Geometry & MOs

Info

ID:	259097
PubChem CID:	103158207
Reduced:	N2O6C13H22 (1)
Stoich.:	A2B6C13D22 (1)
Weight, g/mol:	216.111007
ΔH_f, kcal/mol:	-278.6
Dipole, Da:	9.72
IP(EA), eV:	-9.66(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-4-(prop-2-enylcarbamoylamino)butanoic acid

Drug info:

PubChemData

Smile

COC(CC(=O)O)CNC(=O)N1CCC(CC1)C(=O)OC

DOS

IR

Vibrations