Geometry & MOs

Info

ID:	147597
PubChem CID:	53787253
Reduced:	FO5C26H41 (1)
Stoich.:	AB5C26D41 (1)
Weight, g/mol:	379.069888
ΔH_f, kcal/mol:	-329.76
Dipole, Da:	3.97
IP(EA), eV:	-9.27(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6S)-3-(azidomethyl)-7-[[2-(3-methyl-1,2,4-oxadiazol-5-yl)acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Drug info:

PubChemData

Smile

CCCCC(C(=O)CCC1C(CC2C1CC(=CCCCC(=O)O)C2)OC3CCCCO3)F

DOS

IR

Vibrations