Geometry & MOs

Info

ID:	234800
PubChem CID:	92303519
Reduced:	ClON2C23H27 (1)
Stoich.:	ABC2D23E27 (1)
Weight, g/mol:	386.146427
ΔH_f, kcal/mol:	-25.33
Dipole, Da:	6.34
IP(EA), eV:	-8.55(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCCCCNC(=O)C[C@@H](C1=CC=C(C=C1)Cl)C2=CNC3=CC=CC=C32

DOS

IR

Vibrations