Geometry & MOs

Info

ID:	283548
PubChem CID:	103988028
Reduced:	ON3C16H27 (1)
Stoich.:	AB3C16D27 (1)
Weight, g/mol:	267.194677
ΔH_f, kcal/mol:	-48.14
Dipole, Da:	4.45
IP(EA), eV:	-9.07(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(oxolan-3-ylmethyl)-1,2,4-oxadiazol-5-yl]-N-propylbutan-2-amine

Drug info:

PubChemData

Smile

CCNCC(C)C1=C(N=C(N=C1C)CC2CCOC2)C

DOS

IR

Vibrations