Geometry & MOs

Info

ID:	218211
PubChem CID:	85089033
Reduced:	S2N3O6C18H21 (1)
Stoich.:	A2B3C6D18E21 (1)
Weight, g/mol:	439.098411
ΔH_f, kcal/mol:	-198.79
Dipole, Da:	1.75
IP(EA), eV:	-9.47(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[[2-(2-amino-1,3-thiazol-4-yl)-2-cyclobutyloxyiminoacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Drug info:

PubChemData

Smile

CCN(C)C(=O)OCC1=C(N2C(C(C2=O)NC(=O)CC3=CC=CS3)SC1)C(=O)O

DOS

IR

Vibrations