3-(2-Chloro-2-Deoxypentofuranosyl)-3,4,7,8-Tetrahydroimidazo[4,5-D][1,3]Diazepin-8-Ol
Properties
Property | Value |
---|---|
Formula | C11H15ClN4O4 |
IUPAC Name | (8r)-3-[(2s,3s,4r,5r)-3-chloro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-7,8-dihydro-4h-imidazo[4,5-d][1,3]diazepin-8-ol |
Molecular Mass | 302.714 g·mol−1 |
Heat of Formation | -543.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.66 ± 1.08 D |
Volume | 322.06 Å 3 |
Surface Area | 281.32 Å 2 |
HOMO Energy | -8.87 ± 0.55 eV |
LUMO Energy | -0.41 ± eV |
Point Group Symmetry | C1 |
InChIKey | JYWSHPMZFVPRRF-RZBPYSQRSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N O Cl |