(E)-3-(4-(1H-Imidazol-1-Ylmethyl)Phenyl)-2-Propenyl Methyl 1,4-Dihydro-2,6-Dimethyl-4-(3-Nitrophenyl)-3,5-Pyridinedicarboxylate

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Properties Simple | Detailed

Formula C29H28N4O6
IUPAC Name o5-[(e)-3-[4-(imidazol-1-ylmethyl)phenyl]allyl] o3-methyl (4s)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Molecular Mass 528.556 g·mol−1
Heat of Formation 3643.6 ± 16.7 kJ·mol−1
Dipole Moment 9.71 ± 1.08 D
Volume 591.61 Å 3
Surface Area 520.05 Å 2
HOMO Energy -8.45 ± 0.55 eV
LUMO Energy -3.31 ± eV
Point Group Symmetry C1
InChIKey CSBQPRGTYHAYKS-BLRKDVCKSA-N
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