N-(1,3-Bis{[4,5,6-Trihydroxy-2-(Hydroxymethyl)Tetrahydro-2H-Pyran-3-Yl]Oxy}-2-Propanyl)-4-[3-(Trifluoromethyl)-3H-Diaziren-3-Yl]Benzamide

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Properties Simple | Detailed

Formula C24H32F3N3O13
IUPAC Name 4-[3-(trifluoromethyl)diazirin-3-yl]-n-[2-[4,5,6-trihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxy-1-[[4,5,6-trihydroxy-2-(hydroxymethyl)tetrahydropyran-3-yl]oxymethyl]ethyl]benzamide
Molecular Mass 627.518 g·mol−1
Heat of Formation -690.8 ± 16.7 kJ·mol−1
Dipole Moment 6.25 ± 1.08 D
Volume 532.63 Å 3
Surface Area 435.23 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy -2.84 ± eV
Point Group Symmetry C1
InChIKey NPJHSWNPVIJJGQ-ZGYADCBPSA-N
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