Geometry & MOs

Info

ID:	258886
PubChem CID:	103157342
Reduced:	N2O4C11H22 (1)
Stoich.:	A2B4C11D22 (1)
Weight, g/mol:	230.126657
ΔH_f, kcal/mol:	-205.67
Dipole, Da:	4.45
IP(EA), eV:	-9.95(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-4-[[2-(prop-2-enylamino)acetyl]amino]butanoic acid

Drug info:

PubChemData

Smile

CCC(C)[C@@H](C(=O)NCC(CC(=O)O)OC)N

DOS

IR

Vibrations