Geometry & MOs

Info

ID:	21058
PubChem CID:	587055
Reduced:	Cl2N2O2H20C27 (1)
Stoich.:	A2B2C2D20E27 (1)
Weight, g/mol:	474.090183
ΔH_f, kcal/mol:	-7.74
Dipole, Da:	3.39
IP(EA), eV:	-8.75(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[4-[[4-[(4-chlorobenzoyl)amino]phenyl]methyl]phenyl]benzamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)Cl)NC(=O)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations