Geometry & MOs

Info

ID:	213413
PubChem CID:	81063633
Reduced:	SN3O4C11H15 (1)
Stoich.:	AB3C4D11E15 (1)
Weight, g/mol:	217.131408
ΔH_f, kcal/mol:	-151.25
Dipole, Da:	8.52
IP(EA), eV:	-9.52(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-methoxybutanoylamino)-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CC(CC(=O)O)CNC(=O)C1=CSC(=N1)NC(=O)C

DOS

IR

Vibrations