Geometry & MOs

Info

ID:	266951
PubChem CID:	103580191
Reduced:	BrClN3C12H17 (1)
Stoich.:	ABC3D12E17 (1)
Weight, g/mol:	277.98215
ΔH_f, kcal/mol:	26.56
Dipole, Da:	3.76
IP(EA), eV:	-8.54(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-bromo-3-chloropyridin-2-yl)amino]-2-methylpropan-2-ol

Drug info:

PubChemData

Smile

CN(C)C1CCCN(C1)C2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations