C-H Activation Catalysts

Cas#: 1470-61-7        Compound CID:  3034078

Formula:  C₅H₁₀AgNS₂        Molecular Weight: 256.14

IUPAC Name: silver;N,N-diethylcarbamodithioate

SMILES: CCN(CC)C(=S)[S-].[Ag+]

InChIKey: NSVHDIYWJVLAGH-UHFFFAOYSA-M

InChI: InChI=1S/C5H11NS2.Ag/c1-3-6(4-2)5(7)8;/h3-4H2,1-2H3,(H,7,8);/q;+1/p-1

Cas#: 14588-08-0        Compound CID:  10865532

Formula:  C₄₀H₃₆O₄P₂Pd        Molecular Weight: 749.08

IUPAC Name: acetic acid;palladium;triphenylphosphane

SMILES: CC(=O)O.CC(=O)O.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Pd]

InChIKey: VKYBQFWSQQZDLX-UHFFFAOYSA-N

InChI: InChI=1S/2C18H15P.2C2H4O2.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2*1-2(3)4;/h2*1-15H;2*1H3,(H,3,4);

Cas#: 5518-52-5        Compound CID:  521585

Formula:  C₁₂H₉O₃P        Molecular Weight: 232.17

IUPAC Name: tris(furan-2-yl)phosphane

SMILES: C1=COC(=C1)P(C2=CC=CO2)C3=CC=CO3

InChIKey: DLQYXUGCCKQSRJ-UHFFFAOYSA-N

InChI: InChI=1S/C12H9O3P/c1-4-10(13-7-1)16(11-5-2-8-14-11)12-6-3-9-15-12/h1-9H

Cas#: 7718-54-9        Compound CID:  24385

Formula:  NiCl₂        Molecular Weight: 129.60

IUPAC Name: dichloronickel

SMILES: Cl[Ni]Cl

InChIKey: QMMRZOWCJAIUJA-UHFFFAOYSA-L

InChI: InChI=1S/2ClH.Ni/h2*1H;/q;;+2/p-2

Cas#: 29823-87-8        Compound CID:  9815358

Formula:  C₁₀H₂₃NO        Molecular Weight: 173.3

IUPAC Name: 8-(dimethylamino)octan-1-ol

SMILES: CN(C)CCCCCCCCO

InChIKey: CAKJEDBOIMYCHP-UHFFFAOYSA-N

InChI: InChI=1S/C10H23NO/c1-11(2)9-7-5-3-4-6-8-10-12/h12H,3-10H2,1-2H3

Cas#: 34622-08-7        Compound CID:  2733937

Formula:  C₃F₉NdO₉S₃        Molecular Weight: 591.45

IUPAC Name: neodymium(3+);trifluoromethanesulfonate

SMILES: C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Nd+3]

InChIKey: WYRSPTDNOIZOGA-UHFFFAOYSA-K

InChI: InChI=1S/3CHF3O3S.Nd/c3*2-1(3,4)8(5,6)7;/h3*(H,5,6,7);/q;;;+3/p-3

Cas#: 39819-65-3        Compound CID:  14325094

Formula:  C₁₂H₁₀NiO₆S₂·6H₂O        Molecular Weight: 481.11

IUPAC Name: benzenesulfonate;nickel(2+)

SMILES: C1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C=C1)S(=O)(=O)[O-].[Ni+2]

InChIKey: IBVWKDVFDAWRFU-UHFFFAOYSA-L

InChI: InChI=1S/2C6H6O3S.Ni/c2*7-10(8,9)6-4-2-1-3-5-6;/h2*1-5H,(H,7,8,9);/q;;+2/p-2

Cas#: 14647-23-5        Compound CID:  9871585

Formula:  C₂₆H₂₄Cl₂NiP₂        Molecular Weight: 528.02

IUPAC Name: 2-diphenylphosphanylethyl(diphenyl)phosphane;nickel(2+);dichloride

SMILES: C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[Cl-].[Cl-].[Ni+2]

InChIKey: XXECWTBMGGXMKP-UHFFFAOYSA-L

InChI: InChI=1S/C26H24P2.2ClH.Ni/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;;;/h1-20H,21-22H2;2*1H;/q;;;+2/p-2

Cas#: 930796-10-4        Compound CID:  76030762

Formula:  C₃₆H₄₈ClN₃Pd        Molecular Weight: 664.67

IUPAC Name: [1,3-bis[2,6-di(propan-2-yl)phenyl]imidazol-2-ylidene]palladium;N,N-dimethyl-1-phenylmethanamine;chloride

SMILES: CC(C)C1=C(C(=CC=C1)C(C)C)N2C=CN(C2=[Pd])C3=C(C=CC=C3C(C)C)C(C)C.CN(C)CC1=CC=CC=[C-]1.[Cl-]

InChIKey: BGNMDPTYDVUDBP-UHFFFAOYSA-M

InChI: InChI=1S/C27H36N2.C9H12N.ClH.Pd/c1-18(2)22-11-9-12-23(19(3)4)26(22)28-15-16-29(17-28)27-24(20(5)6)13-10-14-25(27)21(7)8;1-10(2)8-9-6-4-3-5-7-9;;/h9-16,18-21H,1-8H3;3-6H,8H2,1-2H3;1H;/q;-1;;/p-1

Cas#: 13965-03-2        Compound CID:  6102075

Formula:  C₃₆H₃₀Cl₂P₂Pd        Molecular Weight: 701.9

IUPAC Name: dichloropalladium;triphenylphosphane

SMILES: C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.Cl[Pd]Cl

InChIKey: YNHIGQDRGKUECZ-UHFFFAOYSA-L

InChI: InChI=1S/2C18H15P.2ClH.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;/h2*1-15H;2*1H;/q;;;;+2/p-2

Cas#: 1058661-78-1        Compound CID:  76030758

Formula:  C₃₀H₃₆ClN₃Pd        Molecular Weight: 580.51

IUPAC Name: [1,3-bis(2,4,6-trimethylphenyl)imidazol-2-ylidene]palladium;N,N-dimethyl-1-phenylmethanamine;chloride

SMILES: CC1=CC(=C(C(=C1)C)N2C=CN(C2=[Pd])C3=C(C=C(C=C3C)C)C)C.CN(C)CC1=CC=CC=[C-]1.[Cl-]

InChIKey: DGPOQJVFBKBRDT-UHFFFAOYSA-M

InChI: InChI=1S/C21H24N2.C9H12N.ClH.Pd/c1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6;1-10(2)8-9-6-4-3-5-7-9;;/h7-12H,1-6H3;3-6H,8H2,1-2H3;1H;/q;-1;;/p-1

Cas#: 39722-81-1        Compound CID:  91972112

Formula:  C₈H₁₆Cl₂Ir₂        Molecular Weight: 567.55

IUPAC Name: ethene;iridium;dichloride

SMILES: C=C.C=C.C=C.C=C.[Cl-].[Cl-].[Ir].[Ir]

InChIKey: KIGDBTYHWLDKQG-UHFFFAOYSA-L

InChI: InChI=1S/4C2H4.2ClH.2Ir/c4*1-2;;;;/h4*1-2H2;2*1H;;/p-2