Geometry & MOs

Info

ID:	281822
PubChem CID:	103914421
Reduced:	SN3O3C11H19 (1)
Stoich.:	AB3C3D11E19 (1)
Weight, g/mol:	238.179361
ΔH_f, kcal/mol:	-83.05
Dipole, Da:	7.29
IP(EA), eV:	-9.43(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]piperidin-4-amine

Drug info:

PubChemData

Smile

CC1=NOC(=N1)CCNC2CCCC2S(=O)(=O)C

DOS

IR

Vibrations