Geometry & MOs

Info

ID:	30283
PubChem CID:	841085
Reduced:	NO2C9H10 (2)
Stoich.:	AB2C9D10 (2)
Weight, g/mol:	339.158292
ΔH_f, kcal/mol:	-81.67
Dipole, Da:	2.62
IP(EA), eV:	-8.48(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-N-[1-[4-(propanoylamino)phenyl]ethylideneamino]benzamide

Drug info:

PubChemData

Smile

COCC1=C(C=CC(=C1)C=NNC(=O)C2=CC(=CC=C2)OC)OC

DOS

IR

Vibrations