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Complex #25 — Ru(2) [2 · Cl]

GT: {"N": 3, "P": 1} → Top-1: {"P": 1}
rdmetallics.net (363)Sequential multi-lig (7058)Single-ligand (939)
15
Candidates
{"N": 3, "P": 1}
Ground Truth
{"P": 1}
Top-1 Prediction
0.970
Match Score
#1 TOP-1 0.97 ± 0.04
CN1CN2CN(C1)C[P](C)(->[Ru+2])C2
#1 TOP-1 0.36 ± 0.34
CN1CN2CN(C1)C[P](C)(->[Ru+2]134[CH]5C=C[CH]1[CH]3[CH]54)C2
#2 0.21 ± 0.25
C[N]12->[Ru+2]<-[P]3(C)CN(CN(C1)C3)C2
#2 0.17 ± 0.24
CN1CN2CN(C1)C[P](C)(->[Ru+2]1[CH]3C=CC=C[CH]31)C2
#3 0.03 ± 0.04
CN1CN2C[N]3(->[Ru+2]<-[P](C)(C2)C3)C1
#3 0.07 ± 0.07
CN1CN2CN(C1)C[P](C)(->[Ru+2]13456<-[cH]7[cH]->1[cH]->3[cH]->4[cH]->5[cH]->67)C2
#4 0.01 ± 0.01
CP1C[N]23->[Ru+2]4<-[N](C)(C2)C[N]->4(C1)C3
#4 0.01 ± 0.02
CN1CN2CN(C1)C[P](C)(->[Ru+]13<-[cH]4ccc[cH]->1[cH]->34)C2
#5 0.00 ± 0.00
CN1CN2CP(C)C[N](->[Ru+2])(C1)C2
#5 0.01 ± 0.01
CN1CN2CN(C1)C[P](C)(->[Ru+2]134<-[cH]5cc[cH]->1[cH]->3[cH]->45)C2
#6 0.00 ± 0.00
CP1CN2CN(C1)C[N](C)(->[Ru+2])C2
#6 0.00 ± 0.01
CN1CN2CN(C1)C[P](C)(->[Ru+2]1<-[cH]3cccc[cH]->13)C2
#7 0.00 ± 0.00
CP1CN2C[N]3(C)->[Ru+2]<-[N](C2)(C1)C3
#7 0.00 ± 0.00
CN1CN2CN(C1)C[P](C)(->[Ru+2]<-[cH]1ccccc1)C2
#8 0.00 ± 0.00
CN1C[N]23->[Ru+2]<-[N](C1)(CP(C)C2)C3