Geometry & MOs

Info

ID:	370373
PubChem CID:	127338365
Reduced:	NOSC16H21 (1)
Stoich.:	ABCD16E21 (1)
Weight, g/mol:	286.168128
ΔH_f, kcal/mol:	-37.03
Dipole, Da:	5.58
IP(EA), eV:	-8.38(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-4-(2-methyl-3,4-dihydro-2H-quinoline-1-carbonyl)piperidin-2-one

Drug info:

PubChemData

Smile

CC1CCC2=CC=CC=C2N1C(=O)C3CCSCC3

DOS

IR

Vibrations