Geometry & MOs

Info

ID:	259005
PubChem CID:	103157908
Reduced:	NOC4H7 (3)
Stoich.:	ABC4D7 (3)
Weight, g/mol:	229.142641
ΔH_f, kcal/mol:	-85.04
Dipole, Da:	2.9
IP(EA), eV:	-9.67(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-3-[3-(1-methoxypropyl)-1,2,4-oxadiazol-5-yl]propan-1-amine

Drug info:

PubChemData

Smile

COC(CC1=NC(=NO1)CC2CCCCO2)CN

DOS

IR

Vibrations