Geometry & MOs

Info

ID:	259163
PubChem CID:	103158443
Reduced:	NO2C7H10 (2)
Stoich.:	AB2C7D10 (2)
Weight, g/mol:	280.142307
ΔH_f, kcal/mol:	-163.87
Dipole, Da:	2.48
IP(EA), eV:	-8.83(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3,4-dimethylphenyl)carbamoylamino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

CCN(C1=CC=CC=C1)C(=O)NCC(CC(=O)O)OC

DOS

IR

Vibrations