Geometry & MOs

Info

ID:	340997
PubChem CID:	127263432
Reduced:	N2Na2O5C11H14 (1)
Stoich.:	A2B2C5D11E14 (1)
Weight, g/mol:	236.068473
ΔH_f, kcal/mol:	-329.2
Dipole, Da:	8.89
IP(EA), eV:	-9.26(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 9,10-dihydroxy-11-oxatricyclo[6.2.1.02,7]undeca-2,4,6-triene-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OCCN1C=NC(=C1C(=O)[O-])C(=O)[O-].[Na+].[Na+]

DOS

IR

Vibrations