Geometry & MOs

Info

ID:	355749
PubChem CID:	127290601
Reduced:	ON4C20H28 (1)
Stoich.:	AB4C20D28 (1)
Weight, g/mol:	369.196489
ΔH_f, kcal/mol:	-10.38
Dipole, Da:	1.21
IP(EA), eV:	-8.58(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-fluoro-4-methylphenyl)-5-[1-[3-(4-methylpyrazol-1-yl)piperidin-1-yl]ethyl]-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NC(=O)C(C)N2CCCC(C2)N3C=C(C=N3)C

DOS

IR

Vibrations