Geometry & MOs

Info

ID:	429728
PubChem CID:	135169779
Reduced:	ON5H27C44 (1)
Stoich.:	AB5C27D44 (1)
Weight, g/mol:	249.95085
ΔH_f, kcal/mol:	232.67
Dipole, Da:	3.75
IP(EA), eV:	-8.42(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-6-chloro-N-methoxy-2-methylpyridin-3-amine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=NC(=NC(=N3)C4=CC=CC=C4)N5C6=C(C=CC7=CC=CC=C76)C8=C5C9=C(C=C8)N=C(O9)C1=CC=CC=C1

DOS

IR

Vibrations