5-Isopropyl 3-Methyl (4R)-2-Cyano-6-Methyl-4-(3-Nitrophenyl)-1,4-Dihydro-3,5-Pyridinedicarboxylate

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Properties Simple | Detailed

Formula C19H19N3O6
IUPAC Name o5-isopropyl o3-methyl (4r)-2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Molecular Mass 385.371 g·mol−1
Heat of Formation -491.9 ± 16.7 kJ·mol−1
Dipole Moment 5.54 ± 1.08 D
Volume 445.85 Å 3
Surface Area 360.18 Å 2
HOMO Energy -9.39 ± 0.55 eV
LUMO Energy 1.45 ± eV
Point Group Symmetry C1
Synonyms
  • (4r)-2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid o5-isopropyl o3-methyl ester
  • o3-methyl o5-propan-2-yl (4r)-2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
  • o5-isopropyl o3-methyl (4r)-2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
InChIKey FAIIFDPAEUKBEP-MRXNPFEDSA-N
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