N-{[(2E)-2-(2-Nitrobenzylidene)Hydrazino]Carbonothioyl}-β-D-Glucopyranosylamine

Molecule SVG Image

Properties Simple | Detailed

Formula C14H18N4O7S
IUPAC Name 1-[(e)-(2-nitrophenyl)methyleneamino]-3-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]thiourea
Molecular Mass 386.380 g·mol−1
Heat of Formation 1229.8 ± 16.7 kJ·mol−1
Dipole Moment 4.78 ± 1.08 D
Volume 358.04 Å 3
Surface Area 330.21 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy -0.68 ± eV
Point Group Symmetry C1
InChIKey HIBBBAGNJNCOKR-ARDSGTFASA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C S O N