Geometry & MOs

Info

ID:	234917
PubChem CID:	92303710
Reduced:	SN2O3H22C24 (1)
Stoich.:	AB2C3D22E24 (1)
Weight, g/mol:	378.060505
ΔH_f, kcal/mol:	-48.38
Dipole, Da:	5.06
IP(EA), eV:	-8.57(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2[C@H](SCC2=O)C3=CC=CC=C3NC(=O)COC4=CC=CC=C4

DOS

IR

Vibrations