Geometry & MOs

Info

ID:	217308
PubChem CID:	85087594
Reduced:	NO6H13C19 (1)
Stoich.:	AB6C13D19 (1)
Weight, g/mol:	351.179421
ΔH_f, kcal/mol:	-154.56
Dipole, Da:	6.4
IP(EA), eV:	-9.72(-1.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-amino-6-[(4-ethoxybenzoyl)amino]hexanoyl]amino]acetic acid

Drug info:

PubChemData

Smile

CC(=O)OC1=C(C=CC(=C1)C=C2C(=O)OC(=N2)C3=CC=CC=C3)C(=O)O

DOS

IR

Vibrations