Geometry & MOs

Info

ID:	264839
PubChem CID:	103496315
Reduced:	NO5C14H17 (1)
Stoich.:	AB5C14D17 (1)
Weight, g/mol:	293.126323
ΔH_f, kcal/mol:	-211.67
Dipole, Da:	4.12
IP(EA), eV:	-9.34(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-methoxycarbonylphenyl)methylamino]-2,3-dimethyl-4-oxobutanoic acid

Drug info:

PubChemData

Smile

CC(C(C)C(=O)O)C(=O)NC1=CC=CC=C1C(=O)OC

DOS

IR

Vibrations