Geometry & MOs

Info

ID:	278202
PubChem CID:	103834071
Reduced:	NSCl2F3O3C11H12 (1)
Stoich.:	ABC2D3E3F11G12 (1)
Weight, g/mol:	314.018427
ΔH_f, kcal/mol:	-291.99
Dipole, Da:	6.65
IP(EA), eV:	-9.66(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1Cl)S(=O)(=O)NCC(C(F)(F)F)O)C)Cl

DOS

IR

Vibrations