Geometry & MOs

Info

ID:	267494
PubChem CID:	103582379
Reduced:	BrClN2C11H14 (1)
Stoich.:	ABC2D11E14 (1)
Weight, g/mol:	310.98249
ΔH_f, kcal/mol:	8.5
Dipole, Da:	3.17
IP(EA), eV:	-8.64(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-(1-pyridin-4-ylethyl)pyridin-2-amine

Drug info:

PubChemData

Smile

C1CCC(C1)CNC2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations