1,4:3,6-Dianhydro-2-O-Hexopyranuronosyl-5-O-Nitro-D-Glucitol

Molecule SVG Image

Properties Simple | Detailed

Formula C12H23NO12+
IUPAC Name [(1r,2z)-1-formyl-1,2,4-trihydroxy-penta-2,4-dienoxy]-oxido-azanide; hexa-1,2-diene-1,1,3,6-tetrol; dihydrate
Molecular Mass 373.311 g·mol−1
Heat of Formation -1311.9 ± 16.7 kJ·mol−1
Dipole Moment 5.62 ± 1.08 D
Volume 413.83 Å 3
Surface Area 354.07 Å 2
HOMO Energy -8.34 ± 0.55 eV
LUMO Energy -1.12 ± eV
Point Group Symmetry C1
InChIKey MQHSDQNPAIOBOQ-RFRCIQAESA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N