Geometry & MOs

Info

ID:	141476
PubChem CID:	52880626
Reduced:	FS2O4N6C18H21 (1)
Stoich.:	AB2C4D6E18F21 (1)
Weight, g/mol:	459.000485
ΔH_f, kcal/mol:	-106.8
Dipole, Da:	6.28
IP(EA), eV:	-9.38(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

N-[4-[[3,5-bis(trifluoromethyl)phenyl]sulfonylamino]-3-chlorophenyl]ethanimidate

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1NS(=O)(=O)C)C)S(=O)(=O)NC2=C(C=CC(=C2)N3C(=NN=N3)C)F)C

DOS

IR

Vibrations