Geometry & MOs

Info

ID:	234913
PubChem CID:	92303703
Reduced:	SN2O2H24C25 (1)
Stoich.:	AB2C2D24E25 (1)
Weight, g/mol:	416.155849
ΔH_f, kcal/mol:	-27.22
Dipole, Da:	5.42
IP(EA), eV:	-8.68(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations