Geometry & MOs

Info

ID:	79666
PubChem CID:	49829908
Reduced:	FO2S2N4C19H19 (1)
Stoich.:	AB2C2D4E19F19 (1)
Weight, g/mol:	400.182064
ΔH_f, kcal/mol:	-44.71
Dipole, Da:	3.65
IP(EA), eV:	-8.82(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dibenzyl-1-ethylsulfonylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(NC(=C1C(=O)C)C)C(=O)C(C)SC2=NN=C(S2)NC3=CC=C(C=C3)F

DOS

IR

Vibrations