Geometry & MOs

Info

ID:	288281
PubChem CID:	104314581
Reduced:	Br2N2C13H20 (1)
Stoich.:	A2B2C13D20 (1)
Weight, g/mol:	405.90185
ΔH_f, kcal/mol:	7.14
Dipole, Da:	1.3
IP(EA), eV:	-9.18(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-3-[(3,5-dibromopyridin-2-yl)-(methylamino)methyl]pyridin-2-amine

Drug info:

PubChemData

Smile

CC(C)CCCC(C1=C(C=C(C=N1)Br)Br)NC

DOS

IR

Vibrations