5-Amino-3-Pentofuranosyl-2,3-Dihydro-7H-[1,2,3]Triazolo[4,5-D]Pyrimidin-7-One
Properties
Property | Value |
---|---|
Formula | C9H12N6O5 |
IUPAC Name | 5-amino-3-[(2s,3r,4r,5s)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]triazolo[4,5-d]pyrimidine-2,3,4,6-tetraium-7-one |
Molecular Mass | 284.229 g·mol−1 |
Heat of Formation | 601.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 13.89 ± 1.08 D |
Volume | 257.73 Å 3 |
Surface Area | 246.54 Å 2 |
HOMO Energy | -9.55 ± 0.55 eV |
LUMO Energy | -1.39 ± eV |
Point Group Symmetry | C1 |
InChIKey | PFIXFNFIQKRYHC-BAFHMCBBSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | C O N |