Geometry & MOs

Info

ID:	79040
PubChem CID:	49746501
Reduced:	SF3N3O3H12C17 (1)
Stoich.:	AB3C3D3E12F17 (1)
Weight, g/mol:	327.104148
ΔH_f, kcal/mol:	-142.19
Dipole, Da:	3.92
IP(EA), eV:	-9.42(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[1-[(4-methoxyphenyl)methyl]azetidin-3-yl]-3-thiophen-2-yl-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

C1C(CN1C(=O)C2=CC=C(C=C2)OC(F)(F)F)C3=NC(=NO3)C4=CC=CS4

DOS

IR

Vibrations