I07: {6-[(3-methoxyphenyl)methyl]-4-methyl-5-oxo-5,6-dihydro-4H-thieno[2',3':4,5]pyrrolo[2,3-d]pyridazin-2-yl}(methyl)sulfaniumolate

I07 is a Ligand Of Interest in 8TBT designated by the Author


Best-fitted instance in this entry
Other instances in this entry
IdentifierRanking for goodness of fit Ranking for geometry Real space R factor Real space correlation coefficient RMSZ-bond-length RMSZ-bond-angleOutliers of bond length Outliers of bond angle Atomic clashesStereochemical errorsModel completenessAverage occupancy
8TBT_I07_B_601 62% 3% 0.165 0.9573.82 2.43 6 900100%0.476
8TBT_I07_D_601 58% 3% 0.182 0.9613.8 2.29 6 700100%0.528