N-[2-(2-Chlorophenyl)-5-Isopropyl-4-Methyl-1H-Imidazol-1-Yl]-5-Methyl-2,3-Dihydro-1,4-Benzodioxine-6-Carboxamide

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Properties Simple | Detailed

Formula C23H24ClN3O3
IUPAC Name n-[2-(2-chlorophenyl)-5-isopropyl-4-methyl-imidazol-1-ium-2-ylium-1-yl]-5-methyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Molecular Mass 425.908 g·mol−1
Heat of Formation -203.7 ± 16.7 kJ·mol−1
Dipole Moment 8.71 ± 1.08 D
Volume 496.69 Å 3
Surface Area 400.21 Å 2
HOMO Energy -8.61 ± 0.55 eV
LUMO Energy 2.58 ± eV
Point Group Symmetry C1
InChIKey XLNQTHXOKGRTAL-UHFFFAOYSA-N
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Elements H C N O Cl