Geometry & MOs

Info

ID:	310330
PubChem CID:	126578858
Reduced:	Cl3N3O3C27H32 (1)
Stoich.:	A3B3C3D27E32 (1)
Weight, g/mol:	329.980979
ΔH_f, kcal/mol:	-133.17
Dipole, Da:	5.82
IP(EA), eV:	-7.73(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(trifluoromethylsulfonyl)benzo[f][2]benzofuran-1,3-dione

Drug info:

PubChemData

Smile

CC(C1=C(C=C(C=C1)Cl)Cl)NC2=C(C=CC(=C2)N3CCC(CC3)C(=O)N4CCC(CC4)C(=O)OC)Cl

DOS

IR

Vibrations