Geometry & MOs

Info

ID:	273977
PubChem CID:	103806249
Reduced:	ClION2H14C15 (1)
Stoich.:	ABCD2E14F15 (1)
Weight, g/mol:	228.108562
ΔH_f, kcal/mol:	18.58
Dipole, Da:	2.04
IP(EA), eV:	-9.66(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-aminobutyl)-2-(2,2,2-trifluoroethoxy)acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CN)CNC(=O)C2=CC(=C(C=C2)I)Cl

DOS

IR

Vibrations