Geometry & MOs

Info

ID:	176773
PubChem CID:	76097162
Reduced:	PC5O7H11 (1)
Stoich.:	AB5C7D11 (1)
Weight, g/mol:	540.073319
ΔH_f, kcal/mol:	-342.03
Dipole, Da:	1.18
IP(EA), eV:	-10.45(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[[2-(2-amino-2-oxoethoxy)imino-2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]-8-oxo-3-(3-oxobutanoyloxymethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Drug info:

PubChemData

Smile

C(C(C(C(=O)CO)OP(O)O)O)O

DOS

IR

Vibrations