Geometry & MOs

Info

ID:	341060
PubChem CID:	127263495
Reduced:	ClO2C15H19 (1)
Stoich.:	AB2C15D19 (1)
Weight, g/mol:	342.98538
ΔH_f, kcal/mol:	-98.71
Dipole, Da:	4.57
IP(EA), eV:	-9.51(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromo-6-methoxypyridin-2-yl)piperazine;dihydrochloride

Drug info:

PubChemData

Smile

CC1(CC(C(=C(C1)C2=CC=C(C=C2)Cl)CO)O)C

DOS

IR

Vibrations