Geometry & MOs

Info

ID:	406039
PubChem CID:	135076330
Reduced:	ClNH16C19 (1)
Stoich.:	ABC16D19 (1)
Weight, g/mol:	307.010169
ΔH_f, kcal/mol:	61.47
Dipole, Da:	3.87
IP(EA), eV:	-8.35(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1,1-trifluoro-N-[[4-(trifluoromethyl)phenyl]methyl]methanesulfonamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CNC2=C(C=C(C=C2)Cl)C3=CC=CC=C3

DOS

IR

Vibrations