Geometry & MOs

Info

ID:	288463
PubChem CID:	104316982
Reduced:	ON2C12H26 (1)
Stoich.:	AB2C12D26 (1)
Weight, g/mol:	229.215413
ΔH_f, kcal/mol:	-80.79
Dipole, Da:	5.29
IP(EA), eV:	-8.87(2.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(4-aminobutyl)piperazin-1-yl]butan-2-ol

Drug info:

PubChemData

Smile

CC(CCN(CCCN)C1CCCC1)O

DOS

IR

Vibrations