Geometry & MOs

Info

ID:	68638
PubChem CID:	46508817
Reduced:	FO2N5C24H28 (1)
Stoich.:	AB2C5D24E28 (1)
Weight, g/mol:	385.247775
ΔH_f, kcal/mol:	-26.95
Dipole, Da:	1.2
IP(EA), eV:	-9.25(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methylbutan-2-yl)-2-[4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NOC(=N2)CN3CCN(CC3)CC(=O)NC(C)C4=CC=C(C=C4)F

DOS

IR

Vibrations