Geometry & MOs

Info

ID:	349731
PubChem CID:	127275883
Reduced:	O2N3C23H35 (1)
Stoich.:	A2B3C23D35 (1)
Weight, g/mol:	359.220892
ΔH_f, kcal/mol:	-87.46
Dipole, Da:	2.39
IP(EA), eV:	-9.1(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]bicyclo[3.3.1]nonan-9-one

Drug info:

PubChemData

Smile

CC(C)C1=NC(=NO1)C2CCCN(C2)C(=O)C34CC5CC(C3)(CC(C5)(C4)C)C

DOS

IR

Vibrations