Geometry & MOs

Info

ID:	218685
PubChem CID:	85089805
Reduced:	OSF2N9H19C22 (1)
Stoich.:	ABC2D9E19F22 (1)
Weight, g/mol:	499.167811
ΔH_f, kcal/mol:	82.1
Dipole, Da:	10.4
IP(EA), eV:	-8.99(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-[(3,5-diphenylpyrazolidin-4-yl)oxymethyl]-1,3,4-oxadiazol-2-yl]-2-phenyl-1,3-thiazolidin-4-one

Drug info:

PubChemData

Smile

CC(C(CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)N3C=CN(C3=S)C4=CC=C(C=C4)N5C=NN=N5

DOS

IR

Vibrations