Geometry & MOs

Info

ID:	21064
PubChem CID:	587069
Reduced:	ON2Cl3H13C20 (1)
Stoich.:	AB2C3D13E20 (1)
Weight, g/mol:	402.009346
ΔH_f, kcal/mol:	31.17
Dipole, Da:	1.33
IP(EA), eV:	-8.97(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(benzylideneamino)-2,4-dichlorophenyl]-4-chlorobenzamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C=NC2=C(C=C(C(=C2)NC(=O)C3=CC=C(C=C3)Cl)Cl)Cl

DOS

IR

Vibrations