N-[(4-Nitrobenzoyl)Carbamoyl]Hexopyranosylamine

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Properties Simple | Detailed

Formula C14H17N3O9
IUPAC Name 4-nitro-n-[[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]carbamoyl]benzamide
Molecular Mass 371.299 g·mol−1
Heat of Formation -1190.3 ± 16.7 kJ·mol−1
Dipole Moment 3.25 ± 1.08 D
Volume 395.58 Å 3
Surface Area 360.64 Å 2
HOMO Energy -10.54 ± 0.55 eV
LUMO Energy 1.02 ± eV
Point Group Symmetry C1
InChIKey TXVZHPDFTXBTMX-BZNQNGANSA-N
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