Geometry & MOs

Info

ID:	374512
PubChem CID:	131330716
Reduced:	ISO3H5C10 (1)
Stoich.:	ABC3D5E10 (1)
Weight, g/mol:	206.020164
ΔH_f, kcal/mol:	-46.55
Dipole, Da:	6.12
IP(EA), eV:	-9.65(-1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-fluorophenyl)thiophene-3-carbaldehyde

Drug info:

PubChemData

Smile

C1=C(C=C2C(=C1C=O)C(=CS2)C(=O)O)I

DOS

IR

Vibrations