Sec-Butyl 3-(6-Amino-9H-Purin-9-Yl)-2-Hydroxypropanoate
Properties
Property | Value |
---|---|
Formula | C12H17N5O3 |
IUPAC Name | [(1r)-1-methylpropyl] (2s)-3-(6-aminopurin-9-ium-9-yl)-2-hydroxy-propanoate |
Molecular Mass | 279.295 g·mol−1 |
Heat of Formation | -360.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.26 ± 1.08 D |
Volume | 330.16 Å 3 |
Surface Area | 297.46 Å 2 |
HOMO Energy | -8.90 ± 0.55 eV |
LUMO Energy | -0.65 ± eV |
Point Group Symmetry | C1 |
InChIKey | NZGSPYJUPRILCT-SFYZADRCSA-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 |