Geometry & MOs

Info

ID:	202331
PubChem CID:	79659114
Reduced:	N3C16H33 (1)
Stoich.:	A3B16C33 (1)
Weight, g/mol:	267.20591
ΔH_f, kcal/mol:	-28.84
Dipole, Da:	3.28
IP(EA), eV:	-8.27(2.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(1,4-dimethylpiperazin-2-yl)-1,2,4-oxadiazol-5-yl]-N-ethylpropan-1-amine

Drug info:

PubChemData

Smile

CCCNC(C1CCCCC1)C2CN(CCN2C)C

DOS

IR

Vibrations