2-Amino-9-{[(2S)-2-(Hydroxymethyl)Cyclohexyl]Methyl}-3,9-Dihydro-6H-Purin-6-One
Properties
Property | Value |
---|---|
Formula | C13H19N5O2 |
IUPAC Name | 2-amino-9-[[(1r,2r)-2-(hydroxymethyl)cyclohexyl]methyl]-3h-purin-6-one |
Molecular Mass | 277.322 g·mol−1 |
Heat of Formation | -159.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 10.58 ± 1.08 D |
Volume | 331.74 Å 3 |
Surface Area | 292.34 Å 2 |
HOMO Energy | -9.17 ± 0.55 eV |
LUMO Energy | -0.47 ± eV |
Point Group Symmetry | C1 |
InChIKey | NNUZPTLISFKQLP-IUCAKERBSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |