O5-[(1R,3R)-1-Benzyl-3-Piperidyl] O3-Methyl (4R)-2,6-Dimethyl-4-(3-Nitrophenyl)-1,4-Dihydropyridine-3,5-Dicarboxylate

Molecule SVG Image

Properties Simple | Detailed

Formula C28H31N3O6
IUPAC Name o5-[(1r,3r)-1-benzyl-3-piperidyl] o3-methyl (4r)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Molecular Mass 505.562 g·mol−1
Heat of Formation -556.4 ± 16.7 kJ·mol−1
Dipole Moment 4.47 ± 1.08 D
Volume 606.53 Å 3
Surface Area 446.38 Å 2
HOMO Energy -8.87 ± 0.55 eV
LUMO Energy 2.13 ± eV
Point Group Symmetry C1
InChIKey GSFKIAPMQPURNT-ZEQKJWHPSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N