Geometry & MOs

Info

ID:	246306
PubChem CID:	103059119
Reduced:	BrClON3H11C12 (1)
Stoich.:	ABCD3E11F12 (1)
Weight, g/mol:	312.96175
ΔH_f, kcal/mol:	25.96
Dipole, Da:	3.08
IP(EA), eV:	-8.97(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(5-bromo-2-chlorophenoxy)methyl]pyrazin-2-amine

Drug info:

PubChemData

Smile

CNC1=NC=C(N=C1)COC2=C(C=CC(=C2)Br)Cl

DOS

IR

Vibrations