Geometry & MOs

Info

ID:	48164
PubChem CID:	10537630
Reduced:	FO3H11C13 (1)
Stoich.:	AB3C11D13 (1)
Weight, g/mol:	234.069222
ΔH_f, kcal/mol:	-118.02
Dipole, Da:	3.4
IP(EA), eV:	-9.73(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-[(4-fluorophenyl)methyl]furan-2-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(O1)CC2=CC(=CC=C2)F

DOS

IR

Vibrations