Geometry & MOs

Info

ID:	196687
PubChem CID:	78864778
Reduced:	NOSF3C13H16 (1)
Stoich.:	ABCD3E13F16 (1)
Weight, g/mol:	335.1333
ΔH_f, kcal/mol:	-197.48
Dipole, Da:	3.66
IP(EA), eV:	-9.04(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-fluoro-4-methoxyphenyl)methyl]-4-(4-fluorophenoxy)butanamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CSCC(=O)N(C)CC(F)(F)F

DOS

IR

Vibrations