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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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Metal
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#8814
Au(3)
donors: {"N": 1, "Cl": 1, "P": 2}
Cc1c[c-]c(-c2ccccn2)cc1.[Cl-].c1ccc(P(c2ccccc2)c2ccccc2P(c2ccccc2)c2ccccc2)cc1
4 meas.
3D
#8813
Au(3)
donors: {"S": 2, "N": 1, "Cl": 2}
S=C([S-])N1CCCCC1.[Cl-].[Cl-]
11 meas.
3D
#8812
Au(1)
donors: {"Br": 4, "N": 4}
Brc1cc(Br)cc(-n2[c-][n+](Cc3ccccc3)cc2)c1.Brc1cc(Br)cc(-n2[c-][n+](Cc3ccccc3)cc2)c1
1 meas.
3D
#8811
Au(3)
donors: {"N": 4, "O": 1, "Br": 3}
C/C(N)=N\NC(=O)c1ccncc1.[Br-].[Br-].[Br-]
1 meas.
3D
#8810
Ir(3)
donors: {"N": 5, "O": 1}
[c-]1cc(N2CCOCC2)cc[n+]1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
9 meas.
3D
#8809
Au(3)
donors: {"O": 1, "N": 3, "S": 1, "Cl": 1}
Cc1ccc([O-])c(/C=N/N=C(\[S-])Nc2ccccc2)c1.[Cl-]
6 meas.
3D
#8808
Au(3)
donors: {"N": 6, "S": 2, "F": 1}
CCN(CC)C(=S)N=C([N-]N=C([S-])N(C)C)c1cccc(F)c1.C[NH+](C)Cc1[c-]cccc1
1 meas.
3D
#8807
Au(1)
donors: {"N": 4}
CCn1[c-][n+](CC)cc1.CCn1[c-][n+](CC)cc1
25 meas.
3D
#8806
Au(3)
donors: {"O": 3, "P": 1, "N": 5}
CCCCOP(=O)(Nc1ccc(-c2c3nc(c(-c4ccccc4)c4ccc([n-]4)c(-c4ccccc4)c4nc(c(-c5ccccc5)c5ccc2[n-]5)C=C4)C=C3)cc1)OCCCC
2 meas.
3D
#8805
Au(1)
donors: {"Br": 2, "S": 1, "N": 2}
Brc1ccc(SCCn2[c-][n+](Cc3ccccc3)cc2)cc1.[Br-]
1 meas.
3D
#8804
Au(1)
donors: {"N": 4, "O": 2, "I": 1}
Cn1c(=O)c2c(n(C)c1=O)[n+](C)[c-]n2C.[I-]
5 meas.
3D
#8803
Au(1)
donors: {"N": 4, "S": 1}
Cc1cc(C)c(-n2[c-][n+](-c3c(C)cc(C)cc3C)cc2)c(C)c1.[S-]c1ncccn1
5 meas.
3D
#8802
Au(1)
donors: {"P": 1, "N": 1}
CCP(CC)CC.[C-]#Cc1ccc(N)cc1
2 meas.
3D
#8801
Au(1)
donors: {"N": 3, "O": 1, "Cl": 1}
CCn1[c-][n+](CC)c(-c2ccccc2)c1-c1ccc(OC)cn1.[Cl-]
2 meas.
3D
#8800
Au(3)
donors: {"N": 2, "Cl": 2}
Nc1cccc2cccnc12.[Cl-].[Cl-]
4 meas.
3D
#8799
Au(1)
donors: {"O": 2, "N": 4, "P": 1, "Cl": 1}
O=[N+]([O-])c1ccc(C[N+]23CN4CN(CP(C4)C2)C3)cc1.[Cl-]
2 meas.
3D
#8798
Au(3)
donors: {"Cl": 4, "N": 2}
Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1.[Cl-].[Cl-].[Cl-]
1 meas.
3D
#8797
Ir(3)
donors: {"O": 1, "N": 5}
CCC(=O)NCc1ccnc(-c2cc(C)ccn2)c1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
4 meas.
3D
#8796
Au(3)
donors: {"N": 3, "S": 2}
Cc1c[c-]c(-c2ccccn2)cc1.[S-]c1ccccn1.[S-]c1ccccn1
1 meas.
3D
#8795
Ir(3)
donors: {"O": 1, "N": 6}
O=C1Nc2ccccc2/C1=N\N=C\c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
5 meas.
3D
#8794
Au(1)
donors: {"P": 4, "N": 4}
CP(c1nc2ccccc2nc1P(C)C(C)(C)C)C(C)(C)C.CP(c1nc2ccccc2nc1P(C)C(C)(C)C)C(C)(C)C
20 meas.
3D
#8793
Au(3)
donors: {"N": 6, "S": 2, "Cl": 1}
CCN(CC)C(=S)N=C([N-]N=C([S-])N(C)C)c1ccc(Cl)cc1.C[NH+](C)Cc1[c-]cccc1
1 meas.
3D
#8792
Au(1)
donors: {"Cl": 2, "N": 2, "P": 1}
Clc1nc[n-]c1Cl.c1ccc(P(c2ccccc2)c2ccccc2)cc1
14 meas.
3D
#8791
Au(1)
donors: {"N": 6}
CC(C)c1cccc(C(C)C)c1-n1[c-][n+](-c2c(C(C)C)cccc2C(C)C)nc1-c1ccccc1.CC(C)c1cccc(C(C)C)c1-n1[c-][n+](-c2c(C(C)C)cccc2C(C)C...
1 meas.
3D
#8790
Au(1)
donors: {"N": 1, "S": 1, "O": 2, "P": 1}
[C-]#CCN(C)S(=O)(=O)c1ccc(C)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
4 meas.
3D
#8789
Au(3)
donors: {"N": 6, "S": 2, "F": 3}
CCN(CC)C(=S)N=C([N-]N=C([S-])N(C)C)c1cccc(C(F)(F)F)c1.C[NH+](C)Cc1[c-]cccc1
1 meas.
3D
#8788
Au(3)
donors: {"F": 2, "N": 3, "Cl": 2}
Fc1cc(F)cc(Cn2c(-c3ccccn3)nc3ccccc32)c1.[Cl-].[Cl-]
4 meas.
3D
#8787
Au(3)
donors: {"N": 3, "S": 1, "O": 1, "Cl": 1}
N/C([S-])=N/N=C/c1ccccc1[O-].[Cl-]
1 meas.
3D
#8786
Au(3)
donors: {"O": 3, "N": 3, "Cl": 1}
COc1cc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc(OC)c1OC.[Cl-]
3 meas.
3D
#8785
Au(1)
donors: {"N": 4, "O": 6, "S": 2}
CCn1[c-][n+](CC)c2ccccc21.COC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1NC(=O)C1CCN(C(=S)[S-])CC1
3 meas.
3D
#8784
Au(3)
donors: {"O": 2, "N": 2, "Cl": 2}
COc1ccnc(-c2cc(OC)ccn2)c1.[Cl-].[Cl-]
2 meas.
3D
#8783
Au(1)
donors: {"N": 4, "P": 1, "O": 4}
C1N2CN3CN1CP(C2)C3.[C-]#CCNC(=O)C=Cc1cc(OC)c(OC)c(OC)c1
4 meas.
3D
#8782
Au(1)
donors: {"O": 4, "P": 1, "N": 3}
COc1cccc(OC)c1-c1ccccc1P(C1CCCCC1)C1CCCCC1.O=[N+]([O-])c1cc2cccnc2c2ncccc12
2 meas.
3D
#8781
Au(1)
donors: {"N": 2, "F": 2}
CCn1[c-][n+](CC)c(-c2ccc(F)cc2)c1-c1ccc(F)cc1.[C-]#Cc1ccc(-c2ccccc2)cc1
1 meas.
3D
#8780
Au(1)
donors: {"N": 2, "I": 1}
CCN1[C-]=[N+](CC)[C@@H](c2ccccc2)[C@H]1c1ccccc1.[I-]
2 meas.
3D
#8779
Au(1)
donors: {"O": 2, "N": 3, "P": 1, "Cl": 1}
CC(=O)N1CN2CN(C(C)=O)CP(C2)C1.[Cl-]
5 meas.
3D
#8778
Au(3)
donors: {"N": 4, "O": 4, "F": 6}
CCCC[n+]1[c-]n(C)cc1.CCCC[n+]1[c-]n(C)cc1.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F
3 meas.
3D
#8777
Au(1)
donors: {"N": 2, "P": 1}
CCn1[c-][n+](CC)c(-[c]23->[Fe+2]456789%10(<-[CH-]%11[C]4=[C]5[C]6=[C]%117)<-[cH-]2[c]8[c]9[c]3%10)c1-c1ccccc1.c1ccc(P(c2...
9 meas.
3D
#8776
Au(1)
donors: {"Cl": 1, "N": 1, "P": 1}
[Cl-].c1ccc(NCc2ccccc2P(c2ccccc2)c2ccccc2)cc1
13 meas.
3D
#8775
Au(3)
donors: {"Cl": 2, "N": 1}
[Cl-].[Cl-].[c-]1ccccc1-c1ccccn1
2 meas.
3D
#8774
Ir(3)
donors: {"N": 5}
[c-]1cc(N2CCCCC2)cc[n+]1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
9 meas.
3D
#8773
Au(3)
donors: {"O": 6, "N": 3, "S": 2}
O=C(N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O)C1CCN(C(=S)[S-])CC1.[c-]1ccccc1Cc1ccccn1
4 meas.
3D
#8772
Au(1)
donors: {"N": 4}
C=CCn1[c-][n+](CC=C)c2ccccc21.[c-]1c2c(n3[n+]1CCCC3)CCCC2
1 meas.
3D
#8771
Au(1)
donors: {"O": 3, "P": 1}
COc1ccc2cc([C@H](C)C(=O)[O-])ccc2c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
3 meas.
3D
#8770
Au(1)
donors: {"O": 5, "N": 2, "S": 1, "P": 1}
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)[C@H](C[S-])NC(=O)OC(C)(C)C.c1ccc(P(c2ccccc2)c2ccccc2)cc1
3 meas.
3D
#8769
Au(3)
donors: {"N": 2, "O": 3, "S": 2, "Br": 2}
CN(CC(=O)NC(C)(C)C(=O)OC(C)(C)C)C(=S)[S-].[Br-].[Br-]
2 meas.
3D
#8768
Au(3)
donors: {"N": 5}
CC(C)(C)c1c[c-]c(-c2cncc(-c3[c-]cc(C(C)(C)C)cc3)n2)cc1.Cc1cccc(C)c1/[NH+]=[C-]/Nc1c2ccccc2nc2ccccc12
3 meas.
3D
#8767
Ir(3)
donors: {"N": 6, "O": 1}
Cc1cccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c1O.[c-]1ccccc1-c1nccc2ccccc12.[c-]1ccccc1-c1nccc2ccccc12
7 meas.
3D
#8766
Au(3)
donors: {"N": 2, "Br": 3}
Cn1[c-][n+](Cc2ccccc2)cc1.[Br-].[Br-].[Br-]
9 meas.
3D
#8765
Au(1)
donors: {"P": 1, "O": 1}
C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.[C-]#Cc1ccc(C=O)cc1
2 meas.
3D
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13/189 (9414 total)