Geometry & MOs

Info

ID:	252619
PubChem CID:	103112716
Reduced:	N3O4C13H23 (1)
Stoich.:	A3B4C13D23 (1)
Weight, g/mol:	245.137556
ΔH_f, kcal/mol:	-199.66
Dipole, Da:	6.81
IP(EA), eV:	-9.74(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]carbamoylamino]propanoic acid

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NC(=O)N1CCC(C1C(=O)O)C

DOS

IR

Vibrations