Geometry & MOs

Info

ID:	151742
PubChem CID:	56310399
Reduced:	SF2N2O3C24H24 (1)
Stoich.:	AB2C2D3E24F24 (1)
Weight, g/mol:	388.182064
ΔH_f, kcal/mol:	-163.64
Dipole, Da:	5.36
IP(EA), eV:	-8.96(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-phenylbutyl)propanamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)CC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)F)C3=CC=CC=C3F

DOS

IR

Vibrations