Geometry & MOs

Info

ID:	337924
PubChem CID:	127258547
Reduced:	N2O3C10H10 (1)
Stoich.:	A2B3C10D10 (1)
Weight, g/mol:	379.126717
ΔH_f, kcal/mol:	-53.99
Dipole, Da:	4.33
IP(EA), eV:	-8.86(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(3-carboxypropoxy)-3,6-dioxo-1,5-dihydro-2,5-benzoxazocin-4-yl]butanoic acid

Drug info:

PubChemData

Smile

C/C(=N\NC1=CC=CC=C1)/C(=O)C(=O)O

DOS

IR

Vibrations