Geometry & MOs

Info

ID:	373077
PubChem CID:	131309503
Reduced:	NO4C9H9 (1)
Stoich.:	AB4C9D9 (1)
Weight, g/mol:	166.043008
ΔH_f, kcal/mol:	-52.57
Dipole, Da:	7.54
IP(EA), eV:	-9.69(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-6-methylphthalaldehyde

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)OC)C=O)[N+](=O)[O-]

DOS

IR

Vibrations