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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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Ir
Os
Re
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Ru
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#9414
Au(3)
donors: {"N": 3}
CCCn1[c-][n+](CCC)cc1.[c-]1ccccc1-c1cccc(-c2[c-]cccc2)n1
4 meas.
3D
#9413
Au(1)
donors: {"O": 3, "P": 1, "Cl": 1}
COc1ccc2cc(-c3ccc(P(c4ccccc4C)c4ccccc4C)cc3)c(=O)oc2c1.[Cl-]
9 meas.
3D
#9412
Au(1)
donors: {"O": 2, "N": 1, "S": 2, "P": 1}
COC(CN(C)C(=S)[S-])OC.c1ccc(P(c2ccccc2)c2ccccc2)cc1
3 meas.
3D
#9411
Au(3)
donors: {"O": 7, "N": 1}
[CH2-]Cc1ccc(OCCO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1.[c-]1ccccc1-c1cccc(-c2[c-]cccc2)n1
6 meas.
3D
#9410
Au(1)
donors: {"N": 4, "O": 3, "I": 1}
Cn1c(=O)c2c(n(C)[c-][n+]2C2CCCCC2O)n(C)c1=O.[I-]
3 meas.
3D
#9409
Au(1)
donors: {"O": 3, "P": 1, "Cl": 1}
CC12CC3(C)OC(C)(CC(C)(O1)P3c1ccccc1)O2.[Cl-]
7 meas.
3D
#9408
Ir(3)
donors: {"N": 5}
Nc1cc2cccnc2c2ncccc12.[c-]1ccccc1-c1ccc2cc3ccccc3cc2n1.[c-]1ccccc1-c1ccc2cc3ccccc3cc2n1
1 meas.
3D
#9407
Au(3)
donors: {"Cl": 1, "N": 5, "S": 1, "O": 2}
[Cl-].[N-]=C=Nc1cccc(Sc2ccc([N+](=O)[O-])cc2)c1.c1ccc(-c2ccccn2)nc1
4 meas.
3D
#9406
Ir(3)
donors: {"N": 4}
CC(C)(C)c1c[c-][n+](-c2ccccn2)cc1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
9 meas.
3D
#9405
Au(1)
donors: {"P": 2, "O": 3}
CCP(C)c1ccccc1.COc1ccccc1P(c1ccccc1OC)c1ccccc1OC
4 meas.
3D
#9404
Au(3)
donors: {"N": 5}
CC(C)(C)c1c[c-]c(-c2cncc(-c3[c-]cc(C(C)(C)C)cc3)n2)cc1.C[n+]1[c-]n(-c2c3ccccc3nc3ccccc23)cc1
3 meas.
3D
#9403
Au(3)
donors: {"N": 5, "S": 2, "Cl": 1}
CCN(CC)C(=S)NC([N-]/N=C(\[S-])N(C)c1ccccc1)c1ccccc1.[Cl-]
1 meas.
3D
#9402
Au(1)
donors: {"N": 5, "S": 1, "O": 2, "P": 1}
Cc1cc(C)nc([S-])n1.O=C(O)c1ccc(CC[N+]23CN4CN(CP(C4)C2)C3)cc1
2 meas.
3D
#9401
Au(1)
donors: {"O": 2, "N": 4, "P": 1, "S": 2}
CC(=O)N1CN2CN(C(C)=O)CP(C2)C1.[S-]c1nc2ccccc2s1
2 meas.
3D
#9400
Au(1)
donors: {"O": 18, "S": 2, "N": 2, "Cl": 1}
CC(=O)OC[C@H]1O[C@@H](Sc2cc(C)c(-n3[c-][n+](-c4c(C)cc(S[C@@H]5O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]5OC(C)=O...
4 meas.
3D
#9399
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.S=C([S-])N(Cc1ccccc1)Cc1ccccc1
3 meas.
3D
#9398
Au(1)
donors: {"P": 1, "N": 3}
Cc1ccccc1P(c1ccccc1C)c1ccccc1C.[N-]=[N+]=[N-]
3 meas.
3D
#9397
Ir(3)
donors: {"N": 4, "O": 2}
Cc1ccnc(-c2cc(C(=O)O)ccn2)c1.[c-]1ccccc1-c1ccc2ccccc2n1.[c-]1ccccc1-c1ccc2ccccc2n1
5 meas.
3D
#9396
Au(1)
donors: {"N": 4}
CCCCCCCCCCCCCCCCCC[n+]1[c-]n(CCCC)cc1.CCCCCCCCCCCCCCCCCC[n+]1[c-]n(CCCC)cc1
2 meas.
3D
#9395
Au(1)
donors: {"N": 6, "O": 4}
[NH3+][C@H](Cc1cn(Cc2ccccc2)[c-][n+]1Cc1ccccc1)C(=O)O.[NH3+][C@H](Cc1cn(Cc2ccccc2)[c-][n+]1Cc1ccccc1)C(=O)O
3 meas.
3D
#9394
Ir(3)
donors: {"S": 4, "N": 6}
[S-]c1nc2ccccc2c2n1nc([S-])[n+]2-c1ccccc1.[c-]1ccc2ccccc2c1-c1nc2ccccc2s1.[c-]1ccc2ccccc2c1-c1nc2ccccc2s1
3 meas.
3D
#9393
Ir(3)
donors: {"N": 8, "O": 1}
CCNC(=O)CCCn1c(-c2ccccn2)nc2ccccc21.Cc1nc2ccccc2nc1-c1[c-]cccc1.Cc1nc2ccccc2nc1-c1[c-]cccc1
1 meas.
3D
#9392
Au(1)
donors: {"O": 9, "N": 5, "Br": 1}
C=C(OC)OCC1OC(n2cc(-c3cn(C)[c-][n+]3C)nn2)C(OC(=C)OC)C(OC(=C)OC)C1OC(=C)OC.[Br-]
4 meas.
3D
#9391
Au(1)
donors: {"N": 6, "O": 2}
CC(C)c1cccc(C(C)C)c1-n1[c-][n+](-c2c(C(C)C)cccc2C(C)C)cc1.Cc1cc(C)c(-n2[c-][n+](CCOC(=O)NN)cc2)c(C)c1
1 meas.
3D
#9390
Au(3)
donors: {"N": 2, "Cl": 2}
Cc1ccc(-c2ccc(C)cn2)nc1.[Cl-].[Cl-]
3 meas.
3D
#9389
Au(3)
donors: {"N": 4, "S": 1, "Cl": 1}
CN(C)/C([S-])=N/N=C(\c1ccccc1)c1ccccn1.[Cl-]
5 meas.
3D
#9388
Au(3)
donors: {"O": 4, "N": 4}
COc1ccc(-c2c3nc(c(-c4ccc(OC)cc4)c4ccc([n-]4)c(-c4ccc(OC)cc4)c4nc(c(-c5ccc(OC)cc5)c5ccc2[n-]5)C=C4)C=C3)cc1
12 meas.
3D
#9387
Au(3)
donors: {"N": 4, "O": 4}
CCc1c(C)c2cc3[n-]c(cc4nc(cc5nc(cc1[n-]2)C(C)=C5CCC(=O)OC)C(CCC(=O)OC)=C4C)c(C)c3CC
8 meas.
3D
#9386
Au(1)
donors: {"N": 5, "P": 1, "S": 1}
CN(C)P(N(C)C)N(C)C.[S-]c1ncccn1
4 meas.
3D
#9385
Au(3)
donors: {"P": 2}
CC(C)(C)c1c[c-]c(-c2[c-]cc(C(C)(C)C)cc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2P(c2ccccc2)c2ccccc2)cc1
3 meas.
3D
#9384
Au(3)
donors: {"N": 3, "O": 6, "Cl": 2}
CN(C)CCNCCNC(=O)CCCCCO[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O.[Cl-].[Cl-]
4 meas.
3D
#9383
Au(3)
donors: {"O": 2, "N": 2, "F": 2}
[O-]c1ccccc1C=N[C@@H](c1ccc(F)cc1)[C@@H](N=Cc1ccccc1[O-])c1ccc(F)cc1
3 meas.
3D
#9382
Ir(3)
donors: {"N": 7, "O": 1}
Cn1cc(CC(N)C(=O)Nc2cc3cccnc3c3ncccc23)c2ccccc21.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
7 meas.
3D
#9381
Au(1)
donors: {"P": 2}
CCP(CC)CC.CCP(CC)CC
2 meas.
3D
#9380
Au(1)
donors: {"N": 5, "O": 2}
CC(C)c1cccc(C(C)C)c1-n1[c-][n+](-c2c(C(C)C)cccc2C(C)C)cc1.Cc1cc(C)c(-n2[c-][n+](CCOC(=O)NCc3ccc4ccc5cccc6ccc3c4c56)cc2)c...
1 meas.
3D
#9379
Au(1)
donors: {"Br": 1, "N": 3, "O": 1, "Cl": 3}
Cc1ccc(C)c2c1c1cc(Br)ccc1n2CCCCCCC[n+]1[c-]n(CC(O)c2ccccc2)c(Cl)c1Cl.[Cl-]
3 meas.
3D
#9378
Ir(3)
donors: {"N": 7, "P": 1, "S": 4, "O": 4}
C1N2CN3CN1CP(C2)C3.Cc1c(C)c(C)[c-](C)c1C.Cc1ccc(S(=O)(=O)/N=C(\[S-])Nc2ccccc2)cc1.Cc1ccc(S(=O)(=O)/N=C(\[S-])Nc2ccccc2)c...
4 meas.
3D
#9377
Au(1)
donors: {"N": 4, "Cl": 4}
Cn1[c-][n+](C)c(Cl)c1Cl.Cn1[c-][n+](C)c(Cl)c1Cl
1 meas.
3D
#9376
Au(1)
donors: {"N": 3, "P": 1, "Cl": 1}
CN(C)P(N(C)C)N(C)C.[Cl-]
2 meas.
3D
#9375
Au(1)
donors: {"N": 3, "P": 1, "Cl": 1}
CCCCCCCC[N@+]12C[N@@]3C[N@@](C[P@@](C3)C1)C2.[Cl-]
1 meas.
3D
#9374
Au(1)
donors: {"N": 2, "F": 3}
CC(C)c1cccc(C(C)C)c1-n1[c-][n+](-c2c(C(C)C)cccc2C(C)C)cc1.FC(F)(F)c1ccc([Se-])cc1
4 meas.
3D
#9373
Au(1)
donors: {"N": 4}
CC(C)c1cccc(C(C)C)c1-n1[c-][n+](-c2c(C(C)C)cccc2C(C)C)cc1.Cc1cc2nc[n-]c2cc1C
4 meas.
3D
#9372
Au(1)
donors: {"O": 1, "N": 1, "P": 1}
O=C(C=Cc1c2ccccc2cc2ccccc12)c1ccncc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
7 meas.
3D
#9371
Au(3)
donors: {"N": 4, "S": 4}
N#Cc1cc([S-])c([S-])cc1C#N.N#Cc1cc([S-])c([S-])cc1C#N
5 meas.
3D
#9370
Au(1)
donors: {"Br": 2, "N": 2, "Cl": 1}
Brc1cccc(-n2[c-][n+](-c3cccc(Br)c3)c3c2-c2cccc4cccc-3c24)c1.[Cl-]
1 meas.
3D
#9369
Au(1)
donors: {"N": 4, "O": 2}
Cn1[c-][n+](CC([O][Na])c2ccccc2)cc1.Cn1[c-][n+](CC([O][Na])c2ccccc2)cc1
10 meas.
3D
#9368
Au(1)
donors: {"S": 2, "O": 4, "N": 3, "P": 1}
CC1(S(=O)(=O)[O-])CC(=NNC(N)=S)c2ccccc2C1=O.CCP(CC)CC
2 meas.
3D
#9367
Au(1)
donors: {"N": 2, "Cl": 1}
CC(C)c1cccc(C(C)C)c1-n1ccn(-c2c(C(C)C)cccc2C(C)C)c1=[Se].[Cl-]
7 meas.
3D
#9366
Au(3)
donors: {"N": 6, "Cl": 1}
Cn1c(Cn2[c-][n+](Cc3nc4ccccc4n3C)cc2)nc2ccccc21.[Cl-]
1 meas.
3D
#9365
Au(1)
donors: {"N": 2, "F": 5}
Cn1ccnc1.Fc1[c-]c(F)c(F)c(F)c1F
1 meas.
3D
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