Geometry & MOs

Info

ID:	199975
PubChem CID:	79325915
Reduced:	ON2C11H22 (1)
Stoich.:	AB2C11D22 (1)
Weight, g/mol:	282.149891
ΔH_f, kcal/mol:	-58.19
Dipole, Da:	4.87
IP(EA), eV:	-9.25(1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(4-chlorophenyl)piperazin-1-yl]-2-methylbutan-2-ol

Drug info:

PubChemData

Smile

CCN(CCC(C)(C)O)CC(C)C#N

DOS

IR

Vibrations