Geometry & MOs

Info

ID:	286431
PubChem CID:	104170138
Reduced:	ON2C18H30 (1)
Stoich.:	AB2C18D30 (1)
Weight, g/mol:	228.220164
ΔH_f, kcal/mol:	-44.39
Dipole, Da:	2.68
IP(EA), eV:	-8.29(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-butan-2-yl-1-(2-methoxypropyl)-2-methylpiperazine

Drug info:

PubChemData

Smile

CCC1(CNC(CN1CC(C)OC)CC2=CC=CC=C2)C

DOS

IR

Vibrations