Geometry & MOs

Info

ID:	267423
PubChem CID:	103582178
Reduced:	BrClN3C15H23 (1)
Stoich.:	ABC3D15E23 (1)
Weight, g/mol:	339.01379
ΔH_f, kcal/mol:	7.98
Dipole, Da:	2.56
IP(EA), eV:	-8.84(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-(aminomethyl)phenyl]methyl]-5-bromo-3-chloro-N-methylpyridin-2-amine

Drug info:

PubChemData

Smile

C1CCCC(CC1)N(CCCN)C2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations