2-Amino-9-[(2R,4R,5S)-4-Hydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]-8-(Pyren-2-Ylamino)-3H-Purine-1,7-Diium-4-Id-6-One
Properties
Property | Value |
---|---|
Formula | C26H24N6O4+ |
IUPAC Name | 2-amino-9-[(2r,4r,5s)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-8-(pyren-2-ylamino)-3h-purine-1,7-diium-4-id-6-one |
Molecular Mass | 484.507 g·mol−1 |
Heat of Formation | -136.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 13.56 ± 1.08 D |
Volume | 526.53 Å 3 |
Surface Area | 448.69 Å 2 |
HOMO Energy | -8.20 ± 0.55 eV |
LUMO Energy | 1.90 ± eV |
Point Group Symmetry | C1 |
InChIKey | BXIZSSXYDWHWEC-CEXWTWQISA-P |
QR Code | Generate QR Code |
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Elements | H C O N |