(2R,3R,4R,5R,6R)-5-Acetamido-6-[(1R,2R)-3-Benzamido-1,2-Dihydroxy-Propyl]-3-Fluoro-2,4-Dihydroxy-Tetrahydropyran-2-Carboxylic Acid

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Properties Simple | Detailed

Formula C18H23FN2O9
IUPAC Name (2r,3r,4r,5r,6r)-5-acetamido-6-[(1r,2r)-3-benzamido-1,2-dihydroxy-propyl]-3-fluoro-2,4-dihydroxy-tetrahydropyran-2-carboxylic acid
Molecular Mass 430.382 g·mol−1
Heat of Formation -1780.8 ± 16.7 kJ·mol−1
Dipole Moment 7.43 ± 1.08 D
Volume 476.26 Å 3
Surface Area 407.67 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy -0.44 ± eV
Point Group Symmetry C1
InChIKey MROQLLHLBMWCPR-LQUZZVICSA-N
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