Geometry & MOs

Info

ID:	122480
PubChem CID:	50808775
Reduced:	SN2O3C24H32 (1)
Stoich.:	AB2C3D24E32 (1)
Weight, g/mol:	422.106706
ΔH_f, kcal/mol:	-111.97
Dipole, Da:	5.41
IP(EA), eV:	-9.14(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-chlorophenyl)methylsulfonyl]-N-(4-methoxyphenyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCC1=C(C(=CC=C1)CC)NC(=O)C2CCCN(C2)S(=O)(=O)CC3=CC=CC=C3C

DOS

IR

Vibrations