Geometry & MOs

Info

ID:	154685
PubChem CID:	56314177
Reduced:	FN3O5C21H22 (1)
Stoich.:	AB3C5D21E22 (1)
Weight, g/mol:	406.172642
ΔH_f, kcal/mol:	-143.16
Dipole, Da:	10.94
IP(EA), eV:	-9.57(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(dimethylsulfamoyl)-N-[2-(2-fluorophenyl)-2-methylpropyl]-4,5-dimethylbenzamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)CCCN1C2=C(C=C(C=C2)[N+](=O)[O-])OC1=O)C3=CC=CC=C3F

DOS

IR

Vibrations