Geometry & MOs

Info

ID:	438353
PubChem CID:	135228086
Reduced:	SN2F3O5C24H31 (1)
Stoich.:	AB2C3D5E24F31 (1)
Weight, g/mol:	428.138148
ΔH_f, kcal/mol:	-313.31
Dipole, Da:	6.71
IP(EA), eV:	-8.62(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3,4-difluoro-2-(2-fluoro-4-methylanilino)-6-methoxyphenyl]-1-propylcyclopropane-1-sulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC2=C(C(=CC(=C2F)F)OC)NS(=O)(=O)C3(CC3)CC(C)COC(C)(C)O)F

DOS

IR

Vibrations