Geometry & MOs

Info

ID:	267659
PubChem CID:	103583208
Reduced:	BrClN2H12C13 (1)
Stoich.:	ABC2D12E13 (1)
Weight, g/mol:	288.00289
ΔH_f, kcal/mol:	38.54
Dipole, Da:	1.84
IP(EA), eV:	-8.75(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-chloro-N-ethyl-N-(2-methylprop-2-enyl)pyridin-2-amine

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)NC2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations