Methyl (2S,3S,4R,5R,6R)-6-[4-(2-Fluoroethylcarbamoyloxymethyl)-2-Nitro-Phenoxy]-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylate

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Formula C17H21FN2O11
IUPAC Name methyl (2s,3s,4r,5r,6r)-6-[4-(2-fluoroethylcarbamoyloxymethyl)-2-nitro-phenoxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylate
Molecular Mass 448.354 g·mol−1
Heat of Formation -1729.4 ± 16.7 kJ·mol−1
Dipole Moment 6.16 ± 1.08 D
Volume 468.56 Å 3
Surface Area 412.49 Å 2
HOMO Energy -10.21 ± 0.55 eV
LUMO Energy -1.43 ± eV
Point Group Symmetry C1
InChIKey XAFPXBLFHNCHBG-AQRJEWBLSA-N
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Elements H C N O F