6-Amino-9-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]-1-[(Z)-Prop-1-Enyl]Purine-3,7-Diium-6-Id-2-One
Properties
Property | Value |
---|---|
Formula | C13H19N5O5 |
IUPAC Name | 6-amino-9-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1-[(z)-prop-1-enyl]purine-3,7-diium-6-id-2-one |
Molecular Mass | 325.320 g·mol−1 |
Heat of Formation | -624.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.34 ± 1.08 D |
Volume | 353.39 Å 3 |
Surface Area | 307.02 Å 2 |
HOMO Energy | -8.93 ± 0.55 eV |
LUMO Energy | 2.23 ± eV |
Point Group Symmetry | C1 |
InChIKey | CNBNGSVHFYYIGU-UEMXZQTKSA-P |
QR Code | Generate QR Code |
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Elements | H C O N |