Geometry & MOs

Info

ID:	244882
PubChem CID:	99431536
Reduced:	SN2F3O3C15H17 (1)
Stoich.:	AB2C3D3E15F17 (1)
Weight, g/mol:	362.091198
ΔH_f, kcal/mol:	-272.78
Dipole, Da:	2.32
IP(EA), eV:	-9.58(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-oxo-1,3-thiazolidin-3-yl)-N-[(3R)-4,4,4-trifluoro-3-hydroxy-3-phenylbutyl]acetamide

Drug info:

PubChemData

Smile

C1CSC(=O)N1CC(=O)NCC[C@](C2=CC=CC=C2)(C(F)(F)F)O

DOS

IR

Vibrations