Geometry & MOs

Info

ID:	1611
PubChem CID:	4769
Reduced:	KSN2O5C16H17 (1)
Stoich.:	ABC2D5E16F17 (1)
Weight, g/mol:	388.049524
ΔH_f, kcal/mol:	-212.15
Dipole, Da:	6.96
IP(EA), eV:	-8.71(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

potassium;3,3-dimethyl-7-oxo-6-[(2-phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Drug info:

PubChemData

Smile

CC1(C(N2C(S1)C(C2=O)NC(=O)COC3=CC=CC=C3)C(=O)[O-])C.[K+]

DOS

IR

Vibrations