Geometry & MOs

Info

ID:	234889
PubChem CID:	92303659
Reduced:	SN2O3C22H24 (1)
Stoich.:	AB2C3D22E24 (1)
Weight, g/mol:	414.161329
ΔH_f, kcal/mol:	-90.02
Dipole, Da:	7.56
IP(EA), eV:	-8.6(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2R)-3-(2,5-dimethoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]-2,2-dimethylpropanamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)N2[C@H](SCC2=O)C3=CC(=CC=C3)NC(=O)C4CCCC4

DOS

IR

Vibrations