Geometry & MOs

Info

ID:	374321
PubChem CID:	131326731
Reduced:	FSO3H7C10 (1)
Stoich.:	ABC3D7E10 (1)
Weight, g/mol:	232.013851
ΔH_f, kcal/mol:	-125.02
Dipole, Da:	6.4
IP(EA), eV:	-8.84(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-2-(2-ethoxy-2-oxoethyl)furan-3-carboxylic acid

Drug info:

PubChemData

Smile

COC1=CSC2=C1C(=C(C=C2)C(=O)O)F

DOS

IR

Vibrations