N-{[(2E)-2-(2-Nitrobenzylidene)Hydrazino]Carbonothioyl}-β-D-Glucopyranosylamine

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Formula C14H18N4O7S
IUPAC Name 1-[(e)-(2-nitrophenyl)methyleneamino]-3-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]thiourea
Molecular Mass 386.380 g·mol−1
Heat of Formation 1142.1 ± 16.7 kJ·mol−1
Dipole Moment 7.14 ± 1.08 D
Volume 397.3 Å 3
Surface Area 338.33 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy -2.79 ± eV
Point Group Symmetry C1
InChIKey HIBBBAGNJNCOKR-IVSPNHRTSA-N
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