2-Amino-7-[(3R,5R)-5-(Hydroxymethyl)Tetrahydrofuran-3-Yl]-1,6-Dihydropyrrolo[2,3-D]Pyrimidine-3,7-Diium-6-Ylium-4-One
Properties
Property | Value |
---|---|
Formula | C11H15N4O3+ |
IUPAC Name | 2-amino-7-[(3r,5r)-5-(hydroxymethyl)tetrahydrofuran-3-yl]-1,6-dihydropyrrolo[2,3-d]pyrimidine-3,7-diium-6-ylium-4-one |
Molecular Mass | 251.262 g·mol−1 |
Heat of Formation | -281.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.88 ± 1.08 D |
Volume | 283.13 Å 3 |
Surface Area | 263.38 Å 2 |
HOMO Energy | -9.00 ± 0.55 eV |
LUMO Energy | -0.09 ± eV |
Point Group Symmetry | C1 |
InChIKey | AEWXBOLDJVWRFP-RNFRBKRXSA-P |
QR Code | Generate QR Code |
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Elements | H C O N |