[(2R,3R,4R,5R)-2,3,4,5-Tetrahydroxy-6-(2-Isocyano-3-Methyl-But-2-Enoyl)Oxy-Hexyl] 2-Isocyano-3-Methyl-But-2-Enoate

Molecule SVG Image

Properties Simple | Detailed

Formula C18H26N2O8
IUPAC Name [(2r,3r,4r,5r)-2,3,4,5-tetrahydroxy-6-(2-isocyano-3-methyl-but-2-enoyl)oxy-hexyl] 2-isocyano-3-methyl-but-2-enoate
Molecular Mass 398.408 g·mol−1
Heat of Formation -1125.0 ± 16.7 kJ·mol−1
Dipole Moment 8.14 ± 1.08 D
Volume 481.27 Å 3
Surface Area 392.96 Å 2
HOMO Energy -9.85 ± 0.55 eV
LUMO Energy -0.61 ± eV
Point Group Symmetry C1
InChIKey WNSYTPOHXWATOJ-CZPYZCIJSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N