Geometry & MOs

Info

ID:

151093

PubChem CID:

53790791

Reduced:

SO5C22H36 (1)

Stoich.:

AB5C22D36 (1)

Weight, g/mol:

337.073242

ΔHf, kcal/mol:

-271.84

Dipole, Da:

6.88

IP(EA), eV:

 -9.89(-0.58)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-(furan-2-yl)-N-[(6R,7R)-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-7-yl]-2-methoxyiminoacetamide

Drug info:

PubChemData

Smile

CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@](C4)(C)OS(=O)(=O)O)C)C

DOS

IR

Vibrations