Geometry & MOs

Info

ID:	244927
PubChem CID:	99431606
Reduced:	SF3N3O3H18C19 (1)
Stoich.:	AB3C3D3E18F19 (1)
Weight, g/mol:	372.129692
ΔH_f, kcal/mol:	-235.75
Dipole, Da:	5.28
IP(EA), eV:	-9.26(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,5-dioxopyrrolidin-1-yl)-N-[(3S)-4,4,4-trifluoro-3-hydroxy-3-phenylbutyl]propanamide

Drug info:

PubChemData

Smile

CC1=C(SC2=C1C(=O)N(C=N2)C)C(=O)NCC[C@@](C3=CC=CC=C3)(C(F)(F)F)O

DOS

IR

Vibrations