Geometry & MOs

Info

ID:	405400
PubChem CID:	135073773
Reduced:	NSO2F6H9C10 (1)
Stoich.:	ABC2D6E9F10 (1)
Weight, g/mol:	275.061614
ΔH_f, kcal/mol:	-371.23
Dipole, Da:	5.56
IP(EA), eV:	-10.32(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-pyridin-2-ylsulfinylbenzoate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CCNS(=O)(=O)C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations