Geometry & MOs

Info

ID:	287257
PubChem CID:	104234178
Reduced:	FON3C16H16 (1)
Stoich.:	ABC3D16E16 (1)
Weight, g/mol:	268.158706
ΔH_f, kcal/mol:	-7.74
Dipole, Da:	4.81
IP(EA), eV:	-9.01(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1-aminoethyl)-2-fluorophenoxy]-N-butylacetamide

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)OCC2=CN3C=CC=CC3=N2)F)N

DOS

IR

Vibrations