Geometry & MOs

Info

ID:	414663
PubChem CID:	135087622
Reduced:	NO2C12H17 (2)
Stoich.:	AB2C12D17 (2)
Weight, g/mol:	378.169191
ΔH_f, kcal/mol:	-178.53
Dipole, Da:	4.17
IP(EA), eV:	-9.44(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4R)-3-hydroxy-1-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-4-yl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CC(=O)N2CCC3(CC2)[C@H]([C@](CCO3)(C)NC(=O)CC4CC4)O

DOS

IR

Vibrations