Geometry & MOs

Info

ID:	365615
PubChem CID:	127318336
Reduced:	N3O3C15H23 (1)
Stoich.:	A3B3C15D23 (1)
Weight, g/mol:	291.194677
ΔH_f, kcal/mol:	-90.32
Dipole, Da:	3.41
IP(EA), eV:	-9.58(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-tert-butyl-4-(3-cyclohexyl-1,2,4-oxadiazol-5-yl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1CCC(CC1)C2=NOC(=N2)CCC(=O)N3CCOCC3

DOS

IR

Vibrations