Geometry & MOs

Info

ID:	14744
PubChem CID:	419366
Reduced:	O3N4C9H20 (1)
Stoich.:	A3B4C9D20 (1)
Weight, g/mol:	232.153541
ΔH_f, kcal/mol:	-137.1
Dipole, Da:	2.96
IP(EA), eV:	-9.1(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-amino-2-[2-(dimethylamino)ethylamino]-2-oxoethyl] 2-aminopropanoate

Drug info:

PubChemData

Smile

CC(C(=O)OC(C(=O)NCCN(C)C)N)N

DOS

IR

Vibrations