Geometry & MOs

Info

ID:	24469
PubChem CID:	610436
Reduced:	BrN2H5C8 (1)
Stoich.:	AB2C5D8 (1)
Weight, g/mol:	207.96361
ΔH_f, kcal/mol:	74.18
Dipole, Da:	3.89
IP(EA), eV:	-10.01(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromophthalazine

Drug info:

PubChemData

Smile

C1=CC2=CN=NC=C2C=C1Br

DOS

IR

Vibrations