3-[2-[2-Cyclopentyl-6-(4-Dimethylphosphorylanilino)Purine-1,3,7-Triium-9-Yl]Ethyl]Phenol
Properties
Property | Value |
---|---|
Formula | C26H32N5O2P |
IUPAC Name | 3-[2-[2-cyclopentyl-6-(4-dimethylphosphorylanilino)purine-1,3,7-triium-9-yl]ethyl]phenol |
Molecular Mass | 477.538 g·mol−1 |
Heat of Formation | -110.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.38 ± 1.08 D |
Volume | 572.43 Å 3 |
Surface Area | 486.79 Å 2 |
HOMO Energy | -8.60 ± 0.55 eV |
LUMO Energy | 2.29 ± eV |
Point Group Symmetry | C1 |
InChIKey | UPEMSHYVHYTQBB-UHFFFAOYSA-O |
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Elements | P C H O N |