(1R,2S,3R)-1-[(2E)-2-(1,2-Oxazol-3(2H)-Ylidene)-2H-Imidazol-4-Yl]-1,2,3,4-Butanetetrol
Properties
Property | Value |
---|---|
Formula | C10H13N3O5 |
IUPAC Name | (1r,2s,3r)-1-[(2z)-2-isoxazol-3-ylideneimidazol-4-yl]butane-1,2,3,4-tetrol |
Molecular Mass | 255.227 g·mol−1 |
Heat of Formation | -440.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.89 ± 1.08 D |
Volume | 283.51 Å 3 |
Surface Area | 250.75 Å 2 |
HOMO Energy | -8.81 ± 0.55 eV |
LUMO Energy | 1.28 ± eV |
Point Group Symmetry | C1 |
InChIKey | BSEXVGFOHBFEAQ-GSYVTDRKSA-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 |