Geometry & MOs

Info

ID:	288428
PubChem CID:	104316527
Reduced:	NO4C10H13 (1)
Stoich.:	AB4C10D13 (1)
Weight, g/mol:	230.06128
ΔH_f, kcal/mol:	-147.83
Dipole, Da:	6.38
IP(EA), eV:	-9.64(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-hydroxybutoxy)-5-methylthiophene-2-carboxylic acid

Drug info:

PubChemData

Smile

CC(CCOC1=C(N=CC=C1)C(=O)O)O

DOS

IR

Vibrations