Geometry & MOs

Info

ID:	45355
PubChem CID:	10511872
Reduced:	OF2C10H16 (1)
Stoich.:	AB2C10D16 (1)
Weight, g/mol:	190.09938
ΔH_f, kcal/mol:	-172.92
Dipole, Da:	5.18
IP(EA), eV:	-10.23(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-6-phenylhex-2-enoic acid

Drug info:

PubChemData

Smile

CC(C)(C)C1CCC(=O)C(C1)(F)F

DOS

IR

Vibrations