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complexes
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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#2014
Ru(2)
donors: {"N": 6}
Nc1ccc(O)c(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
3 meas.
MOL
3D
#2013
Ru(2)
donors: {"N": 6}
Nc1ccccc1-c1nc2c3cccnc3c3ncccc3c2[nH]1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
3 meas.
MOL
3D
#2012
Ru(2)
donors: {"O": 1, "P": 1, "N": 1}
Cc1ccc(C(C)C)cc1.O=C(/C=C(\[O-])c1ccccc1)c1ccccc1.c1ccc(P(c2ccccc2)c2ccccn2)cc1
2 meas.
MOL
3D
#2011
Ru(2)
donors: {"O": 1, "P": 1, "N": 1}
CC(=O)/C=C(\[O-])c1ccccc1.Cc1ccc(C(C)C)cc1.c1ccc(P(c2ccccc2)c2ccccn2)cc1
2 meas.
MOL
3D
#2010
Ru(2)
donors: {"N": 2, "P": 1, "O": 1}
Cc1ccc(C(C)C)cc1.Cn1ccnc1P(c1ccccc1)c1ccccc1.O=C(/C=C(\[O-])c1ccccc1)c1ccccc1
2 meas.
MOL
3D
#2009
Ru(2)
donors: {"O": 1, "N": 2, "P": 1}
CC(=O)/C=C(\[O-])c1ccccc1.Cc1ccc(C(C)C)cc1.Cn1ccnc1P(c1ccccc1)c1ccccc1
2 meas.
MOL
3D
#2008
Ru(2)
donors: {"O": 1, "N": 2, "P": 1}
CC(=O)/C=C(/C)[O-].Cc1ccc(C(C)C)cc1.Cn1ccnc1P(c1ccccc1)c1ccccc1
2 meas.
MOL
3D
#2007
Ru(2)
donors: {"N": 5}
[Cl-].c1ccc(-c2ccc(-c3cc(-c4ccccn4)nc(-c4ccccn4)c3)cc2)cc1.c1ccc(-c2ccccn2)nc1
6 meas.
MOL
3D
#2006
Ru(2)
donors: {"N": 5}
[Cl-].c1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1.c1ccc(-c2ccccn2)nc1
12 meas.
MOL
3D
#2005
Ru(2)
donors: {"S": 1, "N": 4, "P": 2}
[S-]c1ncccn1.c1ccc(-c2ccccn2)nc1.c1ccc(P(CCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
2 meas.
MOL
3D
#2004
Ru(2)
donors: {"S": 1, "N": 4, "P": 2}
[S-]c1ncccn1.c1ccc(-c2ccccn2)nc1.c1ccc(P(CCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1
2 meas.
MOL
3D
#2003
Ru(2)
donors: {"N": 6}
c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1.c1cnc2c(c1)c1nccnc1c1cccnc12
2 meas.
MOL
3D
#2002
Ru(2)
donors: {"N": 6}
Cc1ccc2ccc3ccc(C)nc3c2n1.Cc1ccc2ccc3ccc(C)nc3c2n1.Nc1cc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)ccc1O
4 meas.
MOL
3D
#2001
Ru(2)
donors: {"N": 5, "O": 1}
Cc1ccc2ccc3ccc(C)nc3c2n1.Cc1ccc2ccc3ccc(C)nc3c2n1.O=[N+]([O-])c1cc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)ccc1O
4 meas.
MOL
3D
#2000
Ru(2)
donors: {"N": 4, "S": 1, "O": 2, "As": 1}
N/C([S-])=N\N=C(\c1ccccc1)c1cc(Cl)ccc1N=Cc1cc(Cl)ccc1[O-].[C-]#[O+].c1ccc([As](c2ccccc2)c2ccccc2)cc1
1 meas.
MOL
3D
#1999
Ru(2)
donors: {"N": 4, "S": 1, "O": 2, "P": 1}
N/C([S-])=N\N=C(\c1ccccc1)c1cc(Cl)ccc1N=Cc1c([O-])ccc2ccccc12.[C-]#[O+].c1ccc(P(c2ccccc2)c2ccccc2)cc1
1 meas.
MOL
3D
#1998
Ru(2)
donors: {"N": 4, "S": 1, "O": 2, "P": 1}
N/C([S-])=N\N=C(\c1ccccc1)c1cc(Cl)ccc1N=Cc1cc(Cl)ccc1[O-].[C-]#[O+].c1ccc(P(c2ccccc2)c2ccccc2)cc1
1 meas.
MOL
3D
#1997
Ru(2)
donors: {"N": 6}
CC1(C)CC(NC(=O)c2ccc3[nH]c4c(c3c2)C/C(=N\Cc2ccccn2)Nc2ccccc2-4)CC(C)(C)N1[O].Cc1ccc(C(C)C)cc1.[Cl-]
6 meas.
MOL
3D
#1996
Ru(2)
donors: {"N": 3}
CC1=C/C(=N\NC(=O)c2cccnc2)c2c(O)cccc2C1=O.Cc1ccccc1.[Cl-].[Cl-]
4 meas.
MOL
3D
#1995
Ru(2)
donors: {"N": 3}
CC1=C/C(=N\NC(=O)c2ccncc2)c2c(O)cccc2C1=O.Cc1ccc(C(C)C)cc1.[Cl-].[Cl-]
4 meas.
MOL
3D
#1994
Ru(2)
donors: {"N": 3}
CC1=C/C(=N\NC(=O)c2cccnc2)c2c(O)cccc2C1=O.Cc1ccc(C(C)C)cc1.[Cl-].[Cl-]
4 meas.
MOL
3D
#1993
Ru(2)
donors: {"N": 3, "S": 1, "O": 2, "As": 2}
CN/C([S-])=N/N=C\c1ccccc1[N+](=O)[O-].[C-]#[O+].[Cl-].c1ccc([As](c2ccccc2)c2ccccc2)cc1.c1ccc([As](c2ccccc2)c2ccccc2)cc1
1 meas.
MOL
3D
#1992
Ru(2)
donors: {"N": 3, "S": 1, "O": 2, "P": 2}
CN/C([S-])=N/N=C\c1ccccc1[N+](=O)[O-].[C-]#[O+].[Cl-].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
1 meas.
MOL
3D
#1991
Ru(2)
donors: {"N": 3, "S": 1, "O": 1, "As": 2}
CN/C([S-])=N/N=C\c1ccccc1Cl.[C-]#[O+].[Cl-].c1ccc([As](c2ccccc2)c2ccccc2)cc1.c1ccc([As](c2ccccc2)c2ccccc2)cc1
1 meas.
MOL
3D
#1990
Ru(2)
donors: {"N": 3, "S": 1, "O": 1, "P": 2}
CN/C([S-])=N/N=C\c1ccccc1Cl.[C-]#[O+].[Cl-].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
1 meas.
MOL
3D
#1989
Ru(2)
donors: {"N": 4, "P": 1}
C1N2CN3CN1CP(C2)C3.O=C(NCCc1ccccc1)c1c2ccccc2cc2ccccc12.[Cl-].[Cl-]
36 meas.
MOL
3D
#1988
Ru(2)
donors: {"N": 4, "P": 1}
C1N2CN3CN1CP(C2)C3.O=C(NCc1ccccc1)c1c2ccccc2cc2ccccc12.[Cl-].[Cl-]
36 meas.
MOL
3D
#1987
Ru(2)
donors: {"P": 1, "N": 1}
CC1(C)O[C@H]2O[C@@H]3C4COP(O4)O[C@@H]3[C@H]2O1.O=C(NCCc1ccccc1)c1c2ccccc2cc2ccccc12.[Cl-].[Cl-]
36 meas.
MOL
3D
#1986
Ru(2)
donors: {"P": 1, "N": 1}
CC1(C)O[C@H]2O[C@@H]3C4COP(O4)O[C@@H]3[C@H]2O1.O=C(NCc1ccccc1)c1c2ccccc2cc2ccccc12.[Cl-].[Cl-]
36 meas.
MOL
3D
#1985
Ru(2)
donors: {"O": 2, "N": 2, "As": 2}
O=C([O-])c1ccnc(-c2cc(C(=O)O)ccn2)c1.[C-]#[O+].[Cl-].c1ccc([As](c2ccccc2)c2ccccc2)cc1.c1ccc([As](c2ccccc2)c2ccccc2)cc1
6 meas.
MOL
3D
#1984
Ru(2)
donors: {"O": 2, "N": 2, "P": 2}
O=C([O-])c1ccnc(-c2cc(C(=O)O)ccn2)c1.[C-]#[O+].[Cl-].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
6 meas.
MOL
3D
#1983
Ru(2)
donors: {"O": 1, "N": 2, "As": 1}
[C-]#[O+].[Cl-].[H-].c1ccc(-c2ccccn2)nc1.c1ccc([As](c2ccccc2)c2ccccc2)cc1
6 meas.
MOL
3D
#1982
Ru(2)
donors: {"O": 1, "N": 2, "P": 1}
[C-]#[O+].[Cl-].[H-].c1ccc(-c2ccccn2)nc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
6 meas.
MOL
3D
#1981
Ru(2)
donors: {"N": 6}
Nc1cc[c-]c(-c2ccccn2)c1.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12
2 meas.
MOL
3D
#1980
Ru(2)
donors: {"O": 1, "N": 5}
O=[N+]([O-])c1cc[c-]c(-c2ccccn2)c1.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12
2 meas.
MOL
3D
#1979
Ru(2)
donors: {"S": 2, "O": 2, "N": 3}
CS(C)=O.CS(C)=O.O=C(N/N=C(\c1ccccc1)c1ccccn1)c1ccco1.[Cl-].[Cl-]
2 meas.
MOL
3D
#1978
Ru(2)
donors: {"O": 2, "N": 3, "P": 2}
[C-]#[O+].[H-].[O-]/C(=N\N=C(/c1ccccc1)c1ccccn1)c1ccco1.c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
2 meas.
MOL
3D
#1977
Ru(2)
donors: {"N": 2}
Cc1ccc(C(C)C)cc1.O=c1[nH]c2cnccc2c2ccccc12.[Cl-].[Cl-]
5 meas.
MOL
3D
#1976
Ru(2)
donors: {"N": 2}
Cc1ccc(C(C)C)cc1.O=c1[nH]cnc2ccccc12.[Cl-].[Cl-]
5 meas.
MOL
3D
#1975
Ru(2)
donors: {"N": 2}
Cc1ccc(C(C)C)cc1.NC(=O)c1cccnc1.[Cl-].[Cl-]
5 meas.
MOL
3D
#1974
Ru(2)
donors: {"N": 2, "S": 1, "O": 1, "As": 2}
Oc1ccc2ccccc2c1/C=N/N=C(/[S-])SCc1ccccc1.[C-]#[O+].[Cl-].c1ccc([As](c2ccccc2)c2ccccc2)cc1.c1ccc([As](c2ccccc2)c2ccccc2)c...
2 meas.
MOL
3D
#1973
Ru(2)
donors: {"N": 2, "S": 1, "O": 1, "P": 2}
Oc1ccc2ccccc2c1/C=N/N=C(/[S-])SCc1ccccc1.[C-]#[O+].[Cl-].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1
2 meas.
MOL
3D
#1972
Ru(2)
donors: {"N": 5}
CC#N.Cc1cc(-c2ccccn2)[c-]c(-c2ccccn2)c1.c1cnc2c(c1)ccc1cccnc12
2 meas.
MOL
3D
#1971
Ru(2)
donors: {"N": 6}
NCCCNCCCCNCCCNC(=O)c1ccc(-c2[c-]cccc2)nc1.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12
2 meas.
MOL
3D
#1970
Ru(2)
donors: {"N": 7}
c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1.c1ccc2c(c1)[nH]c1cnccc12
8 meas.
MOL
3D
#1969
Ru(2)
donors: {"N": 8}
c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc(Nc2ccccn2)nc1.c1ccc2c(c1)[nH]c1cnccc12
8 meas.
MOL
3D
#1968
Ru(2)
donors: {"N": 7}
c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc2c(c1)[nH]c1cnccc12.c1cnc2c(c1)ccc1cccnc12
8 meas.
MOL
3D
#1967
Ru(2)
donors: {"N": 7}
c1ccc(-c2cccc(-c3ccccn3)n2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc2c(c1)[nH]c1cnccc12
8 meas.
MOL
3D
#1966
Ru(3)
donors: {"O": 2, "N": 2}
CC(/C=C(\[O-])c1ccccc1)=N\CC/N=C(\C)c1ccc(O)cc1[O-].O.[Cl-]
3 meas.
MOL
3D
#1965
Ru(3)
donors: {"O": 2, "N": 2}
C/C([O-])=C/C(C)=N/CC/N=C(\C)c1ccc(O)cc1[O-].O.[Cl-]
3 meas.
MOL
3D
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149/189 (9414 total)