Geometry & MOs

Info

ID:	138
PubChem CID:	2172
Reduced:	NO5C8H9 (1)
Stoich.:	AB5C8D9 (1)
Weight, g/mol:	199.048072
ΔH_f, kcal/mol:	-166.65
Dipole, Da:	6.09
IP(EA), eV:	-10.09(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Drug info:

PubChemData

Smile

C1C2N(C1=O)C(C(=CCO)O2)C(=O)O

DOS

IR

Vibrations