Geometry & MOs

Info

ID:	259162
PubChem CID:	103158438
Reduced:	N2O4C11H22 (1)
Stoich.:	A2B4C11D22 (1)
Weight, g/mol:	280.142307
ΔH_f, kcal/mol:	-212.09
Dipole, Da:	3.12
IP(EA), eV:	-9.8(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[ethyl(phenyl)carbamoyl]amino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations