Geometry & MOs

Info

ID:	371895
PubChem CID:	131277880
Reduced:	NO2C12H15 (1)
Stoich.:	AB2C12D15 (1)
Weight, g/mol:	339.85959
ΔH_f, kcal/mol:	-83.45
Dipole, Da:	2.27
IP(EA), eV:	-8.39(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-2-iodo-5-methoxybenzaldehyde

Drug info:

PubChemData

Smile

CCOC(=O)C1CCC2=C1C(=CC=C2)N

DOS

IR

Vibrations