Geometry & MOs

Info

ID:	143952
PubChem CID:	53286907
Reduced:	SN2F3O3C19H21 (1)
Stoich.:	AB2C3D3E19F21 (1)
Weight, g/mol:	394.136257
ΔH_f, kcal/mol:	-257.75
Dipole, Da:	6.47
IP(EA), eV:	-8.86(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-ethoxy-N-methylsulfonylanilino)-N-(4-fluorophenyl)butanamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC(=O)CCCN(C2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)C

DOS

IR

Vibrations