Geometry & MOs

Info

ID:	267476
PubChem CID:	103582341
Reduced:	BrClON4C11H16 (1)
Stoich.:	ABCD4E11F16 (1)
Weight, g/mol:	377.90929
ΔH_f, kcal/mol:	4.08
Dipole, Da:	2.04
IP(EA), eV:	-9.11(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-[1-(2,4-dichlorophenyl)ethyl]pyridin-2-amine

Drug info:

PubChemData

Smile

COCCN(CCC(=N)N)C1=C(C=C(C=N1)Br)Cl

DOS

IR

Vibrations