Geometry & MOs

Info

ID:	238650
PubChem CID:	92764876
Reduced:	N2O3C18H28 (1)
Stoich.:	A2B3C18D28 (1)
Weight, g/mol:	332.140389
ΔH_f, kcal/mol:	-110.94
Dipole, Da:	2.37
IP(EA), eV:	-8.43(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[(8aR)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]methyl]-3-[(2-chlorophenyl)methyl]-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC(C)CN1CCN(C[C@@H]1CCO)CC2=C3C(=CC=C2)OCO3

DOS

IR

Vibrations