Geometry & MOs

Info

ID:	234915
PubChem CID:	92303706
Reduced:	SN2O2C21H24 (1)
Stoich.:	AB2C2D21E24 (1)
Weight, g/mol:	418.135114
ΔH_f, kcal/mol:	-68.99
Dipole, Da:	5.75
IP(EA), eV:	-8.75(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2S)-3-(4-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]-2-phenoxyacetamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations