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Complex #40 — Ru(2) [2a,[Ru(bpy)2p-NPIP]2+]

GT: {"O": 1, "N": 5} → Top-1: {"N": 15}
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)
3
Candidates
{"O": 1, "N": 5}
Ground Truth
{"N": 15}
Top-1 Prediction
0.312
Match Score
⬇ MOL (coordinated) Raw MOL 🔬 3D Viewer Complex detail
⚠ Per-candidate scores unavailable for sequential. Showing 30 candidates from single-ligand scoring. For sequential results only top-1 prediction is stored.
#1 TOP-1 0.85 ± 0.00
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n]5->[Ru+2]<-[n]6cccc(c3[nH]2)c6c45)cc1
#1 TOP-1 0.85 ± 0.00
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n]5->[Ru+2]<-[n]6cccc(c3[nH]2)c6c45)cc1
#1 TOP-1 0.85 ± 0.00
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n]5->[Ru+2]<-[n]6cccc(c3[nH]2)c6c45)cc1
#1 TOP-1 0.85 ± 0.00
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n]5->[Ru+2]<-[n]6cccc(c3[nH]2)c6c45)cc1
#1 TOP-1 0.85 ± 0.00
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n]5->[Ru+2]<-[n]6cccc(c3[nH]2)c6c45)cc1
#1 TOP-1 0.85 ± 0.00
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n]5->[Ru+2]<-[n]6cccc(c3[nH]2)c6c45)cc1
#1 TOP-1 0.85 ± 0.00
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n]5->[Ru+2]<-[n]6cccc(c3[nH]2)c6c45)cc1
#1 TOP-1 0.85 ± 0.00
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n]5->[Ru+2]<-[n]6cccc(c3[nH]2)c6c45)cc1
#1 TOP-1 0.85 ± 0.00
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n]5->[Ru+2]<-[n]6cccc(c3[nH]2)c6c45)cc1
#1 TOP-1 0.88 ± 0.10
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n]5->[Ru+2]<-[n]6cccc(c3[nH]2)c6c45)cc1
#1 TOP-1 0.18 ± 0.41
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n]5->[Ru+2]6(<-[n]7ccccc7-c7cccc[n]->67)<-[n]6cccc(c3[nH]2)c6c45)cc1
#1 TOP-1 0.20 ± 0.44
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n]5->[Ru+2]67(<-[n]8ccccc8-c8cccc[n]->68)(<-[n]6ccccc6-c6cccc[n]->76)<...
#2 0.19 ± 0.00
O=[N+]([O-])c1ccc(-c2[nH]c3c4ccc[n]5->[Ru+2]67(<-[n]8ccccc8-c8cccc[n]->68)<-[n]6cccc(c6c45)c3[n]->72...
#2 0.19 ± 0.00
O=[N+]([O-])c1ccc(-c2[nH]c3c4ccc[n]5->[Ru+2]67(<-[n]8ccccc8-c8cccc[n]->68)<-[n]6cccc(c6c45)c3[n]->72...
#2 0.19 ± 0.00
O=[N+]([O-])c1ccc(-c2[nH]c3c4ccc[n]5->[Ru+2]67(<-[n]8ccccc8-c8cccc[n]->68)<-[n]6cccc(c6c45)c3[n]->72...
#2 0.19 ± 0.00
O=[N+]([O-])c1ccc(-c2[nH]c3c4ccc[n]5->[Ru+2]67(<-[n]8ccccc8-c8cccc[n]->68)<-[n]6cccc(c6c45)c3[n]->72...
#2 0.19 ± 0.00
O=[N+]([O-])c1ccc(-c2[nH]c3c4ccc[n]5->[Ru+2]67(<-[n]8ccccc8-c8cccc[n]->68)<-[n]6cccc(c6c45)c3[n]->72...
#2 0.19 ± 0.00
O=[N+]([O-])c1ccc(-c2[nH]c3c4ccc[n]5->[Ru+2]67(<-[n]8ccccc8-c8cccc[n]->68)<-[n]6cccc(c6c45)c3[n]->72...
#2 0.19 ± 0.00
O=[N+]([O-])c1ccc(-c2[nH]c3c4ccc[n]5->[Ru+2]67(<-[n]8ccccc8-c8cccc[n]->68)<-[n]6cccc(c6c45)c3[n]->72...
#2 0.19 ± 0.00
O=[N+]([O-])c1ccc(-c2[nH]c3c4ccc[n]5->[Ru+2]67(<-[n]8ccccc8-c8cccc[n]->68)<-[n]6cccc(c6c45)c3[n]->72...
#2 0.19 ± 0.00
O=[N+]([O-])c1ccc(-c2[nH]c3c4ccc[n]5->[Ru+2]67(<-[n]8ccccc8-c8cccc[n]->68)<-[n]6cccc(c6c45)c3[n]->72...
#2 0.13 ± 0.11
O=[N+]([O-])c1ccc(-c2[nH]c3c4ccc[n]5->[Ru+2]6<-[n]7cccc(c7c45)c3[n]->62)cc1
#2 0.00 ± 0.00
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n]5->[Ru+]67(<-[cH]8cnc(-c9ccccn9)[cH]->6[cH]->78)<-[n]6cccc(c3[nH]2)c...
#2 0.00 ± 0.00
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n]5->[Ru+]678(<-[cH]9cnc(-c%10ccccn%10)[cH]->6[cH]->79)(<-[n]6ccccc6-c...
#3 0.06 ± 0.00
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n](->[Ru+2]5<-[n]6ccccc6-c6cccc[n]->56)c4c4ncccc4c3[nH]2)cc1
#3 0.06 ± 0.00
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n](->[Ru+2]5<-[n]6ccccc6-c6cccc[n]->56)c4c4ncccc4c3[nH]2)cc1
#3 0.06 ± 0.00
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n](->[Ru+2]5<-[n]6ccccc6-c6cccc[n]->56)c4c4ncccc4c3[nH]2)cc1
#3 0.06 ± 0.00
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n](->[Ru+2]5<-[n]6ccccc6-c6cccc[n]->56)c4c4ncccc4c3[nH]2)cc1
#3 0.06 ± 0.00
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n](->[Ru+2]5<-[n]6ccccc6-c6cccc[n]->56)c4c4ncccc4c3[nH]2)cc1
#3 0.06 ± 0.00
O=[N+]([O-])c1ccc(-c2nc3c4ccc[n](->[Ru+2]5<-[n]6ccccc6-c6cccc[n]->56)c4c4ncccc4c3[nH]2)cc1