Geometry & MOs

Info

ID:	213387
PubChem CID:	81063590
Reduced:	NO4C14H15 (1)
Stoich.:	AB4C14D15 (1)
Weight, g/mol:	255.092915
ΔH_f, kcal/mol:	-132.71
Dipole, Da:	5.22
IP(EA), eV:	-9.52(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4,5-dimethylthiophene-2-carbonyl)amino]-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CC(CC(=O)O)CNC(=O)C1=CC2=CC=CC=C2O1

DOS

IR

Vibrations