Geometry & MOs

Info

ID:	235011
PubChem CID:	92303880
Reduced:	N2O3C25H32 (1)
Stoich.:	A2B3C25D32 (1)
Weight, g/mol:	420.130777
ΔH_f, kcal/mol:	-101.53
Dipole, Da:	2.9
IP(EA), eV:	-7.97(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=C2C(=CC=C1)C(=CN2)[C@H](CC(=O)N[C@H](C)CC)C3=C(C=C(C=C3)OC)OC

DOS

IR

Vibrations