Geometry & MOs

Info

ID:	235090
PubChem CID:	92304020
Reduced:	SN2O3C18H18 (1)
Stoich.:	AB2C3D18E18 (1)
Weight, g/mol:	420.130777
ΔH_f, kcal/mol:	-82.14
Dipole, Da:	4.06
IP(EA), eV:	-8.76(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2R)-3-(2,4-dimethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]-2-fluorobenzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations