Geometry & MOs

Info

ID:	340805
PubChem CID:	127263240
Reduced:	ClON2C9H21 (1)
Stoich.:	ABC2D9E21 (1)
Weight, g/mol:	297.86026
ΔH_f, kcal/mol:	-98.64
Dipole, Da:	2.42
IP(EA), eV:	-8.94(1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-4-iodo-2-methylpyrimidine

Drug info:

PubChemData

Smile

COCC1CCN(CC1)CCN.Cl

DOS

IR

Vibrations