Geometry & MOs

Info

ID:	214085
PubChem CID:	81067249
Reduced:	ClON2C14H23 (1)
Stoich.:	ABC2D14E23 (1)
Weight, g/mol:	296.153621
ΔH_f, kcal/mol:	-50.01
Dipole, Da:	3.32
IP(EA), eV:	-8.59(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(4-fluorophenyl)propan-2-ylcarbamoylamino]-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CCOCCN(C)C1=C(C(=CC=C1)Cl)CC(C)N

DOS

IR

Vibrations