Geometry & MOs

Info

ID:	20159
PubChem CID:	580491
Reduced:	O2H5C6 (2)
Stoich.:	A2B5C6 (2)
Weight, g/mol:	218.057909
ΔH_f, kcal/mol:	-97.91
Dipole, Da:	5.93
IP(EA), eV:	-9.27(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(phenoxymethyl)furan-2-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)O

DOS

IR

Vibrations