUMO Energy | -0.86 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | DMXIHKQKBYZIHM-YJMZUNRSSA-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 |