Geometry & MOs

Info

ID:	168711
PubChem CID:	75006618
Reduced:	KN2O4C15H15 (1)
Stoich.:	AB2C4D15E15 (1)
Weight, g/mol:	288.111007
ΔH_f, kcal/mol:	-116.56
Dipole, Da:	16.21
IP(EA), eV:	-8.64(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(1-hydroxyethyl)-4-methyl-7-oxo-3-pyridin-3-yl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Drug info:

PubChemData

Smile

CC1C2C(C(=O)N2C(=C1C3=CN=CC=C3)C(=O)[O-])C(C)O.[K+]

DOS

IR

Vibrations