Geometry & MOs

Info

ID:	347536
PubChem CID:	127272391
Reduced:	N3O3C16H21 (1)
Stoich.:	A3B3C16D21 (1)
Weight, g/mol:	396.216141
ΔH_f, kcal/mol:	-72.02
Dipole, Da:	3.26
IP(EA), eV:	-9.51(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-tert-butyl-1,2,4-oxadiazol-5-yl)-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide

Drug info:

PubChemData

Smile

C1CC1C(=O)N2CCC(CC2)NC(=O)COC3=CN=CC=C3

DOS

IR

Vibrations