Geometry & MOs

Info

ID:	153825
PubChem CID:	56313141
Reduced:	BrFO2N3C20H23 (1)
Stoich.:	ABC2D3E20F23 (1)
Weight, g/mol:	356.156992
ΔH_f, kcal/mol:	-105.16
Dipole, Da:	1.45
IP(EA), eV:	-9.06(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-fluorophenyl)-2-methylpropyl]-1-methylsulfonylpiperidine-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)CCNC(=O)NC1=CC=C(C=C1)Br)C2=CC=CC=C2F

DOS

IR

Vibrations