Geometry & MOs

Info

ID:	324985
PubChem CID:	126679066
Reduced:	ON4H28C48 (1)
Stoich.:	AB4C28D48 (1)
Weight, g/mol:	218.90865
ΔH_f, kcal/mol:	229.72
Dipole, Da:	4.39
IP(EA), eV:	-7.91(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-2-chloro-1-nitrosobenzene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC(=NC3=C2C4=CC=CC=C4C=C3)N5C6=CC=CC=C6C7=C5C8=C(C=C7)C9=C(N8C1=CC=CC=C1)C=CC1=C9OC2=CC=CC=C12

DOS

IR

Vibrations