1-O-[3-(1H-Imidazol-4-Yl)Propanimidoyl]-α-D-Altropyranose
Properties
Property | Value |
---|---|
Formula | C12H19N3O6 |
IUPAC Name | [(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] 3-(1h-imidazol-5-yl)propanimidate |
Molecular Mass | 301.296 g·mol−1 |
Heat of Formation | -984.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.54 ± 1.08 D |
Volume | 345.64 Å 3 |
Surface Area | 281.34 Å 2 |
HOMO Energy | -9.64 ± 0.55 eV |
LUMO Energy | 0.19 ± eV |
Point Group Symmetry | C1 |
InChIKey | IVLWPPRPYFRCJU-MDRTYKRJSA-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 |