Geometry & MOs

Info

ID:	364081
PubChem CID:	127313870
Reduced:	NOC11H23 (1)
Stoich.:	ABC11D23 (1)
Weight, g/mol:	376.166604
ΔH_f, kcal/mol:	-78.08
Dipole, Da:	2.0
IP(EA), eV:	-8.74(2.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-chlorophenyl)-5-[[4-(oxan-4-ylmethyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC1CN(CCO1)CCC(C)(C)C

DOS

IR

Vibrations