Geometry & MOs

Info

ID:	251379
PubChem CID:	103103543
Reduced:	N3O5C13H17 (1)
Stoich.:	A3B5C13D17 (1)
Weight, g/mol:	269.137556
ΔH_f, kcal/mol:	-189.01
Dipole, Da:	2.42
IP(EA), eV:	-9.38(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[(2-amino-2-oxoethyl)-ethylcarbamoyl]-7-azabicyclo[2.2.1]heptane-2-carboxylic acid

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C(=O)NC1=CC=CC=C1OCC(=O)O

DOS

IR

Vibrations