Formula |
C28H26N8O4 |
IUPAC Name |
4-[[5-[6-amino-8-(6-quinolylmethylamino)purin-9-yl]-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxymethyl]benzonitrile |
Molecular Mass |
538.557 g·mol−1 |
Heat of Formation |
3558.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
21.25 ± 1.08 D |
Volume |
567.82 Å 3 |
Surface Area |
488.57 Å 2 |
HOMO Energy |
-9.16 ± 0.55 eV |
LUMO Energy |
-3.35 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
DKJUQSPQYGQPBH-VBHAUSMQSA-N |
QR Code |
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Elements |
C
O
N
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