Geometry & MOs

Info

ID:	266945
PubChem CID:	103580162
Reduced:	BrClN4C11H12 (1)
Stoich.:	ABC4D11E12 (1)
Weight, g/mol:	305.02944
ΔH_f, kcal/mol:	53.45
Dipole, Da:	4.96
IP(EA), eV:	-8.73(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-(5-bromo-3-chloropyridin-2-yl)-1-N,1-N-dimethylbutane-1,3-diamine

Drug info:

PubChemData

Smile

CN1C=CN=C1CCNC2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations