O5-[(E)-3-[4-(4H-Imidazol-1-Ium-4-Id-3-Ylmethyl)Phenyl]Allyl] O3-Methyl (4R)-2,6-Dimethyl-4-(3-Nitrophenyl)-1,4-Dihydropyridine-3,5-Dicarboxylate

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Formula C29H29N4O6
IUPAC Name o5-[(e)-3-[4-(4h-imidazol-1-ium-4-id-3-ylmethyl)phenyl]allyl] o3-methyl (4r)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Molecular Mass 529.564 g·mol−1
Heat of Formation -361.6 ± 16.7 kJ·mol−1
Dipole Moment 6.73 ± 1.08 D
Volume 622.88 Å 3
Surface Area 442.02 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy 2.19 ± eV
Point Group Symmetry C1
InChIKey VABNHNGHICRPEJ-IQKOXAACSA-N
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