Geometry & MOs

Info

ID:	270232
PubChem CID:	103635524
Reduced:	OSN3C11H15 (1)
Stoich.:	ABC3D11E15 (1)
Weight, g/mol:	291.121906
ΔH_f, kcal/mol:	33.71
Dipole, Da:	2.02
IP(EA), eV:	-8.87(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)ethanamine

Drug info:

PubChemData

Smile

CC1=C(SC=C1)CNCCC2=NOC(=N2)C

DOS

IR

Vibrations