Geometry & MOs

Info

ID:	365609
PubChem CID:	127318330
Reduced:	SN3O3C13H21 (1)
Stoich.:	AB3C3D13E21 (1)
Weight, g/mol:	235.168462
ΔH_f, kcal/mol:	-83.71
Dipole, Da:	6.86
IP(EA), eV:	-9.92(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclohexyl-5-(1-methylpyrrolidin-3-yl)-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

C1CCC(CC1)C2=NOC(=N2)CCN3CCCS3(=O)=O

DOS

IR

Vibrations