[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,7r,8s)-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 | -1041.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.86 ± 1.08 D |
Volume | 332.92 Å 3 |
Surface Area | 288.23 Å 2 |
HOMO Energy | -9.51 ± 0.55 eV |
LUMO Energy | 0.02 ± eV |
Point Group Symmetry | C1 |
InChIKey | OBMORLCFLUTVPI-CZULRBLNSA-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 |