Geometry & MOs

Info

ID:	288300
PubChem CID:	104314851
Reduced:	OBr2N2C12H12 (1)
Stoich.:	AB2C2D12E12 (1)
Weight, g/mol:	419.9175
ΔH_f, kcal/mol:	22.44
Dipole, Da:	1.48
IP(EA), eV:	-8.46(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCNC(C1=COC=C1)C2=C(C=C(C=N2)Br)Br

DOS

IR

Vibrations