Geometry & MOs

Info

ID:	120763
PubChem CID:	50743706
Reduced:	ClFNSO2H19C24 (1)
Stoich.:	ABCDE2F19G24 (1)
Weight, g/mol:	389.142722
ΔH_f, kcal/mol:	-45.74
Dipole, Da:	4.32
IP(EA), eV:	-8.72(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-fluorophenyl)-4-hydroxy-1-[(3-methoxyphenyl)methyl]-3-phenyl-2H-pyrrol-5-one

Drug info:

PubChemData

Smile

CSC1=CC=C(C=C1)CN2C(C(=C(C2=O)O)C3=CC=C(C=C3)Cl)C4=CC=CC=C4F

DOS

IR

Vibrations