Geometry & MOs

Info

ID:	428617
PubChem CID:	135167797
Reduced:	NC12H25 (1)
Stoich.:	AB12C25 (1)
Weight, g/mol:	286.262028
ΔH_f, kcal/mol:	-35.82
Dipole, Da:	1.67
IP(EA), eV:	-8.77(1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-1-(4-tert-butylpiperazin-1-yl)-4-[(2-methylpropan-2-yl)oxy]butan-2-ol

Drug info:

PubChemData

Smile

CC=C(CCC(C)C)[C@@H](C)CNC

DOS

IR

Vibrations