(2R,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-6-(4-Azido-2-Nitro-Anilino)-4,5-Dihydroxy-2-(Hydroxymethyl)Tetrahydropyran-3-Yl]Oxy-6-(Hydroxymethyl)Tetrahydropyran-3,4,5-Triol

Molecule SVG Image

Properties Simple | Detailed

Formula C18H26N5O12
IUPAC Name (2r,3r,4s,5s,6r)-2-[(2r,3s,4r,5r,6r)-6-(4-azido-2-nitro-anilino)-4,5-dihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
Molecular Mass 504.425 g·mol−1
Heat of Formation -1462.7 ± 16.7 kJ·mol−1
Dipole Moment 5.21 ± 1.08 D
Volume 540.74 Å 3
Surface Area 445.56 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy -1.58 ± eV
Point Group Symmetry C1
InChIKey RFFFGJRQCISMEH-YMJSIHPXSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N