Geometry & MOs

Info

ID:	227391
PubChem CID:	87561621
Reduced:	OC5H6 (3)
Stoich.:	AB5C6 (3)
Weight, g/mol:	158.999014
ΔH_f, kcal/mol:	-30.85
Dipole, Da:	4.05
IP(EA), eV:	-9.03(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(hydroxyamino)thiophene-2-carboxylic acid

Drug info:

PubChemData

Smile

CC(CC1=CC2=C(C=C1)OOCCC2)C(=O)C=C

DOS

IR

Vibrations