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Ir C^N families
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D-MPNN
Coordination Complexes
9414 complexes in database
9414
Total
4834
Ru
2220
Au
1431
Ir
339
Rh
337
Os
253
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#714
Ru(3)
donors: {"O": 1}
C[C@@H]1CC[C@@]2(OC1)O[C@H]1C[C@H]3[C@@H]4CC=C5C[C@@H]([O-])CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C.Cc1ccc(C(C)C)cc1.[C...
2 meas.
MOL
3D
#713
Ru(3)
donors: {"O": 1}
C[C@@H]1CC[C@@]2(OC1)O[C@H]1C[C@H]3[C@@H]4CC=C5C[C@@H]([O-])CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C.[Cl-].[Cl-].c1ccccc...
2 meas.
MOL
3D
#712
Ru(2)
donors: {"N": 4}
C(=N/N=C/c1ccc2ccccc2n1)\c1ccc2ccccc2n1.Cc1ccc(C(C)C)cc1.[Cl-]
4 meas.
MOL
3D
#711
Ru(2)
donors: {"P": 2, "N": 2}
C(=C\P(c1ccccc1)c1ccccc1)\P(c1ccccc1)c1ccccc1.[Cl-].[Cl-].c1ccc(-c2ccccn2)nc1
3 meas.
MOL
3D
#710
Ru(2)
donors: {"P": 2, "S": 1, "N": 4}
C(=C\P(c1ccccc1)c1ccccc1)\P(c1ccccc1)c1ccccc1.[S-]c1ncccn1.c1ccc(-c2ccccn2)nc1
3 meas.
MOL
3D
#709
Ru(2)
donors: {"P": 2, "S": 1, "N": 3}
C(=C\P(c1ccccc1)c1ccccc1)\P(c1ccccc1)c1ccccc1.[S-]c1ccccn1.c1ccc(-c2ccccn2)nc1
3 meas.
MOL
3D
#708
Ru(2)
donors: {"N": 6}
Cc1ccnc(-c2cc(/C=C/C(=O)c3ccc4ccccc4c3)ccn2)c1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
2 meas.
MOL
3D
#707
Ru(2)
donors: {"O": 1, "N": 4}
O=C([O-])C(=O)[O-].c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1
2 meas.
MOL
3D
#706
Ru(2)
donors: {"O": 1, "N": 4}
O=C([O-])C(=O)[O-].c1cnc2c(c1)c1nccnc1c1cccnc12.c1cnc2c(c1)c1nccnc1c1cccnc12
2 meas.
MOL
3D
#705
Ru(2)
donors: {"O": 2, "N": 4}
O=C([O-])C(=O)[O-].c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12
5 meas.
MOL
3D
#704
Ru(2)
donors: {"O": 1, "N": 2, "P": 4}
[O-]c1ncc(F)c(O)n1.c1ccc(P(CCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1.c1ccc(P(CCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
1 meas.
MOL
3D
#703
Ru(2)
donors: {"P": 4}
[Cl-].[Cl-].c1ccc(P(CCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1.c1ccc(P(CCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
9 meas.
MOL
3D
#702
Ru(3)
donors: {"N": 5, "O": 3}
CCOC(=O)c1cccnc1.CCOC(=O)c1cccnc1.O=N[O-].O=N[O-].[N]=O.[OH-]
1 meas.
MOL
3D
#701
Ru(3)
donors: {"N": 5, "O": 3}
COC(=O)c1cccnc1.COC(=O)c1cccnc1.O=N[O-].O=N[O-].[N]=O.[OH-]
1 meas.
MOL
3D
#700
Ru(3)
donors: {"N": 5, "O": 3}
CCOC(=O)c1ccncc1.CCOC(=O)c1ccncc1.O=N[O-].O=N[O-].[N]=O.[OH-]
1 meas.
MOL
3D
#699
Ru(3)
donors: {"N": 5, "O": 3}
COC(=O)c1ccncc1.COC(=O)c1ccncc1.O=N[O-].O=N[O-].[N]=O.[OH-]
1 meas.
MOL
3D
#698
Ru(2)
donors: {"S": 4, "O": 4}
CS(C)=O.CS(C)=O.CS(C)=O.CS(C)=O.[Cl-].[Cl-]
2 meas.
MOL
3D
#697
Ru(2)
donors: {"S": 2, "O": 2, "N": 1}
CS(C)=O.CS(C)=O.O=c1oc2ccc3ccccc3c2cc1-c1ccccn1.[Cl-].[Cl-]
2 meas.
MOL
3D
#696
Ru(2)
donors: {"N": 1, "S": 2, "O": 2}
COc1ccc2cc(-c3ccccn3)c(=O)oc2c1.CS(C)=O.CS(C)=O.[Cl-].[Cl-]
2 meas.
MOL
3D
#695
Ru(2)
donors: {"S": 2, "O": 2, "N": 1}
CS(C)=O.CS(C)=O.Cc1cccc2cc(-c3ccccn3)c(=O)oc12.[Cl-].[Cl-]
2 meas.
MOL
3D
#694
Ru(2)
donors: {"S": 2, "O": 2, "N": 1}
CS(C)=O.CS(C)=O.O=c1oc2ccccc2cc1-c1ccccn1.[Cl-].[Cl-]
2 meas.
MOL
3D
#693
Ru(2)
donors: {"N": 1}
CC(C)(C)c1ccc(C[n+]2[c-]n(Cc3c4ccccc4cc4ccccc34)c3ccccc32)cc1.Cc1ccc(C(C)C)cc1.[Cl-].[Cl-]
2 meas.
MOL
3D
#692
Ru(2)
donors: {"N": 1}
Cc1ccc(C(C)C)cc1.Cc1ccc(C[n+]2[c-]n(Cc3c4ccccc4cc4ccccc34)c3ccccc32)cc1.[Cl-].[Cl-]
2 meas.
MOL
3D
#691
Ru(2)
donors: {"N": 4}
COc1ccc2oc(=O)cc(Cn3cc(-c4ccccn4)nn3)c2c1.Cc1ccc(C(C)C)cc1.[Cl-]
5 meas.
MOL
3D
#690
Ru(2)
donors: {"N": 4}
Cc1ccc(C(C)C)cc1.O=c1cc(Cn2cc(-c3ccccn3)nn2)c2cc(O)ccc2o1.[Cl-]
5 meas.
MOL
3D
#689
Ru(2)
donors: {"N": 4}
Cc1ccc(C(C)C)cc1.Cc1ccc2c(Cn3cc(-c4ccccn4)nn3)cc(=O)oc2c1.[Cl-]
5 meas.
MOL
3D
#688
Ru(2)
donors: {"N": 4}
COc1ccc2c(Cn3cc(-c4ccccn4)nn3)cc(=O)oc2c1.Cc1ccc(C(C)C)cc1.[Cl-]
5 meas.
MOL
3D
#687
Ru(2)
donors: {"N": 4}
Cc1ccc(C(C)C)cc1.O=c1cc(Cn2cc(-c3ccccn3)nn2)c2ccc(O)cc2o1.[Cl-]
5 meas.
MOL
3D
#686
Ru(2)
donors: {"N": 4}
Cc1ccc(C(C)C)cc1.O=c1cc(-n2cc(-c3ccccn3)nn2)c2ccccc2o1.[Cl-]
5 meas.
MOL
3D
#685
Ru(2)
donors: {"N": 8}
Clc1ccc2c(NCCC/N=C/c3ccc4ccccc4n3)ccnc2c1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
1 meas.
MOL
3D
#684
Ru(2)
donors: {"N": 8}
Clc1ccc2c(NCCC/N=C/c3ccccn3)ccnc2c1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
1 meas.
MOL
3D
#683
Ru(2)
donors: {"S": 2, "N": 1}
CC(=O)[S-].CC(C)c1cccc(C(C)C)c1N1CC[N+](c2c(C(C)C)cccc2C(C)C)=C1C(=S)[S-].Cc1ccc(C(C)C)cc1
2 meas.
MOL
3D
#682
Ru(2)
donors: {"S": 2, "N": 1}
CC(=O)[S-].Cc1cc(C)c(N2CC[N+](c3c(C)cc(C)cc3C)=C2C(=S)[S-])c(C)c1.Cc1ccc(C(C)C)cc1
2 meas.
MOL
3D
#681
Ru(2)
donors: {"S": 2, "N": 1}
CC(=O)[S-].Cc1ccc(C(C)C)cc1.S=C([S-])c1n(C2CCCCC2)cc[n+]1C1CCCCC1
2 meas.
MOL
3D
#680
Ru(2)
donors: {"S": 2, "N": 1}
CC(=O)[S-].CC(C)c1cccc(C(C)C)c1-n1cc[n+](-c2c(C(C)C)cccc2C(C)C)c1C(=S)[S-].Cc1ccc(C(C)C)cc1
2 meas.
MOL
3D
#679
Ru(2)
donors: {"S": 2, "N": 1}
CC(=O)[S-].Cc1cc(C)c(-n2cc[n+](-c3c(C)cc(C)cc3C)c2C(=S)[S-])c(C)c1.Cc1ccc(C(C)C)cc1
2 meas.
MOL
3D
#678
Ru(2)
donors: {"N": 3}
CCCCN1C(=N\c2ccccc2)/C(=N/c2ccccc2)c2ccccc21.Cc1ccc(C(C)C)cc1.[Cl-]
4 meas.
MOL
3D
#677
Ru(2)
donors: {"N": 2}
CCCCN1C(=O)/C(=N/c2c(C)cc(C)cc2C)c2ccccc21.Cc1ccc(C(C)C)cc1.[Cl-]
4 meas.
MOL
3D
#676
Ru(2)
donors: {"N": 2}
CCCCN1C(=O)/C(=N/c2ccccc2)c2ccccc21.Cc1ccc(C(C)C)cc1.[Cl-]
4 meas.
MOL
3D
#675
Ru(2)
donors: {"N": 2}
Cc1ccc(C(C)C)cc1.O=C1Nc2ccccc2/C1=N\c1ccccc1.[Cl-]
4 meas.
MOL
3D
#674
Ru(3)
donors: {"O": 1, "N": 1, "P": 2}
COc1cccc2c1C(=O)c1c(O)c3c(c([O-])c1C2=O)C[C@@](O)(C(=O)CO)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1.[Cl-].[Cl-].c1ccc(P...
3 meas.
MOL
3D
#673
Ru(2)
donors: {"N": 4}
CC(=O)OC[C@H]1OC(OC(C)=O)[C@H](N=N/N=N/[C@H]2C(OC(C)=O)O[C@H](COC(C)=O)[C@H](F)[C@@H]2OC(C)=O)[C@@H](OC(C)=O)[C@H]1F.Cc1...
4 meas.
MOL
3D
#672
Ru(2)
donors: {"N": 4}
CC(=O)O[C@@H]1O[C@H](CF)[C@@H](F)[C@H](OC(C)=O)[C@H]1N=N/N=N/[C@H]1[C@H](OC(C)=O)O[C@H](CF)[C@@H](F)[C@@H]1OC(C)=O.Cc1c(...
4 meas.
MOL
3D
#671
Ru(2)
donors: {"N": 4}
CC(=O)O[C@H]1O[C@H](CF)[C@@H](F)[C@H](OC(C)=O)[C@H]1/N=N/N=N/[C@H]1[C@@H](OC(C)=O)O[C@H](CF)[C@@H](F)[C@@H]1OC(C)=O.Cc1c...
4 meas.
MOL
3D
#670
Ru(2)
donors: {"N": 6}
CC(=O)N[C@@H]1[C@@H](OC(C)=O)[C@H](F)[C@@H](CF)O[C@H]1C/N=N/N=N/[C@@H]1O[C@H](CF)[C@@H](F)[C@H](OC(C)=O)[C@H]1NC(C)=O.Cc...
4 meas.
MOL
3D
#669
Ru(2)
donors: {"N": 4}
CC(=O)OC1O[C@H](CF)[C@@H](F)[C@H](OC(C)=O)[C@H]1n1cc(-c2ccccn2)nn1.Cc1ccc(C(C)C)cc1.[Cl-]
4 meas.
MOL
3D
#668
Ru(2)
donors: {"N": 4}
CC(=O)OC[C@H]1O[C@H](OC(C)=O)[C@H](n2cc(-c3ccccn3)nn2)[C@@H](OC(C)=O)[C@H]1F.Cc1ccc(C(C)C)cc1.[Cl-]
4 meas.
MOL
3D
#667
Ru(2)
donors: {"N": 6}
CN(C)c1ccc(-n2cc(-c3nc4ccccc4s3)nn2)cc1.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12
6 meas.
MOL
3D
#666
Ru(2)
donors: {"O": 1, "N": 5}
O=[N+]([O-])c1ccc(-n2cc(-c3nc4ccccc4s3)nn2)cc1.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12
6 meas.
MOL
3D
#665
Ru(2)
donors: {"N": 8}
FC(F)(F)c1ccc(-n2cc(-c3nc4ccccc4s3)nn2)cc1.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12
6 meas.
MOL
3D
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