Geometry & MOs

Info

ID:

215007

PubChem CID:

85083985

Reduced:

SnO4C37H38 (1)

Stoich.:

AB4C37D38 (1)

Weight, g/mol:

665.001477

ΔHf, kcal/mol:

-46.75

Dipole, Da:

3.06

IP(EA), eV:

 -8.98(0.35)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

7-[[2-(2-amino-1,3-thiazol-4-yl)-2-(carboxymethoxyimino)acetyl]amino]-3-[(6,7-dihydroxy-4-oxothiochromen-2-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Drug info:

PubChemData

Smile

COC(=O)C1(CC(C(C1)C=CC[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)CC5=CC=CC=C5)C(=O)OC

DOS

IR

Vibrations