Geometry & MOs

Info

ID:	66482
PubChem CID:	46504659
Reduced:	N3O4C26H31 (1)
Stoich.:	A3B4C26D31 (1)
Weight, g/mol:	415.262363
ΔH_f, kcal/mol:	-104.02
Dipole, Da:	3.79
IP(EA), eV:	-7.89(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-butyl-N-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]benzamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)C2=NC3=C(C=C(C=C3)NC(=O)C4=CC(=C(C(=C4)OC)OC)OC)C(=C2)C

DOS

IR

Vibrations