Geometry & MOs

Info

ID:	292865
PubChem CID:	117362122
Reduced:	F2O3C12H14 (1)
Stoich.:	A2B3C12D14 (1)
Weight, g/mol:	244.091101
ΔH_f, kcal/mol:	-186.21
Dipole, Da:	4.7
IP(EA), eV:	-8.95(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,3-difluoro-5,6-dimethoxyphenyl)butanal

Drug info:

PubChemData

Smile

CC(CC=O)C1=C(C(=CC(=C1F)OC)OC)F

DOS

IR

Vibrations