Geometry & MOs

Info

ID:	20647
PubChem CID:	585009
Reduced:	N3O3C20H23 (1)
Stoich.:	A3B3C20D23 (1)
Weight, g/mol:	353.173942
ΔH_f, kcal/mol:	-64.59
Dipole, Da:	1.56
IP(EA), eV:	-8.96(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(2-ethylanilino)-4-oxobutan-2-ylidene]amino]-4-methoxybenzamide

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1NC(=O)CC(=NNC(=O)C2=CC=C(C=C2)OC)C

DOS

IR

Vibrations