(2S)-3-(2-Methyl-5-Nitro-1H-Imidazol-1-Yl)-1,2-Propanediol
Properties
Property | Value |
---|---|
Formula | C7H11N3O4 |
IUPAC Name | (2s)-3-(2-methyl-5-nitro-imidazol-3-ium-5-id-1-yl)propane-1,2-diol |
Molecular Mass | 201.180 g·mol−1 |
Heat of Formation | -305.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.51 ± 1.08 D |
Volume | 225.83 Å 3 |
Surface Area | 212.01 Å 2 |
HOMO Energy | -10.08 ± 0.55 eV |
LUMO Energy | 1.89 ± eV |
Point Group Symmetry | C1 |
InChIKey | QQNYOVQUGLPEFB-LURJTMIESA-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 |