Geometry & MOs

Info

ID:	293838
PubChem CID:	117404546
Reduced:	FSO4C11H13 (1)
Stoich.:	ABC4D11E13 (1)
Weight, g/mol:	260.104859
ΔH_f, kcal/mol:	-192.98
Dipole, Da:	7.89
IP(EA), eV:	-9.24(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(7-methoxy-1-benzofuran-4-yl)cyclopentane-1-carboxylic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations