Geometry & MOs

Info

ID:	234981
PubChem CID:	92303822
Reduced:	OCl2N2C23H24 (1)
Stoich.:	AB2C2D23E24 (1)
Weight, g/mol:	410.090055
ΔH_f, kcal/mol:	-20.68
Dipole, Da:	5.76
IP(EA), eV:	-8.44(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-N-[4-[(2S)-3-(2-fluorophenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]benzamide

Drug info:

PubChemData

Smile

CCC1=C2C(=CC=C1)C(=CN2)[C@H](CC(=O)N3CCCC3)C4=CC(=C(C=C4)Cl)Cl

DOS

IR

Vibrations