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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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#4564
Ru(2)
donors: {"O": 2, "N": 4}
O=C([O-])CC(=O)[O-].c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12
8 meas.
MOL
3D
#4563
Ru(2)
donors: {"O": 2, "N": 4}
O=C([O-])C(=O)[O-].c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1
3 meas.
MOL
3D
#4562
Ru(2)
donors: {"O": 1, "N": 4}
CC(=O)/C=C(/C)[O-].c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1
3 meas.
MOL
3D
#4561
Ru(2)
donors: {"O": 2, "N": 4}
O=C([O-])CC(=O)[O-].c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1
3 meas.
MOL
3D
#4560
Ru(2)
donors: {"N": 6}
NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)c1cc(-c2ccccn2)nc(-c2ccccn2)c1.c1ccc(-c2cccc(-c3ccccn3)n2)nc1
5 meas.
MOL
3D
#4559
Ru(2)
donors: {"N": 2, "O": 1}
C1COCCN1.Cc1ccc(C(C)C)cc1.O=C1C(=C([O-])NCc2ccccc2)C(=O)c2ccccc21
4 meas.
MOL
3D
#4558
Ru(2)
donors: {"O": 1, "N": 2}
Cc1ccc(C(C)C)cc1.O=C1C(=C([O-])NCc2ccccc2)C(=O)c2ccccc21.c1ccncc1
4 meas.
MOL
3D
#4557
Ru(2)
donors: {"O": 1, "N": 3}
Cc1ccc(C(C)C)cc1.O=C1C(=C([O-])NCc2ccccc2)C(=O)c2ccccc21.c1ccc2[nH]ncc2c1
4 meas.
MOL
3D
#4556
Ru(2)
donors: {"O": 1, "N": 3}
Cc1ccc(C(C)C)cc1.O=C1C(=C([O-])NCc2ccccc2)C(=O)c2ccccc21.c1ccc2[nH]cnc2c1
4 meas.
MOL
3D
#4555
Ru(2)
donors: {"O": 1, "N": 3}
Cc1ccc(C(C)C)cc1.O=C1C(=C([O-])NCc2ccccc2)C(=O)c2ccccc21.c1cn[nH]c1
4 meas.
MOL
3D
#4554
Ru(2)
donors: {"N": 3, "O": 1}
Cc1ccc(C(C)C)cc1.Cn1ccnc1.O=C1C(=C([O-])NCc2ccccc2)C(=O)c2ccccc21
4 meas.
MOL
3D
#4553
Ru(2)
donors: {"O": 1, "N": 1}
Cc1ccc(C(C)C)cc1.O=C1C(=C([O-])NCc2ccccc2)C(=O)c2ccccc21.[Cl-]
4 meas.
MOL
3D
#4552
Ru(2)
donors: {"N": 4}
Cc1ccc(C(C)C)cc1.[Cl-].c1c[nH]cn1.c1c[nH]cn1
1 meas.
MOL
3D
#4551
Ru(2)
donors: {"N": 2}
CCCn1ccnc1.Cc1ccc(C(C)C)cc1.[Cl-].[Cl-]
5 meas.
MOL
3D
#4550
Ru(2)
donors: {"N": 6}
Cc1ccc(C(C)C)cc1.Cn1ccnc1.Cn1ccnc1.Cn1ccnc1
5 meas.
MOL
3D
#4549
Ru(2)
donors: {"N": 3}
COc1ccc(N(c2ccc(/C=C/c3ccnc(-c4cc(C)ccn4)c3)cc2)c2ccc(OC)cc2)cc1.Cc1ccc(C(C)C)cc1.[Cl-]
3 meas.
MOL
3D
#4548
Ru(2)
donors: {"N": 3}
Cc1ccc(C(C)C)cc1.Cc1ccc(N(c2ccc(C)cc2)c2ccc(/C=C/c3ccnc(-c4cc(C)ccn4)c3)cc2)cc1.[Cl-]
3 meas.
MOL
3D
#4547
Ru(2)
donors: {"N": 3}
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccnc(-c4ccccn4)c3)cc2)cc1.Cc1ccc(C(C)C)cc1.[Cl-]
3 meas.
MOL
3D
#4546
Ru(2)
donors: {"N": 3}
Cc1ccc(C(C)C)cc1.[Cl-].c1ccc(N(c2ccccc2)c2ccc(-c3ccnc(-c4ccccn4)c3)cc2)cc1
3 meas.
MOL
3D
#4545
Ru(2)
donors: {"N": 8}
O=Cc1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
9 meas.
MOL
3D
#4544
Ru(2)
donors: {"N": 8}
O=Cc1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12
9 meas.
MOL
3D
#4543
Ru(2)
donors: {"O": 1}
Cc1ccc(C(C)C)cc1.O=C([O-])c1cc(-c2ccc(F)cc2F)ccc1O.[Cl-]
4 meas.
MOL
3D
#4542
Ru(2)
donors: {"O": 1, "N": 1}
Cc1ccc(C(C)C)cc1.O=C([O-])c1ccccc1Nc1cccc(C(F)(F)F)c1.[Cl-]
4 meas.
MOL
3D
#4541
Ru(2)
donors: {"N": 1, "O": 1}
Cc1ccc(C(C)C)cc1.Cc1cccc(Nc2ccccc2C(=O)[O-])c1C.[Cl-]
4 meas.
MOL
3D
#4540
Ru(2)
donors: {"N": 1}
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)OC[c-]1c(C)c(C)c(C)c1C.c1ccc2ccccc2c1
6 meas.
MOL
3D
#4539
Ru(2)
donors: {"N": 1}
Cc1c(C)c(C)[c-](COC(=O)[C@H](C)NC(=O)OC(C)(C)C)c1C.c1ccc2ccccc2c1
6 meas.
MOL
3D
#4538
Ru(2)
donors: {"N": 4}
Cc1ccc(C(C)C)cc1.NCc1cn(Cc2ccccc2)nn1.[Cl-]
9 meas.
MOL
3D
#4537
Ru(2)
donors: {"O": 1, "N": 4}
CCO/C([O-])=C/C(=O)c1cc2cccc(OC)c2oc1=O.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
3 meas.
MOL
3D
#4536
Ru(2)
donors: {"O": 1, "N": 5}
CCO/C([O-])=C/C(=O)c1cc2ccc(N(CC)CC)cc2oc1=O.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
3 meas.
MOL
3D
#4535
Ru(2)
donors: {"O": 1, "N": 4}
CCO/C([O-])=C/C(=O)c1cc2cc(C)ccc2oc1=O.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
3 meas.
MOL
3D
#4534
Ru(2)
donors: {"N": 1, "P": 1}
CCCCN(CCCC)CP(c1ccccc1)c1ccccc1.Cc1ccc(C(C)C)cc1.[Cl-].[Cl-]
5 meas.
MOL
3D
#4533
Ru(2)
donors: {"N": 1, "P": 1}
CCN(CC)CP(c1ccccc1)c1ccccc1.Cc1ccc(C(C)C)cc1.[Cl-].[Cl-]
5 meas.
MOL
3D
#4532
Ru(2)
donors: {"N": 1, "S": 2, "O": 2}
COc1cc2ccnc3c2c(c1OC)-c1ccccc1C3=O.CS(C)=O.CS(C)=O.[Cl-].[Cl-]
5 meas.
MOL
3D
#4531
Ru(2)
donors: {"N": 3}
Cc1ccc(C(C)C)cc1.O=C1c2ccccc2C(=O)c2c1ccc1nc(-c3ccccn3)[nH]c21.[I-]
3 meas.
MOL
3D
#4530
Ru(2)
donors: {"N": 3}
Cc1ccc(C(C)C)cc1.O=C1c2ccccc2C(=O)c2c1ccc1nc(-c3ccccn3)[nH]c21.[Br-]
3 meas.
MOL
3D
#4529
Ru(2)
donors: {"N": 3}
Cc1ccc(C(C)C)cc1.O=C1c2ccccc2C(=O)c2c1ccc1nc(-c3ccccn3)[nH]c21.[Cl-]
3 meas.
MOL
3D
#4528
Ru(2)
donors: {"N": 1, "O": 1}
COc1ccc(/N=C/c2cccc(OC)c2[O-])cc1OC.Cc1ccc(C(C)C)cc1.[Cl-]
3 meas.
MOL
3D
#4527
Ru(2)
donors: {"N": 1, "O": 1}
COc1cccc(/C=N/c2cc(OC)c(OC)c(OC)c2)c1[O-].Cc1ccc(C(C)C)cc1.[Cl-]
3 meas.
MOL
3D
#4526
Ru(2)
donors: {"N": 1, "O": 1}
COc1ccc(/N=C/c2ccccc2[O-])cc1OC.Cc1ccc(C(C)C)cc1.[Cl-]
3 meas.
MOL
3D
#4525
Ru(2)
donors: {"N": 1, "O": 1}
COc1cc(/N=C/c2ccccc2[O-])cc(OC)c1OC.Cc1ccc(C(C)C)cc1.[Cl-]
3 meas.
MOL
3D
#4524
Ru(2)
donors: {"O": 1, "N": 1}
Cc1ccc(C(C)C)cc1.[I-].[O-]c1ccccc1/C=N/CCc1ccc(O)cc1
4 meas.
MOL
3D
#4523
Ru(2)
donors: {"O": 1, "N": 1}
Cc1ccc(C(C)C)cc1.[Cl-].[O-]c1ccccc1/C=N/CCc1ccc(O)cc1
4 meas.
MOL
3D
#4522
Ru(2)
donors: {"N": 2}
Cc1ccc(C(C)C)cc1.Oc1ccc(CC/N=C/c2ccccn2)cc1.[I-]
4 meas.
MOL
3D
#4521
Ru(2)
donors: {"N": 2}
Cc1ccc(C(C)C)cc1.Oc1ccc(CC/N=C/c2ccccn2)cc1.[Cl-]
4 meas.
MOL
3D
#4520
Ru(2)
donors: {"N": 4}
Cc1cc2nc(-c3ccccn3)c(-c3ccccn3)nc2cc1C.Cc1ccc(C(C)C)cc1.[Cl-]
5 meas.
MOL
3D
#4519
Ru(2)
donors: {"N": 6}
Cc1ccc(C(C)C)cc1.[Cl-].c1ccc(-c2nnc(-c3ccccn3)nn2)nc1
5 meas.
MOL
3D
#4518
Ru(2)
donors: {"P": 1, "N": 2, "O": 2}
CCOP(=O)(OCC)c1ccc(CNC2CC(=O)[N-]C2=O)cc1.[C-]#[O+].[C-]#[O+].c1cc[cH-]c1
1 meas.
MOL
3D
#4517
Ru(2)
donors: {"P": 1, "N": 2, "O": 2}
CCOP(=O)(OCC)c1cccc(CNC2CC(=O)[N-]C2=O)c1.[C-]#[O+].[C-]#[O+].c1cc[cH-]c1
1 meas.
MOL
3D
#4516
Ru(2)
donors: {"P": 1, "N": 2, "O": 2}
CCOP(=O)(OCC)c1ccccc1CNC1CC(=O)[N-]C1=O.[C-]#[O+].[C-]#[O+].c1cc[cH-]c1
1 meas.
MOL
3D
#4515
Ru(2)
donors: {"N": 4}
COC(=O)c1ccnc(-c2cc(C(=O)OC)ccn2)c1.COC(=O)c1ccnc(-c2cc(C(=O)OC)ccn2)c1.O.O
2 meas.
MOL
3D
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