Geometry & MOs

Info

ID:	31452
PubChem CID:	855737
Reduced:	NOC11H12 (2)
Stoich.:	ABC11D12 (2)
Weight, g/mol:	334.168128
ΔH_f, kcal/mol:	-63.56
Dipole, Da:	6.93
IP(EA), eV:	-8.88(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(4-methylphenyl)methyl]acetamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations