Geometry & MOs

Info

ID:	228216
PubChem CID:	87563681
Reduced:	NSO4H5C6 (1)
Stoich.:	ABC4D5E6 (1)
Weight, g/mol:	331.978871
ΔH_f, kcal/mol:	-110.88
Dipole, Da:	5.78
IP(EA), eV:	-10.63(-1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dibenzothiophen-4-yl trifluoromethanesulfonate

Drug info:

PubChemData

Smile

C1=CC(=C(N=C1)S(=O)(=O)O)C=O

DOS

IR

Vibrations