Geometry & MOs

Info

ID:	20041
PubChem CID:	577454
Reduced:	Br2N2O3H12C14 (1)
Stoich.:	A2B2C3D12E14 (1)
Weight, g/mol:	415.91942
ΔH_f, kcal/mol:	13.95
Dipole, Da:	4.51
IP(EA), eV:	-9.08(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-bromo-3-methoxyphenyl)-(4-bromo-3-methoxyphenyl)imino-oxidoazanium

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)N=[N+](C2=CC(=C(C=C2)Br)OC)[O-])Br

DOS

IR

Vibrations