Geometry & MOs

Info

ID:	235066
PubChem CID:	92303975
Reduced:	N2O3H22C25 (1)
Stoich.:	A2B3C22D25 (1)
Weight, g/mol:	416.132527
ΔH_f, kcal/mol:	-27.25
Dipole, Da:	2.47
IP(EA), eV:	-8.3(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-[4-[(2S)-3-(3-ethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]-2,2-dimethylpropanamide

Drug info:

PubChemData

Smile

C1OC2=CC=CC(=C2O1)[C@H](CC(=O)NCC3=CC=CC=C3)C4=CNC5=CC=CC=C54

DOS

IR

Vibrations