Geometry & MOs

Info

ID:	61700
PubChem CID:	26711929
Reduced:	SN2O4C21H28 (1)
Stoich.:	AB2C4D21E28 (1)
Weight, g/mol:	396.091056
ΔH_f, kcal/mol:	-127.83
Dipole, Da:	8.03
IP(EA), eV:	-9.04(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)sulfonyl-N-(furan-2-ylmethyl)-N-methylpiperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC3=CC=CO3

DOS

IR

Vibrations