5-[2,4-Dihydroxy-6-(4-Nitrophenoxy)Phenyl]-N-(1-Methyl-4-Piperidinyl)-1,2-Oxazole-3-Carboxamide

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Properties Simple | Detailed

Formula C22H22N4O7
IUPAC Name 5-[2,4-dihydroxy-6-(4-nitrophenoxy)phenyl]-n-(1-methyl-4-piperidyl)isoxazole-3-carboxamide
Molecular Mass 454.433 g·mol−1
Heat of Formation -440.4 ± 16.7 kJ·mol−1
Dipole Moment 2.59 ± 1.08 D
Volume 506.65 Å 3
Surface Area 451.88 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy -1.67 ± eV
Point Group Symmetry C1
InChIKey YLQODGGPIHWTHR-UHFFFAOYSA-N
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