Geometry & MOs

Info

ID:	235039
PubChem CID:	92303930
Reduced:	FSN2O2H19C23 (1)
Stoich.:	ABC2D2E19F23 (1)
Weight, g/mol:	420.130777
ΔH_f, kcal/mol:	-59.22
Dipole, Da:	7.24
IP(EA), eV:	-8.82(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(2R)-3-(3,5-dimethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]-4-fluorobenzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations