(2R,3S,4S,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-2-(Hydroxymethyl)-4-(4-Nitrophenyl)Tetrahydrofuran-3-Ol
Properties
Property | Value |
---|---|
Formula | C16H16N6O5 |
IUPAC Name | (2r,3s,4s,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-2-(hydroxymethyl)-4-(4-nitrophenyl)tetrahydrofuran-3-ol |
Molecular Mass | 372.335 g·mol−1 |
Heat of Formation | -204.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.92 ± 1.08 D |
Volume | 405.05 Å 3 |
Surface Area | 319.68 Å 2 |
HOMO Energy | -9.15 ± 0.55 eV |
LUMO Energy | 1.56 ± eV |
Point Group Symmetry | C1 |
InChIKey | DPHAGCRDWKTGDW-DDFXLWFNSA-O |
QR Code | Generate QR Code |
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Elements | H C O N |