Geometry & MOs

Info

ID:	268851
PubChem CID:	103601225
Reduced:	BrNO5H12C14 (1)
Stoich.:	ABC5D12E14 (1)
Weight, g/mol:	350.97424
ΔH_f, kcal/mol:	-67.4
Dipole, Da:	8.38
IP(EA), eV:	-9.26(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-(4-methoxy-2-nitrophenoxy)benzaldehyde

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)OC2=C(C=C(C=C2)Br)CO)[N+](=O)[O-]

DOS

IR

Vibrations