Geometry & MOs

Info

ID:	199172
PubChem CID:	79209361
Reduced:	NSO3C15H15 (1)
Stoich.:	ABC3D15E15 (1)
Weight, g/mol:	294.067428
ΔH_f, kcal/mol:	-94.34
Dipole, Da:	6.93
IP(EA), eV:	-8.93(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(5-acetamidothiophene-2-carbonyl)amino]cyclopent-2-ene-1-carboxylic acid

Drug info:

PubChemData

Smile

C1C(C=CC1NC(=O)C2CC3=CC=CC=C3S2)C(=O)O

DOS

IR

Vibrations