Geometry & MOs

Info

ID:	27350
PubChem CID:	820867
Reduced:	NO3H21C22 (1)
Stoich.:	AB3C21D22 (1)
Weight, g/mol:	349.108086
ΔH_f, kcal/mol:	-74.03
Dipole, Da:	3.56
IP(EA), eV:	-9.07(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-O-ethyl 3-O-methyl (4R)-4-(3-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Drug info:

PubChemData

Smile

CC1(CC(=O)C(=CNC2=CC=CC=C2C(=O)C3=CC=CC=C3)C(=O)C1)C

DOS

IR

Vibrations