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Ir C^N families
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D-MPNN
Coordination Complexes
9414 complexes in database
9414
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4834
Ru
2220
Au
1431
Ir
339
Rh
337
Os
253
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#7564
Au(1)
donors: {"O": 18, "S": 2, "N": 2, "Cl": 1}
CC(=O)OC[C@H]1O[C@@H](Sc2cc(C(C)C)c(-n3[c-][n+](-c4c(C(C)C)cc(S[C@@H]5O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]...
4 meas.
3D
#7563
Au(1)
donors: {"N": 2, "O": 2, "F": 1, "Cl": 1}
CC[N+](=[C-]Nc1ccccc2c(-c3ccc(OC)cc3)c(-c3ccccc3F)c(-c3ccc(OC)cc3)c1-2)CC.[Cl-]
4 meas.
3D
#7562
Au(1)
donors: {"N": 2, "O": 2}
CC(C)c1cccc(C(C)C)c1-n1[c-][n+](-c2c(C(C)C)cccc2C(C)C)cc1.[C-]#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@...
4 meas.
3D
#7561
Au(1)
donors: {"N": 4, "O": 6, "Br": 2}
CCn1[c-][n+](CC)c(-c2ccc(OC)cc2)c1-c1cc(Br)c(OC)c(OC)c1.CCn1[c-][n+](CC)c(-c2ccc(OC)cc2)c1-c1cc(Br)c(OC)c(OC)c1
6 meas.
3D
#7560
Au(1)
donors: {"N": 2, "O": 3, "S": 1, "P": 1}
C[C@H](NC(=O)c1cccnc1[S-])C(=O)O.c1ccc(P(c2ccccc2)c2ccccc2)cc1
5 meas.
3D
#7559
Au(3)
donors: {"N": 6, "Cl": 1}
Cc1c2ccccn2[c-][n+]1-c1ccccn1.Cc1c2ccccn2[c-][n+]1-c1ccccn1.[Cl-]
3 meas.
3D
#7558
Au(3)
donors: {"S": 8, "N": 2}
CCSc1nc([S-])c([S-])s1.CCSc1nc([S-])c([S-])s1
1 meas.
3D
#7557
Au(1)
donors: {"O": 2, "S": 1, "N": 2}
O=C(O)c1ccc([S-])cc1.[c-]1n(Cc2ccccc2)c(-c2ccccc2)c(-c2ccccc2)[n+]1Cc1ccccc1
6 meas.
3D
#7556
Au(1)
donors: {"O": 2, "S": 1, "N": 2}
CCOC(=O)c1ccc([S-])cc1.[c-]1n(Cc2ccccc2)c(-c2ccccc2)c(-c2ccccc2)[n+]1Cc1ccccc1
3 meas.
3D
#7555
Ir(3)
donors: {"O": 2, "N": 5, "S": 3, "F": 3}
COC(=O)c1ccc2c(c1)nc(-c1nc3ccccc3s1)n2Cc1ccc(C(F)(F)F)cc1.[c-]1ccccc1-c1nc2ccccc2s1.[c-]1ccccc1-c1nc2ccccc2s1
4 meas.
3D
#7554
Au(1)
donors: {"O": 1, "S": 1, "N": 2, "Br": 1}
COc1ccc(SCCn2[c-][n+](Cc3ccccc3)cc2)cc1.[Br-]
1 meas.
3D
#7553
Au(1)
donors: {"O": 3, "S": 1, "N": 3}
CCOC(=O)[C@H](C[S-])NC(C)=O.[c-]1n(Cc2ccccc2)c(-c2ccccc2)c(-c2ccccc2)[n+]1Cc1ccccc1
3 meas.
3D
#7552
Au(3)
donors: {"N": 8}
[c-]1n2cc[n+]1Cn1[c-][n+](cc1)Cn1[c-][n+](cc1)Cn1[c-][n+](cc1)C2
2 meas.
3D
#7551
Au(1)
donors: {"N": 4}
CCN1[C-]=[N+](CC)[C@@H](c2ccccc2)[C@H]1c1ccccc1.CCN1[C-]=[N+](CC)[C@@H](c2ccccc2)[C@H]1c1ccccc1
2 meas.
3D
#7550
Au(1)
donors: {"O": 2, "N": 5, "P": 1, "S": 1}
CC(=O)N1CN2CN(C(C)=O)CP(C2)C1.Cc1ccnc([S-])n1
2 meas.
3D
#7549
Au(1)
donors: {"O": 5, "N": 3, "P": 1}
CC(=O)N1CN2CN(C(C)=O)CP(C2)C1.[C-]#CCOc1ccc2c(C)cc(=O)oc2c1
2 meas.
3D
#7548
Au(1)
donors: {"N": 10, "O": 8}
Cn1c(=O)c2c(n(C)c1=O)[n+](Cc1ccc([N+](=O)[O-])cc1)[c-]n2C.Cn1c(=O)c2c(n(C)c1=O)[n+](Cc1ccc([N+](=O)[O-])cc1)[c-]n2C
5 meas.
3D
#7547
Au(1)
donors: {"N": 4}
CCN1[C-]=[N+](CC)[C@H](c2ccccc2)[C@H]1c1ccccc1.CCN1[C-]=[N+](CC)[C@H](c2ccccc2)[C@H]1c1ccccc1
2 meas.
3D
#7546
Au(1)
donors: {"N": 4, "O": 12}
CC[n+]1[c-]n(CCCCCOC(=O)/C=C/c2ccc(O)c(OC)c2)c(-c2ccc(OC)cc2)c1-c1ccc(OC)cc1.CC[n+]1[c-]n(CCCCCOC(=O)/C=C/c2ccc(O)c(OC)c...
2 meas.
3D
#7545
Au(1)
donors: {"O": 3, "N": 2, "P": 1}
COc1ccc2c(Cn3cnc4ccccc43)cc(=O)oc2c1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
4 meas.
3D
#7544
Au(3)
donors: {"O": 2, "N": 3, "P": 2, "Cl": 1}
O=C(N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1P(c1ccccc1)c1ccccc1)c1ccccc1P(c1ccccc1)c1ccccc1.[Cl-].[c-]1ccccc1Cc1ccccn1
5 meas.
3D
#7543
Au(1)
donors: {"O": 3, "N": 4, "S": 1, "Cl": 1}
O=[N+]([O-])c1ccc(C=NNC(=S)Nc2ccccc2)o1.[Cl-]
5 meas.
3D
#7542
Au(3)
donors: {"S": 6}
CC(C)(C)c1cc([S-])c([S-])s1.CC(C)(C)c1cc([S-])c([S-])s1
6 meas.
3D
#7541
Au(1)
donors: {"N": 3, "O": 2, "Cl": 1}
CC[n+]1[c-]n(CCCN2C(=O)c3cccc4cccc(c34)C2=O)cc1.[Cl-]
2 meas.
3D
#7540
Au(1)
donors: {"N": 5, "O": 2}
Cn1c(=O)c2c(n(C)[c-][n+]2C)n(C)c1=O.[C-]#Cc1ccncc1
3 meas.
3D
#7539
Au(3)
donors: {"O": 1, "N": 1, "P": 2}
O=C(c1[c-]cccc1)c1ccccn1.c1ccc(P(CCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
4 meas.
3D
#7538
Au(3)
donors: {"P": 2}
CC(C)(C)c1c[c-]c(-c2[c-]cc(C(C)(C)C)cc2)cc1.c1ccc(P(CCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
3 meas.
3D
#7537
Au(1)
donors: {"N": 2, "O": 1, "S": 1}
Cn1[c-][n+](C)c2ccccc21.O=C([S-])c1ccccc1
1 meas.
3D
#7536
Au(1)
donors: {"N": 2, "O": 2}
Cc1cc(C)c(-n2[c-][n+](-c3c(C)cc(C)cc3C)cc2)c(C)c1.[C-]#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C
4 meas.
3D
#7535
Au(3)
donors: {"N": 4, "S": 5}
Cc1ccnc([S-])n1.S=C([S-])N(Cc1ccccc1)Cc1ccccc1.S=C([S-])N(Cc1ccccc1)Cc1ccccc1
1 meas.
3D
#7534
Au(1)
donors: {"N": 1, "P": 1, "Cl": 1}
NCCP(c1ccccc1)c1ccccc1.[Cl-]
3 meas.
3D
#7533
Au(1)
donors: {"S": 2, "N": 2, "P": 1}
[S-]C1=NCCS1.c1ccc(P(c2ccccc2)c2ccccn2)cc1
6 meas.
3D
#7532
Au(3)
donors: {"N": 2, "S": 4}
CC(C)n1c([Se-])c([Se-])sc1=S.CC(C)n1c([Se-])c([Se-])sc1=S
6 meas.
3D
#7531
Au(3)
donors: {"O": 1, "N": 3, "S": 1, "Cl": 1}
Cc1ccc([O-])c(/C=N/N=C(\[S-])N2CCCCCC2)c1.[Cl-]
6 meas.
3D
#7530
Ir(3)
donors: {"N": 6, "O": 2, "Cl": 2, "F": 4}
Cc1ccnc(-c2cc(COC(=O)c3nn(Cc4ccc(Cl)cc4Cl)c4ccccc34)ccn2)c1.Fc1c[c-]c(-c2ccccn2)c(F)c1.Fc1c[c-]c(-c2ccccn2)c(F)c1
5 meas.
3D
#7529
Au(3)
donors: {"N": 2, "Br": 3}
Cn1[c-][n+](C(c2ccccc2)c2ccccc2)cc1.[Br-].[Br-].[Br-]
1 meas.
3D
#7528
Au(1)
donors: {"O": 4, "N": 2, "F": 1, "Cl": 1}
CCOc1ccc(-c2c(-c3cc(OC)c(OC)c(OC)c3)n(C)[c-][n+]2C)cc1F.[Cl-]
5 meas.
3D
#7527
Au(1)
donors: {"N": 4}
CC(C)N1CCNC1=[Se].CC(C)c1cccc(C(C)C)c1-n1[c-][n+](-c2c(C(C)C)cccc2C(C)C)cc1
3 meas.
3D
#7526
Au(1)
donors: {"O": 9, "S": 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.CCP(CC)CC
3 meas.
3D
#7525
Au(3)
donors: {"N": 3, "Cl": 2}
Cn1c(-c2ccccn2)nc2ccccc21.[Cl-].[Cl-]
4 meas.
3D
#7524
Au(1)
donors: {"N": 2}
CCn1[c-][n+](CC)c2ccccc21.[C-]#Cc1ccccc1
4 meas.
3D
#7523
Au(1)
donors: {"O": 2, "N": 2, "F": 1, "Cl": 1}
COc1ccc(-c2c3ccc(N/[C-]=[NH+]/c4c(C)cccc4C)ccc-3c(-c3ccc(OC)cc3)c2-c2ccc(F)cc2)cc1.[Cl-]
4 meas.
3D
#7522
Au(1)
donors: {"N": 2, "Cl": 1}
Cn1[c-][n+](C)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.[Cl-]
9 meas.
3D
#7521
Au(1)
donors: {"N": 3, "Cl": 1}
CC(C)(C)[NH+]=[C-]NCc1cccc(N)c1.[Cl-]
6 meas.
3D
#7520
Au(3)
donors: {"N": 3, "F": 3}
CC(C)(C)c1c[c-]c(-c2[c-]cc(C(C)(C)C)cc2)cc1.C[n+]1[c-]n(-c2cc(C(F)(F)F)ccn2)cc1.[C-]#Cc1ccccc1
2 meas.
3D
#7519
Au(1)
donors: {"N": 3}
[C-]#N.[c-]1n(Cc2ccccc2)c(-c2ccccc2)c(-c2ccccc2)[n+]1Cc1ccccc1
2 meas.
3D
#7518
Au(3)
donors: {"O": 8, "N": 4}
COc1cc(OC)cc(-c2c3nc(c(-c4cc(OC)cc(OC)c4)c4ccc([n-]4)c(-c4cc(OC)cc(OC)c4)c4nc(c(-c5cc(OC)cc(OC)c5)c5ccc2[n-]5)C=C4)C=C3)...
1 meas.
3D
#7517
Au(3)
donors: {"Cl": 3, "N": 1}
[Cl-].[Cl-].[Cl-].c1ccc2ncccc2c1
3 meas.
3D
#7516
Au(3)
donors: {"Cl": 2, "O": 1, "N": 1}
[Cl-].[Cl-].[c-]1ccccc1Oc1ccccn1
10 meas.
3D
#7515
Au(1)
donors: {"O": 1, "S": 1, "N": 2}
O=C([S-])c1ccccc1.[c-]1n(Cc2ccccc2)cc[n+]1Cc1ccccc1
1 meas.
3D
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38/189 (9414 total)