Geometry & MOs

Info

ID:	234905
PubChem CID:	92303687
Reduced:	FON3C21H24 (1)
Stoich.:	ABC3D21E24 (1)
Weight, g/mol:	394.096283
ΔH_f, kcal/mol:	-38.51
Dipole, Da:	5.27
IP(EA), eV:	-8.54(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(2R)-4-oxo-3-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-2-yl]phenyl]propanamide

Drug info:

PubChemData

Smile

CN(C)CCNC(=O)C[C@H](C1=CC(=CC=C1)F)C2=CNC3=CC=CC=C32

DOS

IR

Vibrations