Geometry & MOs

Info

ID:	209259
PubChem CID:	80644647
Reduced:	ClN2S2O3H9C11 (1)
Stoich.:	AB2C2D3E9F11 (1)
Weight, g/mol:	289.017557
ΔH_f, kcal/mol:	-70.32
Dipole, Da:	8.92
IP(EA), eV:	-9.61(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[(3-chlorothiophene-2-carbonyl)amino]methyl]oxolane-2-carboxylic acid

Drug info:

PubChemData

Smile

CC(C1=NC(=CS1)C(=O)O)NC(=O)C2=C(C=CS2)Cl

DOS

IR

Vibrations