Geometry & MOs

Info

ID:	282573
PubChem CID:	103931465
Reduced:	OS2N3C15H17 (1)
Stoich.:	AB2C3D15E17 (1)
Weight, g/mol:	249.147727
ΔH_f, kcal/mol:	69.33
Dipole, Da:	2.04
IP(EA), eV:	-8.85(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CCNC(CC2=CC=CS2)C3=CC=CS3

DOS

IR

Vibrations