Geometry & MOs

Info

ID:	407941
PubChem CID:	135080696
Reduced:	O2C5H7 (2)
Stoich.:	A2B5C7 (2)
Weight, g/mol:	230.01837
ΔH_f, kcal/mol:	-146.0
Dipole, Da:	3.21
IP(EA), eV:	-10.63(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-amino-5-carbamothioylthiophene-3-carboxylate

Drug info:

PubChemData

Smile

CC[C@H]1C=C([C@@H]1C(=O)OC)C(=O)OC

DOS

IR

Vibrations