1,4:3,6-Dianhydro-2-O-Hexopyranuronosyl-5-O-Nitro-D-Glucitol
Properties
Property | Value |
---|---|
Formula | C12H17NO12 |
IUPAC Name | (2r,3r,4r,5r,6s)-6-[[(3s,3ar,6r,6as)-6-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid |
Molecular Mass | 367.263 g·mol−1 |
Heat of Formation | -1630.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.45 ± 1.08 D |
Volume | 375.48 Å 3 |
Surface Area | 324.56 Å 2 |
HOMO Energy | -10.55 ± 0.55 eV |
LUMO Energy | -1.11 ± eV |
Point Group Symmetry | C1 |
InChIKey | MQHSDQNPAIOBOQ-BZIARYSWSA-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 |