Geometry & MOs

Info

ID:	251083
PubChem CID:	103101352
Reduced:	FO2N4C12H17 (1)
Stoich.:	AB2C4D12E17 (1)
Weight, g/mol:	241.09819
ΔH_f, kcal/mol:	-116.86
Dipole, Da:	3.97
IP(EA), eV:	-8.56(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-amino-4-chlorophenyl)methyl-ethylamino]acetamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)CC(=O)NC1=C(C=C(C=C1)F)N

DOS

IR

Vibrations