Geometry & MOs

Info

ID:	11211
PubChem CID:	111901
Reduced:	BrO2N3C6H6 (1)
Stoich.:	AB2C3D6E6 (1)
Weight, g/mol:	230.96434
ΔH_f, kcal/mol:	12.29
Dipole, Da:	4.6
IP(EA), eV:	-9.59(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-6-methyl-3-nitropyridin-2-amine

Drug info:

PubChemData

Smile

CC1=C(C=C(C(=N1)N)[N+](=O)[O-])Br

DOS

IR

Vibrations