Geometry & MOs

Info

ID:	259171
PubChem CID:	103158474
Reduced:	NO2C7H10 (2)
Stoich.:	AB2C7D10 (2)
Weight, g/mol:	284.117235
ΔH_f, kcal/mol:	-172.54
Dipole, Da:	3.46
IP(EA), eV:	-8.76(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3-fluoro-4-methylphenyl)carbamoylamino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NC(=O)NCC(CC(=O)O)OC

DOS

IR

Vibrations