6-[4-Chloro-2-(2-Furylmethylamino)-5-Sulfamoyl-Benzoyl]Oxy-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylic Acid

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Formula C18H19ClN2O11S
IUPAC Name (2r,3s,4s,5s,6s)-6-[4-chloro-2-(2-furylmethylamino)-5-sulfamoyl-benzoyl]oxy-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
Molecular Mass 506.868 g·mol−1
Heat of Formation -1780.6 ± 16.7 kJ·mol−1
Dipole Moment 6.47 ± 1.08 D
Volume 515.52 Å 3
Surface Area 407.03 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy -1.15 ± eV
Point Group Symmetry C1
InChIKey RNVHHPUYELVHRE-IBTNMTNLSA-N
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Elements C Cl H O N S