Geometry & MOs

Info

ID:	143548
PubChem CID:	53225739
Reduced:	FSO3H7C12 (1)
Stoich.:	ABC3D7E12 (1)
Weight, g/mol:	250.009993
ΔH_f, kcal/mol:	-103.38
Dipole, Da:	2.26
IP(EA), eV:	-9.64(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-3-(5-formylthiophen-3-yl)benzoic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1F)C(=O)O)C2=CSC(=C2)C=O

DOS

IR

Vibrations