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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
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Metal
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#2264
Ru(2)
donors: {"N": 1, "P": 1}
CC(=O)N[C@H]1O[C@H]2[C@H](OP3OC[C@H]2O3)[C@H]1O.Cc1ccc(C(C)C)cc1.[Cl-].[Cl-]
2 meas.
MOL
3D
#2263
Ru(2)
donors: {"P": 1}
CCS[C@H]1O[C@H]2[C@H](OP3OC[C@H]2O3)[C@H]1O.Cc1ccc(C(C)C)cc1.[Cl-].[Cl-]
8 meas.
MOL
3D
#2262
Ru(2)
donors: {"P": 1}
C1CCC2(CC1)O[C@H]1O[C@H]3[C@H](OP4OC[C@H]3O4)[C@H]1O2.Cc1ccc(C(C)C)cc1.[Cl-].[Cl-]
8 meas.
MOL
3D
#2261
Ru(2)
donors: {"P": 1}
CC1(C)O[C@H]2O[C@H]3[C@H](OP4OC[C@H]3O4)[C@H]2O1.Cc1ccc(C(C)C)cc1.[Cl-].[Cl-]
8 meas.
MOL
3D
#2260
Ru(2)
donors: {"N": 3, "O": 1}
CCn1nc(C(=O)[O-])c(=O)c2cc3c(nc21)OCO3.Cc1ccc(C(C)C)cc1.[Cl-]
3 meas.
MOL
3D
#2259
Ru(2)
donors: {"N": 2, "O": 1}
CCn1cc(C(=O)[O-])c(=O)c2ccc(C)nc21.Cc1ccc(C(C)C)cc1.[Cl-]
3 meas.
MOL
3D
#2258
Ru(2)
donors: {"N": 3, "O": 1}
CC(C)c1ccccc1.CC1COc2c(N3CCN(C)CC3)c(F)cc3c(=O)c(C(=O)[O-])cn1c23.[Cl-]
3 meas.
MOL
3D
#2257
Ru(2)
donors: {"O": 1}
Cc1cc(=S)c([O-])co1.Cc1ccc(C(C)C)cc1.[Cl-]
2 meas.
MOL
3D
#2256
Ru(2)
donors: {"O": 1}
Cc1ccc(C(C)C)cc1.O=c1ccoc(CO)c1[O-].[Cl-]
3 meas.
MOL
3D
#2255
Ru(2)
donors: {"O": 1}
Cc1cc(=O)c([O-])c(CO)o1.Cc1ccc(C(C)C)cc1.[Cl-]
3 meas.
MOL
3D
#2254
Ru(2)
donors: {"O": 1}
Cc1ccc(C(C)C)cc1.Cc1occc(=O)c1[O-].[Cl-]
3 meas.
MOL
3D
#2253
Ru(2)
donors: {"O": 1}
Cc1ccc(C(C)C)cc1.O=c1ccocc1[O-].[Cl-]
3 meas.
MOL
3D
#2252
Ru(2)
donors: {"O": 1}
Cc1cc(=O)c([O-])co1.Cc1ccc(C(C)C)cc1.[Cl-]
3 meas.
MOL
3D
#2251
Ru(2)
donors: {"O": 1}
Cc1ccc(C(C)C)cc1.O=c1cc(CO)occ1[O-].[Cl-]
2 meas.
MOL
3D
#2250
Ru(2)
donors: {"N": 8}
c1ccc2[nH]c(CCSCCSCCc3nc4ccccc4[nH]3)nc2c1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1
7 meas.
MOL
3D
#2249
Ru(2)
donors: {"N": 6}
c1ccc(CCSCCSCCc2ccccn2)nc1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1
7 meas.
MOL
3D
#2248
Ru(2)
donors: {"N": 2}
Cc1c(C)c(C)c(C)c(C)c1C.[Cl-].c1ccc(-c2nccs2)nc1
2 meas.
MOL
3D
#2247
Ru(2)
donors: {"N": 2}
Cc1ccc(C(C)C)cc1.[Cl-].c1ccc(-c2nccs2)nc1
2 meas.
MOL
3D
#2246
Ru(2)
donors: {"N": 2}
[Cl-].c1ccc(-c2nccs2)nc1.c1ccccc1
2 meas.
MOL
3D
#2245
Ru(2)
donors: {"N": 6}
CCCCn1c(-c2[c-]cc(-c3ccccc3)cc2)nc2cc(C(=O)OC)ccc21.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1
1 meas.
MOL
3D
#2244
Ru(2)
donors: {"N": 6}
CCCCn1c(-c2[c-]cc(-c3ccccc3)cc2)nc2cc(C(=O)OC)ccc21.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12
1 meas.
MOL
3D
#2243
Ru(2)
donors: {"N": 6}
CCCCn1c(-c2[c-]cc3ccccc3c2)nc2cc(C(=O)OC)ccc21.c1cnc2c(c1)c1nccnc1c1cccnc12.c1cnc2c(c1)c1nccnc1c1cccnc12
1 meas.
MOL
3D
#2242
Ru(2)
donors: {"N": 6}
CCCCn1c(-c2[c-]cc(-c3ccccc3)cc2)nc2cc(C(=O)OC)ccc21.c1cnc2c(c1)c1nccnc1c1cccnc12.c1cnc2c(c1)c1nccnc1c1cccnc12
1 meas.
MOL
3D
#2241
Ru(2)
donors: {"N": 6}
CCCCn1c(-c2[c-]cccc2)nc2cc(C(=O)OC)ccc21.c1cnc2c(c1)c1nccnc1c1cccnc12.c1cnc2c(c1)c1nccnc1c1cccnc12
1 meas.
MOL
3D
#2240
Ru(2)
donors: {"N": 6}
C[n+]1ccc(-c2ccc(N(c3ccc(-c4cc[n+](C)cc4)cc3)c3ccc(-c4nc5c6cccnc6c6ncccc6c5[nH]4)cc3)cc2)cc1.c1cnc2c(c1)ccc1cccnc12.c1cn...
3 meas.
MOL
3D
#2239
Ru(2)
donors: {"N": 6}
C[n+]1ccc(-c2ccc(N(c3ccc(-c4cc[n+](C)cc4)cc3)c3ccc(-c4nc5c6cccnc6c6ncccc6c5[nH]4)cc3)cc2)cc1.c1ccc(-c2ccccn2)nc1.c1ccc(-...
3 meas.
MOL
3D
#2238
Ru(2)
donors: {"N": 6}
c1ccc(-c2ccc3ccc4ccc(-c5ccccc5)nc4c3n2)cc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
11 meas.
MOL
3D
#2237
Ru(2)
donors: {"N": 4, "S": 1, "P": 2}
Cc1cc(=O)nc([S-])[nH]1.c1ccc(-c2ccccn2)nc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
31 meas.
MOL
3D
#2236
Ru(2)
donors: {"N": 4, "S": 1, "P": 2}
O=c1cc[nH]c([S-])n1.c1ccc(-c2ccccn2)nc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
31 meas.
MOL
3D
#2235
Ru(2)
donors: {"N": 4, "O": 1, "P": 2}
NCCCCC(N)C(=O)[O-].c1ccc(-c2ccccn2)nc1.c1ccc(P(CCCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
3 meas.
MOL
3D
#2234
Ru(2)
donors: {"N": 3, "O": 1, "P": 2}
CC(C)CC(N)C(=O)[O-].c1ccc(-c2ccccn2)nc1.c1ccc(P(CCCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
5 meas.
MOL
3D
#2233
Ru(2)
donors: {"N": 3, "O": 1, "P": 2}
NCC(=O)[O-].c1ccc(-c2ccccn2)nc1.c1ccc(P(CCCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
7 meas.
MOL
3D
#2232
Ru(2)
donors: {"N": 3, "O": 1, "P": 2}
CC(N)C(=O)[O-].c1ccc(-c2ccccn2)nc1.c1ccc(P(CCCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
5 meas.
MOL
3D
#2231
Ru(2)
donors: {"N": 3, "O": 1, "P": 2}
Cc1ccnc(-c2cc(C)ccn2)c1.N[C@@H](CO)C(=O)[O-].c1ccc(P(CCCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
1 meas.
MOL
3D
#2230
Ru(2)
donors: {"N": 3, "O": 1, "P": 2}
Cc1ccnc(-c2cc(C)ccn2)c1.N[C@@H](Cc1ccc(O)cc1)C(=O)[O-].c1ccc(P(CCCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
1 meas.
MOL
3D
#2229
Ru(2)
donors: {"N": 4, "O": 1, "P": 2}
Cc1ccnc(-c2cc(C)ccn2)c1.N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-].c1ccc(P(CCCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
1 meas.
MOL
3D
#2228
Ru(2)
donors: {"N": 3, "O": 1, "P": 2}
CSCC[C@H](N)C(=O)[O-].Cc1ccnc(-c2cc(C)ccn2)c1.c1ccc(P(CCCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
1 meas.
MOL
3D
#2227
Ru(2)
donors: {"N": 3, "O": 1, "P": 2}
CC(N)C(=O)[O-].Cc1ccnc(-c2cc(C)ccn2)c1.c1ccc(P(CCCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
1 meas.
MOL
3D
#2226
Ru(2)
donors: {"N": 3, "O": 1, "P": 2}
CC(C)[C@H](N)C(=O)[O-].Cc1ccnc(-c2cc(C)ccn2)c1.c1ccc(P(CCCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
1 meas.
MOL
3D
#2225
Ru(2)
donors: {"N": 3, "O": 1, "P": 2}
Cc1ccnc(-c2cc(C)ccn2)c1.NCC(=O)[O-].c1ccc(P(CCCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
1 meas.
MOL
3D
#2224
Ru(2)
donors: {"N": 2, "P": 2}
Cc1ccnc(-c2cc(C)ccn2)c1.[Cl-].[Cl-].c1ccc(P(CCCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
2 meas.
MOL
3D
#2223
Ru(2)
donors: {"S": 1, "N": 3, "P": 2}
[S-]c1ccccn1.c1ccc(-c2ccccn2)nc1.c1ccc(P(CCCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
8 meas.
MOL
3D
#2222
Ru(2)
donors: {"S": 1, "N": 3, "P": 2}
[S-]c1ccccn1.c1ccc(-c2ccccn2)nc1.c1ccc(P(CCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
4 meas.
MOL
3D
#2221
Ru(2)
donors: {"S": 1, "N": 3, "P": 2}
[S-]c1ccccn1.c1ccc(-c2ccccn2)nc1.c1ccc(P(CCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
4 meas.
MOL
3D
#2220
Ru(2)
donors: {"N": 4, "S": 1, "O": 1, "P": 2}
CCn1c2ccccc2c2ccc(/C=N/N=C(/[S-])Nc3ccccc3)cc21.[C-]#[O+].[H-].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)c...
3 meas.
MOL
3D
#2219
Ru(2)
donors: {"N": 4, "S": 1, "O": 1, "P": 2}
CCn1c2ccccc2c2ccc(/C=N/N=C(/[S-])NC)cc21.[C-]#[O+].[H-].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
3 meas.
MOL
3D
#2218
Ru(2)
donors: {"N": 4, "S": 1, "O": 1, "P": 2}
CCn1c2ccccc2c2ccc(/C=N/N=C(\N)[S-])cc21.[C-]#[O+].[H-].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
3 meas.
MOL
3D
#2217
Ru(2)
donors: {"N": 5, "P": 1}
C1N2CN3CN1CP(C2)C3.CCCCCCCCCc1ccnc2c1ccc1c(CCCCCCCCC)ccnc12.Cc1ccc(C(C)C)cc1
3 meas.
MOL
3D
#2216
Ru(2)
donors: {"N": 5, "P": 1}
C1N2CN3CN1CP(C2)C3.Cc1ccc(C(C)C)cc1.Cc1ccnc(-c2cc(C)ccn2)c1
3 meas.
MOL
3D
#2215
Ru(2)
donors: {"N": 5, "P": 1}
C1N2CN3CN1CP(C2)C3.Cc1ccc(C(C)C)cc1.O=C(O)c1ccnc(-c2cc(C(=O)O)ccn2)c1
3 meas.
MOL
3D
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144/189 (9414 total)