Geometry & MOs

Info

ID:	359734
PubChem CID:	127299681
Reduced:	O2N3C24H31 (1)
Stoich.:	A2B3C24D31 (1)
Weight, g/mol:	393.241627
ΔH_f, kcal/mol:	-81.66
Dipole, Da:	5.97
IP(EA), eV:	-8.44(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-[(3-methylpiperidin-1-yl)methyl]phenyl]methyl]-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)CC2=CC=CC=C2CNC(=O)C3=CC4=C(CCCC4)NC3=O

DOS

IR

Vibrations