Geometry & MOs

Info

ID:	209257
PubChem CID:	80644645
Reduced:	ClNSO3H10C13 (1)
Stoich.:	ABCD3E10F13 (1)
Weight, g/mol:	244.991342
ΔH_f, kcal/mol:	-87.54
Dipole, Da:	8.3
IP(EA), eV:	-9.33(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-chlorothiophene-2-carbonyl)amino]cyclopropane-1-carboxylic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations