Geometry & MOs

Info

ID:	251239
PubChem CID:	103102419
Reduced:	ON4C10H12 (1)
Stoich.:	AB4C10D12 (1)
Weight, g/mol:	248.09094
ΔH_f, kcal/mol:	19.9
Dipole, Da:	3.59
IP(EA), eV:	-9.6(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-cyano-N-ethyl-3-nitroanilino)acetamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C1=C(C=CN=C1)C#N

DOS

IR

Vibrations