Geometry & MOs

Info

ID:	278199
PubChem CID:	103834023
Reduced:	NSO3F4C9H9 (1)
Stoich.:	ABC3D4E9F9 (1)
Weight, g/mol:	314.018427
ΔH_f, kcal/mol:	-304.46
Dipole, Da:	3.74
IP(EA), eV:	-10.49(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-nitro-N-(3,3,3-trifluoro-2-hydroxypropyl)benzenesulfonamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)S(=O)(=O)NCC(C(F)(F)F)O)F

DOS

IR

Vibrations