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Complex #819 — Ru(2) [7,1]

GT: {"N": 1, "O": 4} → Top-1: {"P": 1}
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)
18
Candidates
{"N": 1, "O": 4}
Ground Truth
{"P": 1}
Top-1 Prediction
0.000
Match Score
⬇ MOL (coordinated) Raw MOL 🔬 3D Viewer Complex detail
#1 TOP-1 1.00 ± 0.00
[Ru+2]<-[P]12CN3CN(CN(C3)C1)C2
#1 TOP-1 1.00 ± 0.00
[Ru+2]<-[P]12CN3CN(CN(C3)C1)C2
#1 TOP-1 1.00 ± 0.00
[Ru+2]<-[P]12CN3CN(CN(C3)C1)C2
#1 TOP-1 1.00 ± 0.00
[Ru+2]<-[P]12CN3CN(CN(C3)C1)C2
#1 TOP-1 1.00 ± 0.00
[Ru+2]<-[P]12CN3CN(CN(C3)C1)C2
#1 TOP-1 1.00 ± 0.00
[Ru+2]<-[P]12CN3CN(CN(C3)C1)C2
#1 TOP-1 1.00 ± 0.00
[Ru+2]<-[P]12CN3CN(CN(C3)C1)C2
#1 TOP-1 1.00 ± 0.00
[Ru+2]<-[P]12CN3CN(CN(C3)C1)C2
#1 TOP-1 1.00 ± 0.00
[Ru+2]<-[P]12CN3CN(CN(C3)C1)C2
#2 0.97 ± 0.00
O=C1[O][Ru][O]C1=O
#2 0.97 ± 0.00
O=C1[O][Ru][O]C1=O
#2 0.97 ± 0.00
O=C1[O][Ru][O]C1=O
#2 0.97 ± 0.00
O=C1[O][Ru][O]C1=O
#2 0.97 ± 0.00
O=C1[O][Ru][O]C1=O
#2 0.97 ± 0.00
O=C1[O][Ru][O]C1=O
#2 0.97 ± 0.00
O=C1[O][Ru][O]C1=O
#2 0.97 ± 0.00
O=C1[O][Ru][O]C1=O
#2 0.97 ± 0.00
O=C1[O][Ru][O]C1=O
#3 0.28 ± 0.00
O=C1[O][Ru+]<-[O-]C1=O
#3 0.28 ± 0.00
O=C1[O][Ru+]<-[O-]C1=O
#3 0.28 ± 0.00
O=C1[O][Ru+]<-[O-]C1=O
#3 0.28 ± 0.00
O=C1[O][Ru+]<-[O-]C1=O
#3 0.28 ± 0.00
O=C1[O][Ru+]<-[O-]C1=O
#3 0.28 ± 0.00
O=C1[O][Ru+]<-[O-]C1=O
#3 0.28 ± 0.00
O=C1[O][Ru+]<-[O-]C1=O
#3 0.28 ± 0.00
O=C1[O][Ru+]<-[O-]C1=O
#3 0.28 ± 0.00
O=C1[O][Ru+]<-[O-]C1=O
#4 0.11 ± 0.00
CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#4 0.11 ± 0.00
CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#4 0.11 ± 0.00
CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#4 0.11 ± 0.00
CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#4 0.11 ± 0.00
CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#4 0.11 ± 0.00
CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#4 0.11 ± 0.00
CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#4 0.11 ± 0.00
CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#4 0.11 ± 0.00
CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62
#5 0.04 ± 0.00
Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12
#5 0.04 ± 0.00
Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12
#5 0.04 ± 0.00
Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12
#5 0.04 ± 0.00
Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12
#5 0.04 ± 0.00
Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12
#5 0.04 ± 0.00
Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12
#5 0.04 ± 0.00
Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12
#5 0.04 ± 0.00
Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12
#5 0.04 ± 0.00
Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12
#6 0.03 ± 0.00
C1N2C[N]34->[Ru+2]<-[P](C2)(CN1C3)C4
#6 0.03 ± 0.00
C1N2C[N]34->[Ru+2]<-[P](C2)(CN1C3)C4
#6 0.03 ± 0.00
C1N2C[N]34->[Ru+2]<-[P](C2)(CN1C3)C4
#6 0.03 ± 0.00
C1N2C[N]34->[Ru+2]<-[P](C2)(CN1C3)C4
#6 0.03 ± 0.00
C1N2C[N]34->[Ru+2]<-[P](C2)(CN1C3)C4
#6 0.03 ± 0.00
C1N2C[N]34->[Ru+2]<-[P](C2)(CN1C3)C4
#6 0.03 ± 0.00
C1N2C[N]34->[Ru+2]<-[P](C2)(CN1C3)C4
#6 0.03 ± 0.00
C1N2C[N]34->[Ru+2]<-[P](C2)(CN1C3)C4
#6 0.03 ± 0.00
C1N2C[N]34->[Ru+2]<-[P](C2)(CN1C3)C4
#7 0.02 ± 0.00
O=C([O-])C(=O)[O][Ru+]
#7 0.02 ± 0.00
O=C([O-])C(=O)[O][Ru+]
#7 0.02 ± 0.00
O=C([O-])C(=O)[O][Ru+]
#7 0.02 ± 0.00
O=C([O-])C(=O)[O][Ru+]
#7 0.02 ± 0.00
O=C([O-])C(=O)[O][Ru+]
#7 0.02 ± 0.00
O=C([O-])C(=O)[O][Ru+]
#7 0.02 ± 0.00
O=C([O-])C(=O)[O][Ru+]
#7 0.02 ± 0.00
O=C([O-])C(=O)[O][Ru+]
#7 0.02 ± 0.00
O=C([O-])C(=O)[O][Ru+]
#8 0.02 ± 0.00
[Ru+2]<-[N]12CN3CN(CP(C3)C1)C2
#8 0.02 ± 0.00
[Ru+2]<-[N]12CN3CN(CP(C3)C1)C2
#8 0.02 ± 0.00
[Ru+2]<-[N]12CN3CN(CP(C3)C1)C2
#8 0.02 ± 0.00
[Ru+2]<-[N]12CN3CN(CP(C3)C1)C2
#8 0.02 ± 0.00
[Ru+2]<-[N]12CN3CN(CP(C3)C1)C2
#8 0.02 ± 0.00
[Ru+2]<-[N]12CN3CN(CP(C3)C1)C2
#8 0.02 ± 0.00
[Ru+2]<-[N]12CN3CN(CP(C3)C1)C2
#8 0.02 ± 0.00
[Ru+2]<-[N]12CN3CN(CP(C3)C1)C2
#8 0.02 ± 0.00
[Ru+2]<-[N]12CN3CN(CP(C3)C1)C2
#9 0.01 ± 0.00
C1P2C[N]34->[Ru+2]5<-[N]1(C3)C[N]->5(C2)C4
#9 0.01 ± 0.00
C1P2C[N]34->[Ru+2]5<-[N]1(C3)C[N]->5(C2)C4
#9 0.01 ± 0.00
C1P2C[N]34->[Ru+2]5<-[N]1(C3)C[N]->5(C2)C4
#9 0.01 ± 0.00
C1P2C[N]34->[Ru+2]5<-[N]1(C3)C[N]->5(C2)C4
#9 0.01 ± 0.00
C1P2C[N]34->[Ru+2]5<-[N]1(C3)C[N]->5(C2)C4
#9 0.01 ± 0.00
C1P2C[N]34->[Ru+2]5<-[N]1(C3)C[N]->5(C2)C4
#9 0.01 ± 0.00
C1P2C[N]34->[Ru+2]5<-[N]1(C3)C[N]->5(C2)C4
#9 0.01 ± 0.00
C1P2C[N]34->[Ru+2]5<-[N]1(C3)C[N]->5(C2)C4
#9 0.01 ± 0.00
C1P2C[N]34->[Ru+2]5<-[N]1(C3)C[N]->5(C2)C4
#10 0.00 ± 0.00
O=C([O-])C1[O][Ru+]<-[O]=1
#10 0.00 ± 0.00
O=C([O-])C1[O][Ru+]<-[O]=1
#10 0.00 ± 0.00
O=C([O-])C1[O][Ru+]<-[O]=1
#10 0.00 ± 0.00
O=C([O-])C1[O][Ru+]<-[O]=1
#10 0.00 ± 0.00
O=C([O-])C1[O][Ru+]<-[O]=1
#10 0.00 ± 0.00
O=C([O-])C1[O][Ru+]<-[O]=1
#10 0.00 ± 0.00
O=C([O-])C1[O][Ru+]<-[O]=1
#10 0.00 ± 0.00
O=C([O-])C1[O][Ru+]<-[O]=1
#10 0.00 ± 0.00
O=C([O-])C1[O][Ru+]<-[O]=1
#11 0.00 ± 0.00
O=C([O-])C(=O)[O-]->[Ru+2]
#11 0.00 ± 0.00
O=C([O-])C(=O)[O-]->[Ru+2]
#11 0.00 ± 0.00
O=C([O-])C(=O)[O-]->[Ru+2]
#11 0.00 ± 0.00
O=C([O-])C(=O)[O-]->[Ru+2]
#11 0.00 ± 0.00
O=C([O-])C(=O)[O-]->[Ru+2]
#11 0.00 ± 0.00
O=C([O-])C(=O)[O-]->[Ru+2]
#11 0.00 ± 0.00
O=C([O-])C(=O)[O-]->[Ru+2]
#11 0.00 ± 0.00
O=C([O-])C(=O)[O-]->[Ru+2]
#11 0.00 ± 0.00
O=C([O-])C(=O)[O-]->[Ru+2]
#12 0.00 ± 0.00
C1N2C[N]34->[Ru+2]<-[N](C2)(CP1C3)C4
#12 0.00 ± 0.00
C1N2C[N]34->[Ru+2]<-[N](C2)(CP1C3)C4
#12 0.00 ± 0.00
C1N2C[N]34->[Ru+2]<-[N](C2)(CP1C3)C4
#12 0.00 ± 0.00
C1N2C[N]34->[Ru+2]<-[N](C2)(CP1C3)C4
#12 0.00 ± 0.00
C1N2C[N]34->[Ru+2]<-[N](C2)(CP1C3)C4
#12 0.00 ± 0.00
C1N2C[N]34->[Ru+2]<-[N](C2)(CP1C3)C4
#12 0.00 ± 0.00
C1N2C[N]34->[Ru+2]<-[N](C2)(CP1C3)C4
#12 0.00 ± 0.00
C1N2C[N]34->[Ru+2]<-[N](C2)(CP1C3)C4
#12 0.00 ± 0.00
C1N2C[N]34->[Ru+2]<-[N](C2)(CP1C3)C4
#13 0.00 ± 0.00
O=C1[O][Ru+]<-[O]=C1[O-]
#13 0.00 ± 0.00
O=C1[O][Ru+]<-[O]=C1[O-]
#13 0.00 ± 0.00
O=C1[O][Ru+]<-[O]=C1[O-]
#13 0.00 ± 0.00
O=C1[O][Ru+]<-[O]=C1[O-]
#13 0.00 ± 0.00
O=C1[O][Ru+]<-[O]=C1[O-]
#13 0.00 ± 0.00
O=C1[O][Ru+]<-[O]=C1[O-]
#13 0.00 ± 0.00
O=C1[O][Ru+]<-[O]=C1[O-]
#13 0.00 ± 0.00
O=C1[O][Ru+]<-[O]=C1[O-]
#13 0.00 ± 0.00
O=C1[O][Ru+]<-[O]=C1[O-]
#14 0.00 ± 0.00
Cc1ccc(C(C)C)[cH](->[Ru+2])c1
#14 0.00 ± 0.00
Cc1ccc(C(C)C)[cH](->[Ru+2])c1
#14 0.00 ± 0.00
Cc1ccc(C(C)C)[cH](->[Ru+2])c1
#14 0.00 ± 0.00
Cc1ccc(C(C)C)[cH](->[Ru+2])c1
#14 0.00 ± 0.00
Cc1ccc(C(C)C)[cH](->[Ru+2])c1
#14 0.00 ± 0.00
Cc1ccc(C(C)C)[cH](->[Ru+2])c1
#14 0.00 ± 0.00
Cc1ccc(C(C)C)[cH](->[Ru+2])c1
#14 0.00 ± 0.00
Cc1ccc(C(C)C)[cH](->[Ru+2])c1
#14 0.00 ± 0.00
Cc1ccc(C(C)C)[cH](->[Ru+2])c1
#15 0.00 ± 0.00
Cc1ccc(C(C)C)c[cH]1->[Ru+2]
#15 0.00 ± 0.00
Cc1ccc(C(C)C)c[cH]1->[Ru+2]
#15 0.00 ± 0.00
Cc1ccc(C(C)C)c[cH]1->[Ru+2]
#15 0.00 ± 0.00
Cc1ccc(C(C)C)c[cH]1->[Ru+2]
#15 0.00 ± 0.00
Cc1ccc(C(C)C)c[cH]1->[Ru+2]
#15 0.00 ± 0.00
Cc1ccc(C(C)C)c[cH]1->[Ru+2]
#15 0.00 ± 0.00
Cc1ccc(C(C)C)c[cH]1->[Ru+2]
#15 0.00 ± 0.00
Cc1ccc(C(C)C)c[cH]1->[Ru+2]
#15 0.00 ± 0.00
Cc1ccc(C(C)C)c[cH]1->[Ru+2]
#16 0.00 ± 0.00
O=C([O-])C([O-])=[O]->[Ru+2]
#16 0.00 ± 0.00
O=C([O-])C([O-])=[O]->[Ru+2]
#16 0.00 ± 0.00
O=C([O-])C([O-])=[O]->[Ru+2]
#16 0.00 ± 0.00
O=C([O-])C([O-])=[O]->[Ru+2]
#16 0.00 ± 0.00
O=C([O-])C([O-])=[O]->[Ru+2]
#16 0.00 ± 0.00
O=C([O-])C([O-])=[O]->[Ru+2]
#16 0.00 ± 0.00
O=C([O-])C([O-])=[O]->[Ru+2]
#16 0.00 ± 0.00
O=C([O-])C([O-])=[O]->[Ru+2]
#16 0.00 ± 0.00
O=C([O-])C([O-])=[O]->[Ru+2]
#17 0.00 ± 0.00
[O-]C1=[O]->[Ru+2]<-[O]=C1[O-]
#17 0.00 ± 0.00
[O-]C1=[O]->[Ru+2]<-[O]=C1[O-]
#17 0.00 ± 0.00
[O-]C1=[O]->[Ru+2]<-[O]=C1[O-]
#17 0.00 ± 0.00
[O-]C1=[O]->[Ru+2]<-[O]=C1[O-]
#17 0.00 ± 0.00
[O-]C1=[O]->[Ru+2]<-[O]=C1[O-]
#17 0.00 ± 0.00
[O-]C1=[O]->[Ru+2]<-[O]=C1[O-]
#17 0.00 ± 0.00
[O-]C1=[O]->[Ru+2]<-[O]=C1[O-]
#17 0.00 ± 0.00
[O-]C1=[O]->[Ru+2]<-[O]=C1[O-]
#17 0.00 ± 0.00
[O-]C1=[O]->[Ru+2]<-[O]=C1[O-]