Geometry & MOs

Info

ID:	258420
PubChem CID:	103153651
Reduced:	NO5C15H23 (1)
Stoich.:	AB5C15D23 (1)
Weight, g/mol:	286.072035
ΔH_f, kcal/mol:	-253.38
Dipole, Da:	8.86
IP(EA), eV:	-10.31(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-carbamoyl-5-chloroanilino)-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

COC(CC(=O)O)CN1C(=O)CC2(CCCCC2)CC1=O

DOS

IR

Vibrations