Geometry & MOs

Info

ID:	357975
PubChem CID:	127295489
Reduced:	SO2N4C15H20 (1)
Stoich.:	AB2C4D15E20 (1)
Weight, g/mol:	295.189592
ΔH_f, kcal/mol:	-17.78
Dipole, Da:	2.83
IP(EA), eV:	-8.86(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-(oxan-3-yl)-N-[[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]methyl]methanamine

Drug info:

PubChemData

Smile

CN(CC1CCCOC1)CC(=O)NC2=CC=CC3=C2N=S=N3

DOS

IR

Vibrations