Geometry & MOs

Info

ID:	402126
PubChem CID:	135054513
Reduced:	FO2C12H13 (1)
Stoich.:	AB2C12D13 (1)
Weight, g/mol:	483.209809
ΔH_f, kcal/mol:	-112.22
Dipole, Da:	5.28
IP(EA), eV:	-9.78(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)C/C=C/CCC(=O)O

DOS

IR

Vibrations