Geometry & MOs

Info

ID:	120753
PubChem CID:	50743515
Reduced:	SO4N5H23C24 (1)
Stoich.:	AB4C5D23E24 (1)
Weight, g/mol:	443.024662
ΔH_f, kcal/mol:	-38.4
Dipole, Da:	10.96
IP(EA), eV:	-8.85(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-bis(4-chlorophenyl)-1-[(4-chlorophenyl)methyl]-4-hydroxy-2H-pyrrol-5-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)NC(=O)CSC2=NN=C3N2C=C(C=C3)C(=O)NC4=CC=C(C=C4)OC

DOS

IR

Vibrations