Geometry & MOs

Info

ID:	146027
PubChem CID:	53624843
Reduced:	FO2N3C17H20 (1)
Stoich.:	AB2C3D17E20 (1)
Weight, g/mol:	339.169525
ΔH_f, kcal/mol:	-57.31
Dipole, Da:	1.98
IP(EA), eV:	-9.54(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C#CCNC(=O)CNC(=O)NCC1(CCC1)C2=CC=C(C=C2)F

DOS

IR

Vibrations