Geometry & MOs

Info

ID:	27136
PubChem CID:	815296
Reduced:	NSO2F3H12C15 (1)
Stoich.:	ABC2D3E12F15 (1)
Weight, g/mol:	329.10612
ΔH_f, kcal/mol:	-178.1
Dipole, Da:	6.61
IP(EA), eV:	-9.25(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclopentyl-[(2R)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]methanone

Drug info:

PubChemData

Smile

C1CS[C@H](N1C(=O)C2=CC=CO2)C3=CC=C(C=C3)C(F)(F)F

DOS

IR

Vibrations