Geometry & MOs

Info

ID:	154482
PubChem CID:	56313927
Reduced:	FN2O3C19H19 (1)
Stoich.:	AB2C3D19E19 (1)
Weight, g/mol:	418.172642
ΔH_f, kcal/mol:	-47.8
Dipole, Da:	5.39
IP(EA), eV:	-9.83(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-fluorophenyl)-2-methylpropyl]-2-piperidin-1-ylsulfonylbenzamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)/C=C/C1=CC=C(C=C1)[N+](=O)[O-])C2=CC=CC=C2F

DOS

IR

Vibrations