Geometry & MOs

Info

ID:	259666
PubChem CID:	103171233
Reduced:	SN2O2F3C13H19 (1)
Stoich.:	AB2C2D3E13F19 (1)
Weight, g/mol:	324.069927
ΔH_f, kcal/mol:	-252.75
Dipole, Da:	6.77
IP(EA), eV:	-8.78(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-[(3-chlorophenyl)methyl]-3,6-dimethylbenzenesulfonamide

Drug info:

PubChemData

Smile

CCCN(CC(F)(F)F)S(=O)(=O)C1=C(C=CC(=C1N)C)C

DOS

IR

Vibrations