Geometry & MOs

Info

ID:	235106
PubChem CID:	92304046
Reduced:	SN2O2C22H26 (1)
Stoich.:	AB2C2D22E26 (1)
Weight, g/mol:	408.187149
ΔH_f, kcal/mol:	-68.13
Dipole, Da:	2.99
IP(EA), eV:	-8.93(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations