Geometry & MOs

Info

ID:	235007
PubChem CID:	92303867
Reduced:	FSN2O2H21C24 (1)
Stoich.:	ABC2D2E21F24 (1)
Weight, g/mol:	354.140199
ΔH_f, kcal/mol:	-66.43
Dipole, Da:	0.46
IP(EA), eV:	-9.15(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(2S)-4-oxo-3-(4-propan-2-ylphenyl)-1,3-thiazolidin-2-yl]phenyl]acetamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations