Geometry & MOs

Info

ID:	183189
PubChem CID:	76989944
Reduced:	NO6C14H15 (1)
Stoich.:	AB6C14D15 (1)
Weight, g/mol:	288.132136
ΔH_f, kcal/mol:	-231.52
Dipole, Da:	5.38
IP(EA), eV:	-9.42(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(2,2-dimethylpropanoylamino)acetyl]amino]-4-methoxy-4-oxobutanoic acid

Drug info:

PubChemData

Smile

COC(=O)CC(C(=O)O)NC(=O)C1CC2=CC=CC=C2O1

DOS

IR

Vibrations