Geometry & MOs

Info

ID:	251080
PubChem CID:	103101318
Reduced:	ClO2N4C12H17 (1)
Stoich.:	AB2C4D12E17 (1)
Weight, g/mol:	280.153541
ΔH_f, kcal/mol:	-81.5
Dipole, Da:	6.38
IP(EA), eV:	-8.45(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(5-amino-2-methoxyanilino)-2-oxoethyl]-ethylamino]acetamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations