Geometry & MOs

Info

ID:	251303
PubChem CID:	103102927
Reduced:	N3O4C10H19 (1)
Stoich.:	A3B4C10D19 (1)
Weight, g/mol:	236.116092
ΔH_f, kcal/mol:	-189.92
Dipole, Da:	5.59
IP(EA), eV:	-9.42(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(2-amino-2-oxoethyl)-ethylamino]methyl]benzoic acid

Drug info:

PubChemData

Smile

CCN(CC(C(=O)OC)NC(=O)C)CC(=O)N

DOS

IR

Vibrations