Geometry & MOs

Info

ID:	251079
PubChem CID:	103101313
Reduced:	ON2C6H8 (2)
Stoich.:	AB2C6D8 (2)
Weight, g/mol:	284.104003
ΔH_f, kcal/mol:	-39.39
Dipole, Da:	7.93
IP(EA), eV:	-8.74(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(3-amino-4-chloroanilino)-2-oxoethyl]-ethylamino]acetamide

Drug info:

PubChemData

Smile

CCN(CC1=NC2=C(O1)C=C(C=C2)N)CC(=O)N

DOS

IR

Vibrations