Geometry & MOs

Info

ID:	367086
PubChem CID:	127323139
Reduced:	ON2C11H15 (2)
Stoich.:	AB2C11D15 (2)
Weight, g/mol:	396.252526
ΔH_f, kcal/mol:	-70.68
Dipole, Da:	6.76
IP(EA), eV:	-8.76(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[1-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]ethyl]piperidin-4-yl]-(4-methylpiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)C2CCN(CC2)CC3=CC(=O)N4C=C(C=CC4=N3)C

DOS

IR

Vibrations