Geometry & MOs

Info

ID:	143963
PubChem CID:	53288517
Reduced:	FSN2O4C19H23 (1)
Stoich.:	ABC2D4E19F23 (1)
Weight, g/mol:	406.172642
ΔH_f, kcal/mol:	-172.67
Dipole, Da:	4.79
IP(EA), eV:	-8.89(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-fluoro-N-methylsulfonylanilino)-N-[1-(4-methylphenyl)propyl]butanamide

Drug info:

PubChemData

Smile

CCC(C(=O)NCC1=CC=CC=C1OC)N(C2=CC=CC=C2F)S(=O)(=O)C

DOS

IR

Vibrations