Geometry & MOs

Info

ID:	206994
PubChem CID:	80329814
Reduced:	ClFNSO2H9C12 (1)
Stoich.:	ABCDE2F9G12 (1)
Weight, g/mol:	201.045964
ΔH_f, kcal/mol:	-82.94
Dipole, Da:	4.31
IP(EA), eV:	-8.9(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-hydroxyethylamino)methyl]thiophene-3-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1F)Cl)NCC2=CC(=CS2)C(=O)O

DOS

IR

Vibrations