Geometry & MOs

Info

ID:	242560
PubChem CID:	97302079
Reduced:	NSF4C14H19 (1)
Stoich.:	ABC4D14E19 (1)
Weight, g/mol:	359.072233
ΔH_f, kcal/mol:	-206.86
Dipole, Da:	2.37
IP(EA), eV:	-9.47(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[(3-chlorophenyl)methyl]-1-phenyl-3-(trifluoromethylsulfanyl)propan-2-amine

Drug info:

PubChemData

Smile

CC(C)C[C@H](CSC(F)(F)F)NCC1=CC=C(C=C1)F

DOS

IR

Vibrations