[8-Acetamido-6,7-Dihydroxy-5-(Hydroxymethyl)-5,6,7,8-Tetrahydroimidazo[1,2-A]Pyridin-3-Yl]Acetic Acid
Properties
Property | Value |
---|---|
Formula | C12H17N3O6 |
IUPAC Name | 2-[(5r,6s,7s,8r)-8-acetamido-6,7-dihydroxy-5-(hydroxymethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-4-ium-8a-ylium-3-yl]acetic acid |
Molecular Mass | 299.280 g·mol−1 |
Heat of Formation | -1056.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.99 ± 1.08 D |
Volume | 330.08 Å 3 |
Surface Area | 288.85 Å 2 |
HOMO Energy | -9.67 ± 0.55 eV |
LUMO Energy | -0.18 ± eV |
Point Group Symmetry | C1 |
InChIKey | OBMORLCFLUTVPI-PXIYARARSA-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 |