Geometry & MOs

Info

ID:	234837
PubChem CID:	92303580
Reduced:	FNO3C24H26 (1)
Stoich.:	ABC3D24E26 (1)
Weight, g/mol:	382.171499
ΔH_f, kcal/mol:	-154.34
Dipole, Da:	1.89
IP(EA), eV:	-9.29(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CN2C(=C([C@@H](CC2=O)C3=CC=CC=C3F)C(=O)OC(C)C)C

DOS

IR

Vibrations