Geometry & MOs

Info

ID:	265336
PubChem CID:	103517683
Reduced:	BrN3C10H16 (1)
Stoich.:	AB3C10D16 (1)
Weight, g/mol:	271.06841
ΔH_f, kcal/mol:	20.04
Dipole, Da:	3.84
IP(EA), eV:	-8.79(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-4-N-ethyl-4-N-(2-methylpropyl)pyridine-3,4-diamine

Drug info:

PubChemData

Smile

CCC(C)N(C)C1=C(C=NC=C1N)Br

DOS

IR

Vibrations