(1R,2R,3S,4R,5S)-4-{2-Chloro-6-[(3-Iodobenzyl)Amino]-9H-Purin-9-Yl}Bicyclo[3.1.0]Hexane-2,3-Diol
Properties
Property | Value |
---|---|
Formula | C18H17ClIN5O2 |
IUPAC Name | (1r,2r,3s,4r,5s)-4-[2-chloro-6-[(3-iodophenyl)methylamino]purin-9-yl]bicyclo[3.1.0]hexane-2,3-diol |
Molecular Mass | 497.717 g·mol−1 |
Heat of Formation | 154.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.81 ± 1.08 D |
Volume | 457.37 Å 3 |
Surface Area | 403.67 Å 2 |
HOMO Energy | -8.95 ± 0.55 eV |
LUMO Energy | 2.35 ± eV |
Point Group Symmetry | C1 |
InChIKey | GSPXPSPDVBRJRV-JHOKLZQASA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C Cl I H O N |