Geometry & MOs

Info

ID:	259175
PubChem CID:	103158486
Reduced:	ON3C15H27 (1)
Stoich.:	AB3C15D27 (1)
Weight, g/mol:	280.142307
ΔH_f, kcal/mol:	-44.59
Dipole, Da:	2.78
IP(EA), eV:	-8.75(1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3-ethylphenyl)carbamoylamino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

CC(C#N)N1CCN(CC1)CC(CC2CCCC2)O

DOS

IR

Vibrations