Geometry & MOs

Info

ID:	403015
PubChem CID:	135058335
Reduced:	N2O2F3C11H11 (1)
Stoich.:	A2B2C3D11E11 (1)
Weight, g/mol:	346.062343
ΔH_f, kcal/mol:	-175.27
Dipole, Da:	4.42
IP(EA), eV:	-9.35(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3-dimethyl-1-(4-nitrophenyl)sulfonylindol-2-one

Drug info:

PubChemData

Smile

C/C(=N\OC)/C1=CC=CC=C1NC(=O)C(F)(F)F

DOS

IR

Vibrations