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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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#8314
Au(3)
donors: {"N": 4, "O": 3, "Cl": 1}
NCC(=O)[N-][C@@H](Cc1cnc[nH]1)C(=O)O.[Cl-]
6 meas.
3D
#8313
Au(1)
donors: {"N": 1, "S": 2, "P": 1}
CCCCCCCCN1CCSC1=S.c1ccc(P(c2ccccc2)c2ccccc2)cc1
3 meas.
3D
#8312
Au(1)
donors: {"S": 1, "N": 2, "P": 1}
Cc1csc(=N)n1C.c1ccc(P(c2ccccc2)c2ccccc2)cc1
1 meas.
3D
#8311
Au(1)
donors: {"F": 3, "N": 3, "Cl": 1, "Br": 1}
FC(F)(F)c1cnc(CCn2[c-][n+](Cc3ccccc3)cc2)c(Cl)c1.[Br-]
13 meas.
3D
#8310
Au(1)
donors: {"N": 4, "O": 3, "I": 1}
Cn1c(=O)c2c(n(C)[c-][n+]2CCO)n(C)c1=O.[I-]
3 meas.
3D
#8309
Au(1)
donors: {"O": 1, "N": 1, "P": 1, "Cl": 1}
O=C(NCc1ccccc1)c1ccc(P(c2ccccc2)c2ccccc2)cc1.[Cl-]
2 meas.
3D
#8308
Au(1)
donors: {"N": 2, "P": 1, "S": 2}
NC1CCCCC1P(c1ccccc1)c1ccccc1.S=C([S-])N(Cc1ccccc1)Cc1ccccc1
3 meas.
3D
#8307
Au(1)
donors: {"N": 5, "O": 1, "Cl": 1}
Cc1ccnc(-c2cc(CNC(=O)c3ccc(Cn4[c-][n+](C)cc4)cc3)ccn2)c1.[Cl-]
3 meas.
3D
#8306
Au(1)
donors: {"N": 4}
CCn1[c-][n+](CC)c(-c2ccccc2)c1-c1ccccc1.CCn1[c-][n+](CC)c(-c2ccccc2)c1-c1ccccc1
6 meas.
3D
#8305
Au(1)
donors: {"N": 7, "O": 2, "S": 1}
CC(C)c1cccc(C(C)C)c1-n1[c-][n+](-c2c(C(C)C)cccc2C(C)C)cc1.O=[N+]([O-])c1ccc(CSc2ncnc3[n-]cnc23)cc1
5 meas.
3D
#8304
Au(3)
donors: {"S": 2, "N": 2}
S=C([S-])N1CCCCC1.[c-]1ccccc1Cc1ccccn1
5 meas.
3D
#8303
Au(3)
donors: {"O": 4, "N": 2, "Cl": 2}
CC(C)COC(=O)[C@H](CC(C)C)NCCN[C@@H](CC(C)C)C(=O)OCC(C)C.[Cl-].[Cl-]
4 meas.
3D
#8302
Au(3)
donors: {"O": 1, "N": 4}
CCCCCCCCCCOc1ccc(-c2c3nc(c(-c4ccccc4)c4ccc([n-]4)c(-c4ccccc4)c4nc(c(-c5ccccc5)c5ccc2[n-]5)C=C4)C=C3)cc1
4 meas.
3D
#8301
Au(3)
donors: {"O": 4, "N": 2, "Cl": 2}
CCOC(=O)[C@H](CC(C)C)NCCN[C@@H](CC(C)C)C(=O)OCC.[Cl-].[Cl-]
5 meas.
3D
#8300
Au(1)
donors: {"N": 2, "O": 4, "Cl": 1}
CCn1[c-][n+](CC)c(-c2cc(OC)c(OC)c(OC)c2)c1-c1ccc(OC)cc1.[Cl-]
6 meas.
3D
#8299
Au(1)
donors: {"O": 2, "N": 2, "Cl": 1}
COC(=O)c1cn(C)[c-][n+]1C.[Cl-]
4 meas.
3D
#8298
Au(1)
donors: {"O": 1, "N": 1, "P": 1, "S": 1, "Cl": 1}
O=C(NCCP(c1ccccc1)c1ccccc1)c1cccs1.[Cl-]
4 meas.
3D
#8297
Au(1)
donors: {"N": 1, "P": 1, "Cl": 1}
CC(C)c1cccc(C(C)C)c1/N=C/c1ccccc1P(c1ccccc1)c1ccccc1.[Cl-]
2 meas.
3D
#8296
Au(3)
donors: {"N": 7, "S": 3, "O": 2, "Cl": 2}
Cc1ncc(C[n+]2csc(CCO)c2C)c(NC(=S)[S-])n1.O=C(CCCc1ccc(N(CCCl)CCCl)cc1)Nc1ccnc(-c2[c-]cccc2)c1
4 meas.
3D
#8295
Au(1)
donors: {"N": 2, "F": 2, "O": 1}
CCn1[c-][n+](CC)c(-c2ccc(F)cc2)c1-c1ccc(F)cc1.[C-]#Cc1ccc(C=O)cc1
1 meas.
3D
#8294
Au(1)
donors: {"N": 2, "F": 2, "S": 1}
CCn1[c-][n+](CC)c(-c2ccc(-c3ccc(F)cc3)cc2)c1-c1ccc(-c2ccc(F)cc2)cc1.[S-]c1ccc2ccccc2c1
3 meas.
3D
#8293
Au(1)
donors: {"P": 1, "N": 12, "O": 4}
CCP(CC)c1ccccc1.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)...
2 meas.
3D
#8292
Ir(3)
donors: {"O": 3, "N": 3, "S": 2}
O=C([O-])c1ccc(O)cn1.[c-]1c(-c2ccccn2)sc2ccccc12.[c-]1c(-c2ccccn2)sc2ccccc12
3 meas.
3D
#8291
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.Cc1cc(C)c(N2[C-]=[N+](c3c(C)cc(C)cc3C)CC2)c(C)...
3 meas.
3D
#8290
Au(3)
donors: {"N": 6, "O": 2}
N=C(N)N=C([NH-])N.[c-]1ccccc1-c1nccc2cc3c(cc12)OCO3
5 meas.
3D
#8289
Au(1)
donors: {"O": 4, "N": 6}
COC(=O)[C@H]([NH3+])Cc1cn(C)[c-][n+]1C.COC(=O)[C@H]([NH3+])Cc1cn(C)[c-][n+]1C
3 meas.
3D
#8288
Au(1)
donors: {"O": 1, "P": 1}
[C-]#CCOCC=C.c1ccc(P(c2ccccc2)c2ccccc2)cc1
1 meas.
3D
#8287
Au(1)
donors: {"N": 2, "F": 2, "Cl": 1}
CCn1[c-][n+](CC)c(-c2ccc(F)cc2)c1-c1ccc(F)cc1.[Cl-]
3 meas.
3D
#8286
Au(1)
donors: {"F": 5, "S": 1, "P": 1}
Fc1[c-]c(F)c(F)c(F)c1F.S=P(c1ccccc1)(c1ccccc1)c1ccccc1
3 meas.
3D
#8285
Au(1)
donors: {"O": 6}
[C-]#CCOc1ccc2ccc(=O)oc2c1.[C-]#CCOc1ccc2ccc(=O)oc2c1
2 meas.
3D
#8284
Ir(3)
donors: {"O": 2, "N": 5}
O=C1Nc2ccccc2/C1=N\N=C\c1c([O-])ccc2ccccc12.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
4 meas.
3D
#8283
Au(1)
donors: {"O": 2, "N": 2, "Cl": 1}
CCO[C@H]1[C@H](OCC)[N+](c2c(C(C)C)cccc2C(C)C)=[C-]N1c1c(C(C)C)cccc1C(C)C.[Cl-]
4 meas.
3D
#8282
Au(1)
donors: {"O": 3, "N": 2, "S": 1, "P": 1}
COC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1[S-].c1ccc(P(c2ccccc2)c2ccccc2)cc1
5 meas.
3D
#8281
Au(1)
donors: {"N": 4, "P": 1}
N#Cc1nc[n-]c1C#N.c1ccc(P(c2ccccc2)c2ccccc2)cc1
7 meas.
3D
#8280
Au(3)
donors: {"N": 2, "Cl": 3}
CCCCc1ccc2ccc3cccnc3c2n1.[Cl-].[Cl-].[Cl-]
1 meas.
3D
#8279
Ir(3)
donors: {"N": 6, "O": 5, "S": 2}
Cc1ccnc(-c2cc(COC(=O)CCC(=O)n3cc(C4CC(=O)NC4=O)c4ccccc43)ccn2)c1.[c-]1ccsc1-c1ccccn1.[c-]1ccsc1-c1ccccn1
7 meas.
3D
#8278
Au(3)
donors: {"N": 4, "F": 4, "I": 2}
CCn1[c-][n+](CC)c(-c2ccc(F)cc2)c1-c1ccc(F)cc1.CCn1[c-][n+](CC)c(-c2ccc(F)cc2)c1-c1ccc(F)cc1.[I-].[I-]
3 meas.
3D
#8277
Au(1)
donors: {"N": 2, "S": 1, "Br": 2}
C[n+]1[c-]n(CCSc2ccc(Br)cc2)cc1.[Br-]
1 meas.
3D
#8276
Au(1)
donors: {"O": 2, "N": 4, "P": 1, "S": 1}
CC(=O)N1CN2CN(C(C)=O)CP(C2)C1.[C-]#CCSc1ccccn1
2 meas.
3D
#8275
Au(1)
donors: {"N": 4}
CC(C)c1cccc(C(C)C)c1-n1[c-][n+](C)cc1.[Se]=C1NCCN1
3 meas.
3D
#8274
Au(1)
donors: {"N": 2, "P": 2}
c1ccc(-c2ccccn2)nc1.c1ccc(P(c2ccccc2)c2ccccc2P(c2ccccc2)c2ccccc2)cc1
4 meas.
3D
#8273
Au(3)
donors: {"Cl": 2, "N": 3}
[Cl-].[Cl-].c1ccc(-c2nc3cc4ccccc4cc3[n-]2)nc1
4 meas.
3D
#8272
Au(1)
donors: {"N": 3, "O": 1, "P": 1}
[C-]#Cc1ccc(/C=N/c2c(C)n(C)n(-c3ccccc3)c2=O)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
2 meas.
3D
#8271
Au(1)
donors: {"F": 6, "N": 2, "Cl": 1}
FC(F)(F)c1cccc(-n2[c-][n+](-c3cccc(C(F)(F)F)c3)c3c2-c2cccc4cccc-3c24)c1.[Cl-]
1 meas.
3D
#8270
Au(1)
donors: {"O": 11, "S": 6, "N": 1, "Cl": 1, "P": 1}
O=S(=O)(NC(=S)[S-])c1ccc(Cl)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
#8269
Au(1)
donors: {"N": 3, "O": 1, "Br": 1, "S": 1}
C[n+]1[c-]n(CC(O)c2ccccc2)cc1.Cc1ccc(C)c2c1c1cc(Br)ccc1n2CCCCCCC[S-]
3 meas.
3D
#8268
Au(1)
donors: {"N": 6}
[c-]1n2ccccc2c[n+]1-c1cccnc1.[c-]1n2ccccc2c[n+]1-c1cccnc1
3 meas.
3D
#8267
Au(3)
donors: {"O": 6, "S": 1, "N": 1}
CCOC(=O)c1sc(C(=O)OCC)c([O-])c1[O-].[c-]1ccccc1Cc1ccccn1
1 meas.
3D
#8266
Ir(3)
donors: {"O": 4, "N": 8, "Cl": 4, "S": 2}
O=C(OCc1ccnc(-c2cc(COC(=O)c3nn(Cc4ccc(Cl)cc4Cl)c4ccccc34)ccn2)c1)c1nn(Cc2ccc(Cl)cc2Cl)c2ccccc12.[c-]1ccsc1-c1ccccn1.[c-]...
5 meas.
3D
#8265
Au(1)
donors: {"N": 2, "O": 2, "S": 1}
CCn1[c-][n+](CC)c(-c2ccccc2)c1-c1ccccc1.[CH3-]->[Ti+4]12345678(<-[O-]C(=O)c9ccc([S-])cc9)(<-[CH-]9[C]1=[C]2[C]3=[C]94)<-...
3 meas.
3D
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23/189 (9414 total)