Geometry & MOs

Info

ID:	235025
PubChem CID:	92303907
Reduced:	FSN2O2C23H25 (1)
Stoich.:	ABC2D2E23F25 (1)
Weight, g/mol:	390.121355
ΔH_f, kcal/mol:	-110.63
Dipole, Da:	7.33
IP(EA), eV:	-8.82(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)N2[C@H](SCC2=O)C3=CC(=CC=C3)NC(=O)C4CCCCC4)F

DOS

IR

Vibrations