Geometry & MOs

Info

ID:	128601
PubChem CID:	51051650
Reduced:	ClNC3H8 (2)
Stoich.:	ABC3D8 (2)
Weight, g/mol:	250.144806
ΔH_f, kcal/mol:	-84.64
Dipole, Da:	7.36
IP(EA), eV:	-9.37(1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2R,5S)-2,5-dimethylpiperazine-1-carboxylate;hydrochloride

Drug info:

PubChemData

Smile

CC[C@H]1CNCCN1.Cl.Cl

DOS

IR

Vibrations