Geometry & MOs

Info

ID:	29449
PubChem CID:	833870
Reduced:	OSN2F3H5C9 (1)
Stoich.:	ABC2D3E5F9 (1)
Weight, g/mol:	342.98441
ΔH_f, kcal/mol:	-130.38
Dipole, Da:	3.94
IP(EA), eV:	-9.7(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(4-bromophenoxy)phenyl]pyrrole-2,5-dione

Drug info:

PubChemData

Smile

C1=CC(=CC=C1NC(=O)C(F)(F)F)SC#N

DOS

IR

Vibrations