Geometry & MOs

Info

ID:	267490
PubChem CID:	103582371
Reduced:	BrClN3C12H17 (1)
Stoich.:	ABC3D12E17 (1)
Weight, g/mol:	309.98724
ΔH_f, kcal/mol:	13.11
Dipole, Da:	4.61
IP(EA), eV:	-8.49(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-[(4-methylphenyl)methyl]pyridin-2-amine

Drug info:

PubChemData

Smile

CCN1CCCC1CNC2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations