Geometry & MOs

Info

ID:	339527
PubChem CID:	127261517
Reduced:	N3O3C6H11 (1)
Stoich.:	A3B3C6D11 (1)
Weight, g/mol:	247.116821
ΔH_f, kcal/mol:	-99.55
Dipole, Da:	5.16
IP(EA), eV:	-9.31(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,6S)-2,6-diamino-7-(carboxymethylamino)-7-oxoheptanoic acid

Drug info:

PubChemData

Smile

CC(=O)N/N=C/N(C)CC(=O)O

DOS

IR

Vibrations