Geometry & MOs

Info

ID:	347625
PubChem CID:	127272491
Reduced:	O2N5C18H31 (1)
Stoich.:	A2B5C18D31 (1)
Weight, g/mol:	335.232125
ΔH_f, kcal/mol:	-62.08
Dipole, Da:	0.55
IP(EA), eV:	-8.72(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-piperidin-1-yl-2-[4-[(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methyl]piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC(C)C1=NN=C(O1)CN2CCN(CC2)CC(=O)N3CCCCCC3

DOS

IR

Vibrations