1,1'-[(2,3-Dihydroxy-1,4-Dioxo-1,4-Butanediyl)Bis(Oxy)]Bis(2,5-Dioxo-3-Pyrrolidinesulfonic Acid)

Molecule SVG Image

Properties Simple | Detailed

Formula C12H12N2O16S2
IUPAC Name (3s)-1-[(2s,3s)-4-[(3s)-2,5-dioxo-3-sulfo-pyrrolidin-1-yl]oxy-2,3-dihydroxy-4-oxo-butanoyl]oxy-2,5-dioxo-pyrrolidine-3-sulfonic acid
Molecular Mass 504.357 g·mol−1
Heat of Formation -2443.0 ± 16.7 kJ·mol−1
Dipole Moment 5.00 ± 1.08 D
Volume 468.68 Å 3
Surface Area 353.57 Å 2
HOMO Energy -10.57 ± 0.55 eV
LUMO Energy -1.17 ± eV
Point Group Symmetry C1
InChIKey WQQBUTMELIQJNY-JSKVFSMCSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N