Geometry & MOs

Info

ID:	229526
PubChem CID:	87567939
Reduced:	NSZnO4C11H13 (1)
Stoich.:	ABCD4E11F13 (1)
Weight, g/mol:	408.222014
ΔH_f, kcal/mol:	-105.86
Dipole, Da:	2.85
IP(EA), eV:	-9.37(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[amino-[bis(3-carboxypropyl)amino]amino]-2-methylpropanoic acid;2-(dimethylamino)acetic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1O)O)CC=N[C@@H](CS)C(=O)O.[Zn]

DOS

IR

Vibrations