Geometry & MOs

Info

ID:	220397
PubChem CID:	85182373
Reduced:	ClN2O2H10C11 (2)
Stoich.:	AB2C2D10E11 (2)
Weight, g/mol:	476.184841
ΔH_f, kcal/mol:	-119.99
Dipole, Da:	5.09
IP(EA), eV:	-9.02(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(N-[(4-methylbenzoyl)amino]anilino)-2-oxo-1-phenylethylidene]amino]benzamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C2=C(N1)C=C(C=C2Cl)Cl)C=CC(=O)NC3=CC=C(C=C3)CNC(=O)N

DOS

IR

Vibrations