Geometry & MOs

Info

ID:	235098
PubChem CID:	92304036
Reduced:	SN2O2H24C25 (1)
Stoich.:	AB2C2D24E25 (1)
Weight, g/mol:	416.155849
ΔH_f, kcal/mol:	-27.97
Dipole, Da:	3.97
IP(EA), eV:	-8.81(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=CC(=CC=C1)N2[C@@H](SCC2=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4C

DOS

IR

Vibrations