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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
Re
Metal
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Ru
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#7864
Au(1)
donors: {"O": 9, "S": 1, "N": 2}
C=C(OC)OC[C@H]1O[C@@H]([S-])[C@H](OC(=C)OC)[C@@H](OC(=C)OC)[C@H]1OC(=C)OC.[c-]1n(C23CC4CC(CC(C4)C2)C3)cc[n+]1C12CC3CC(CC...
3 meas.
3D
#7863
Au(1)
donors: {"P": 1, "O": 2, "S": 1}
CCP(CC)CC.O=C(O)c1ccc([S-])cc1
2 meas.
3D
#7862
Au(3)
donors: {"N": 4}
N[C@@H]1CCCC[C@H]1N.N[C@@H]1CCCC[C@H]1N
3 meas.
3D
#7861
Au(1)
donors: {"N": 2, "F": 2, "Cl": 1}
CCn1[c-][n+](CC)c(-c2ccc(F)cc2)c1-c1ccc(F)cc1.[C-]#Cc1ccc(Cl)cc1
1 meas.
3D
#7860
Ir(3)
donors: {"N": 7, "O": 1}
[c-]1ccccc1-c1ccc2ccccc2n1.[c-]1ccccc1-c1ccc2ccccc2n1.c1cnc2c(c1)c1nc(-c3ccc(N4CCOCC4)cc3)[nH]c1c1cccnc12
2 meas.
3D
#7859
Au(1)
donors: {"O": 2, "N": 3, "S": 2}
CCOC(=O)CN(C)C(=S)[S-].CCn1[c-][n+](CC)c2ccccc21
4 meas.
3D
#7858
Au(1)
donors: {"Br": 1, "N": 2, "P": 1}
Brc1cnc2[n-]ccc2c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
3 meas.
3D
#7857
Au(1)
donors: {"N": 3, "O": 1}
Cc1cc(C)c(N2[C-]=[N+](c3c(C)cc(C)cc3C)CC2)c(C)c1.O=C(C=Cc1c2ccccc2cc2ccccc12)c1ccncc1
7 meas.
3D
#7856
Au(1)
donors: {"P": 1, "N": 3, "O": 2}
c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1nc(OCC2CCCO2)c2[n-]ccc2n1
10 meas.
3D
#7855
Ir(3)
donors: {"O": 1, "N": 5}
O=Cc1c(-c2ccccn2)nc2ccccn12.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
4 meas.
3D
#7854
Au(3)
donors: {"Cl": 3, "N": 2}
[Cl-].[Cl-].[Cl-].c1ccc(-n2ccnc2)cc1
1 meas.
3D
#7853
Au(1)
donors: {"P": 1, "S": 2, "N": 1}
CCP(CC)CC.S=C1SCCN1CC12CC3CC(CC(C3)C1)C2
4 meas.
3D
#7852
Au(3)
donors: {"N": 4, "S": 4}
N#C/C([S-])=C(/[S-])C#N.N#C/C([S-])=C(/[S-])C#N
3 meas.
3D
#7851
Au(1)
donors: {"O": 1, "N": 1, "S": 2, "P": 1}
O=C1CCN(C(=S)[S-])CC1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
3 meas.
3D
#7850
Au(1)
donors: {"N": 8, "O": 4}
Cn1c(=O)c2c(n(C)c1=O)[n+](Cc1ccccc1)[c-]n2C.Cn1c(=O)c2c(n(C)c1=O)[n+](Cc1ccccc1)[c-]n2C
5 meas.
3D
#7849
Au(1)
donors: {"N": 2, "O": 7, "P": 1}
CCn1[c-][n+](CC)c(-c2ccc(OC)cc2)c1-c1ccc(OC)cc1.[C-]#CCOC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@...
3 meas.
3D
#7848
Au(3)
donors: {"O": 4, "N": 1}
CC(=O)[O-].CC(=O)[O-].[c-]1ccccc1-c1ccccn1
2 meas.
3D
#7847
Au(3)
donors: {"N": 2, "Cl": 3}
CC(C)n1ccnc1.[Cl-].[Cl-].[Cl-]
1 meas.
3D
#7846
Au(3)
donors: {"O": 1, "N": 3, "Cl": 3}
Cc1ccc(C(=O)N/N=C(/N)Cc2ccccc2)cc1.[Cl-].[Cl-].[Cl-]
1 meas.
3D
#7845
Au(3)
donors: {"N": 3, "S": 2}
CN(C)C(=S)[S-].Cc1ccc(-c2ccc(C)cn2)nc1
5 meas.
3D
#7844
Au(1)
donors: {"S": 6, "O": 11, "N": 1, "P": 1}
Cc1ccc(S(=O)(=O)NC(=S)[S-])cc1.O=S(=O)([O][Na])c1cccc(P(c2cccc(S(=O)(=O)[O][Na])c2)c2cccc(S(=O)(=O)[O][Na])c2)c1
1 meas.
3D
#7843
Au(1)
donors: {"N": 2, "F": 1, "Cl": 1}
CCn1[c-][n+](CC)c(-c2ccc(F)cc2)c1.[Cl-]
8 meas.
3D
#7842
Au(1)
donors: {"N": 2, "Br": 2, "O": 1, "I": 1}
CCn1[c-][n+](CC)c(-c2cc(Br)cc(Br)c2)c1-c1ccc(OC)cc1.[I-]
2 meas.
3D
#7841
Au(3)
donors: {"S": 2, "N": 2, "O": 2}
S=C([S-])N1CCCC1.[c-]1ccccc1-c1nccc2cc3c(cc12)OCO3
5 meas.
3D
#7840
Au(3)
donors: {"N": 1, "O": 7}
Cc1c[c-]c(-c2cccc(-c3[c-]cc(C)cc3)n2)cc1.[CH2-]Cc1ccc(OCCO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1
6 meas.
3D
#7839
Au(1)
donors: {"O": 1, "N": 3, "Cl": 1}
COCC[n+]1[c-]n(Cc2ccccn2)c2ccccc21.[Cl-]
2 meas.
3D
#7838
Au(1)
donors: {"O": 2, "N": 2, "Cl": 1}
COC(=O)C=Cc1c[n+](C)[c-]n1C.[Cl-]
2 meas.
3D
#7837
Au(1)
donors: {"O": 9, "S": 1, "N": 1, "P": 1}
CC(=O)OC[C@H]1O[C@@H]([S-])[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O.CN1C=CC2C1c1cccc3cccc(c13)P2c1ccccc1
14 meas.
3D
#7836
Au(1)
donors: {"P": 1, "S": 1, "N": 2, "Cl": 1, "O": 1}
CCP(CC)CC.[S-]c1nnc(-c2ccc(Cl)cc2)o1
3 meas.
3D
#7835
Au(1)
donors: {"N": 2, "S": 2, "P": 1}
CN(C)C(=S)[S-].NC1CCCCC1P(c1ccccc1)c1ccccc1
3 meas.
3D
#7834
Ir(3)
donors: {"Br": 1, "N": 6, "O": 2}
Brc1cc2c(cc1-c1nc3c4cccnc4c4ncccc4c3[nH]1)OCO2.[c-]1cccc2ccc3cccnc3c12.[c-]1cccc2ccc3cccnc3c12
3 meas.
3D
#7833
Au(1)
donors: {"O": 2, "N": 5, "P": 1, "S": 1}
CC(=O)N1CN2CN(C(C)=O)CP(C2)C1.[C-]#CCSc1nccc(C)n1
2 meas.
3D
#7832
Au(1)
donors: {"N": 3, "S": 2}
CC(C)c1cccc(C(C)C)c1-n1[c-][n+](-c2c(C(C)C)cccc2C(C)C)cc1.CCN(CC)C(=S)[S-]
3 meas.
3D
#7831
Au(1)
donors: {"N": 4, "O": 3, "P": 1}
[C-]#Cc1cccc(Nc2ncnc3cc(OC)c(OCCCN4CCOCC4)cc23)c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
2 meas.
3D
#7830
Au(1)
donors: {"N": 2, "Cl": 1}
Cc1cc(C)c(-n2ccn(-c3c(C)cc(C)cc3C)c2=[Se])c(C)c1.[Cl-]
7 meas.
3D
#7829
Au(1)
donors: {"N": 3, "S": 1, "P": 1}
CNC(=S)Nc1c2ccccc2nc2ccccc12.c1ccc(P(c2ccccc2)c2ccccc2)cc1
6 meas.
3D
#7828
Ir(3)
donors: {"N": 6}
Cc1ccnc(-c2cc(-c3ncc4ccccc4n3)ccn2)c1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
12 meas.
3D
#7827
Au(1)
donors: {"N": 4}
CC(C)(C)n1[c-][n+](C(C)(C)C)cc1.CC(C)c1cccc(C(C)C)c1-n1[c-][n+](-c2c(C(C)C)cccc2C(C)C)cc1
2 meas.
3D
#7826
Au(1)
donors: {"N": 12, "O": 4, "P": 1}
N=C(N)NCCC[C@@H](NC(=O)[C@@H](N)Cc1ccc(-c2[c-][nH]nn2)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O.c1ccc(P(c2ccc...
2 meas.
3D
#7825
Au(1)
donors: {"N": 4}
Cc1cc(C(c2ccccc2)c2ccccc2)c(-n2[c-][n+](-c3c(C(c4ccccc4)c4ccccc4)cc(C)cc3C(c3ccccc3)c3ccccc3)cc2)c(C(c2ccccc2)c2ccccc2)c...
4 meas.
3D
#7824
Au(3)
donors: {"S": 2, "O": 5, "N": 4}
Cc1ccc(S(=O)(=O)[N-]CC[N-]S(=O)(=O)c2ccc(C)cc2)cc1.[NH-]C(=O)c1ccccn1
1 meas.
3D
#7823
Au(1)
donors: {"N": 6, "F": 1, "S": 1}
CC(C)c1cccc(C(C)C)c1-n1[c-][n+](-c2c(C(C)C)cccc2C(C)C)cc1.Fc1cccc(CSc2ncnc3[n-]cnc23)c1
5 meas.
3D
#7822
Au(3)
donors: {"O": 3, "N": 1, "Cl": 3}
O=C1c2ccccc2-c2c3c(cc4ccnc1c24)OCO3.[Cl-].[Cl-].[Cl-]
5 meas.
3D
#7821
Au(1)
donors: {"N": 2, "P": 1}
[c-]1n(Cc2ccccc2)c(-c2ccccc2)c(-c2ccccc2)[n+]1Cc1ccccc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
4 meas.
3D
#7820
Au(1)
donors: {"N": 2, "P": 1, "Cl": 1}
C(=NCCc1ccccn1)c1ccccc1P(c1ccccc1)c1ccccc1.[Cl-]
13 meas.
3D
#7819
Au(1)
donors: {"N": 3, "O": 4}
CC(C)c1cccc(C(C)C)c1-n1[c-][n+](-c2c(C(C)C)cccc2C(C)C)cc1.N[C@@H](Cc1ccc(O)c(O)c1)C(=O)[O-]
5 meas.
3D
#7818
Au(3)
donors: {"S": 1, "P": 3}
S=P(c1[c-]cccc1)(c1ccccc1)c1ccccc1.c1ccc(P(CCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
6 meas.
3D
#7817
Au(3)
donors: {"Cl": 3, "O": 1, "N": 1}
[Cl-].[Cl-].[O-]c1ccc(Cl)c2cccnc12
4 meas.
3D
#7816
Au(1)
donors: {"O": 2, "N": 3, "P": 1, "Cl": 1}
O=C(O)Cc1ccc(C[N+]23CN4CN(CP(C4)C2)C3)cc1.[Cl-]
2 meas.
3D
#7815
Au(1)
donors: {"O": 12, "S": 1, "P": 1}
CC(=O)OC[C@H]1OC([S-])[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O.COc1ccc2cc(-c3ccc(P(c4ccccc4)c4ccccc4)cc3)c(=O)oc2c1
4 meas.
3D
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32/189 (9414 total)