Geometry & MOs

Info

ID:	31482
PubChem CID:	855774
Reduced:	O2N3C20H21 (1)
Stoich.:	A2B3C20D21 (1)
Weight, g/mol:	348.183778
ΔH_f, kcal/mol:	-39.33
Dipole, Da:	9.24
IP(EA), eV:	-9.15(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(4-methylphenyl)methyl]propanamide

Drug info:

PubChemData

Smile

CCC(=O)N(CC1=CN=CC=C1)CC2=CC3=C(C=CC(=C3)C)NC2=O

DOS

IR

Vibrations