Geometry & MOs

Info

ID:	292864
PubChem CID:	117362111
Reduced:	F2O3C12H14 (1)
Stoich.:	A2B3C12D14 (1)
Weight, g/mol:	244.091101
ΔH_f, kcal/mol:	-219.71
Dipole, Da:	3.41
IP(EA), eV:	-9.21(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(CC1=C(C=C(C=C1)C(F)F)OC)C(=O)O

DOS

IR

Vibrations