Geometry & MOs

Info

ID:	234951
PubChem CID:	92303772
Reduced:	FNO3C24H24 (1)
Stoich.:	ABC3D24E24 (1)
Weight, g/mol:	380.155849
ΔH_f, kcal/mol:	-125.85
Dipole, Da:	0.93
IP(EA), eV:	-9.28(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(2S)-4-oxo-3-(2-propylphenyl)-1,3-thiazolidin-2-yl]phenyl]cyclopropanecarboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN2C(=C([C@H](CC2=O)C3=CC(=CC=C3)F)C(=O)OCC=C)C

DOS

IR

Vibrations