Geometry & MOs

Info

ID:	235079
PubChem CID:	92303997
Reduced:	SN2O3C24H30 (1)
Stoich.:	AB2C3D24E30 (1)
Weight, g/mol:	426.197714
ΔH_f, kcal/mol:	-105.29
Dipole, Da:	3.11
IP(EA), eV:	-8.82(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2S)-3-(2-methoxy-5-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]heptanamide

Drug info:

PubChemData

Smile

CCCCCCC(=O)NC1=CC=CC=C1[C@@H]2N(C(=O)CS2)C3=C(C=CC(=C3)C)OC

DOS

IR

Vibrations