Geometry & MOs

Info

ID:	131493
PubChem CID:	51213637
Reduced:	NOC10H10 (2)
Stoich.:	ABC10D10 (2)
Weight, g/mol:	319.104228
ΔH_f, kcal/mol:	-26.98
Dipole, Da:	7.46
IP(EA), eV:	-8.55(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-fluoro-4-methoxyphenyl)ethyl]-2-phenylsulfanylacetamide

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)C2=CC=CC(=C2)NC(=O)C3(CC3)C4=CC=CC=C4

DOS

IR

Vibrations