Geometry & MOs

Info

ID:	234826
PubChem CID:	92303563
Reduced:	N3O3C25H29 (1)
Stoich.:	A3B3C25D29 (1)
Weight, g/mol:	406.115127
ΔH_f, kcal/mol:	-65.9
Dipole, Da:	4.93
IP(EA), eV:	-8.55(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCN(CC1)CCNC(=O)C[C@H](C2=CC3=C(C=C2)OCO3)C4=CNC5=CC=CC=C54

DOS

IR

Vibrations