Geometry & MOs

Info

ID:	147151
PubChem CID:	53786804
Reduced:	NOC10H12 (2)
Stoich.:	ABC10D12 (2)
Weight, g/mol:	535.137335
ΔH_f, kcal/mol:	-69.6
Dipole, Da:	4.66
IP(EA), eV:	-8.87(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 6-[2-(4-chlorophenyl)-2-oxoethyl]-2-methyl-4-[2-(trifluoromethyl)phenyl]-3,4-dihydropyridine-3,5-dicarboxylate

Drug info:

PubChemData

Smile

CCCC(C)C(=O)NC1=CC=CC(=C1)CC(=O)NC2=CC=CC=C2

DOS

IR

Vibrations