Geometry & MOs

Info

ID:	143745
PubChem CID:	53253414
Reduced:	ClO2H15C17 (1)
Stoich.:	AB2C15D17 (1)
Weight, g/mol:	256.089958
ΔH_f, kcal/mol:	-43.8
Dipole, Da:	1.75
IP(EA), eV:	-9.16(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-fluoro-6-[(E)-2-phenylethenyl]benzoate

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1C(=O)OC)/C=C/C2=CC=CC=C2)Cl

DOS

IR

Vibrations