Ligand

Cas#: 1157867-61-2        Compound CID:  92132781

Formula:  C₃₅H₅₃ClN₂        Molecular Weight: 537.26

IUPAC Name: 1,3-bis[2,6-di(pentan-3-yl)phenyl]imidazol-1-ium;chloride

SMILES: CCC(CC)C1=C(C(=CC=C1)C(CC)CC)N2C=C[N+](=C2)C3=C(C=CC=C3C(CC)CC)C(CC)CC.[Cl-]

InChIKey: ODQOSTRWDUNLQB-UHFFFAOYSA-M

InChI: InChI=1S/C35H53N2.ClH/c1-9-26(10-2)30-19-17-20-31(27(11-3)12-4)34(30)36-23-24-37(25-36)35-32(28(13-5)14-6)21-18-22-33(35)29(15-7)16-8;/h17-29H,9-16H2,1-8H3;1H/q+1;/p-1

Cas#: 62613-15-4        Compound CID:  2737135

Formula:  C₁₂H₁₀AsF₆I        Molecular Weight: 470.03

IUPAC Name: diphenyliodanium;hexafluoroarsenic(1-)

SMILES: C1=CC=C(C=C1)[I+]C2=CC=CC=C2.F[As-](F)(F)(F)(F)F

InChIKey: KFGZTBBPOZNSHA-UHFFFAOYSA-N

InChI: InChI=1S/C12H10I.AsF6/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;2-1(3,4,5,6)7/h1-10H;/q+1;-1

Cas#: 1067-55-6        Compound CID:  16683107

Formula:  C₁₀H₂₄O₂Sn        Molecular Weight: 295.01

IUPAC Name: dibutyl(dimethoxy)stannane

SMILES: CCCC[Sn](CCCC)(OC)OC

InChIKey: ZXDVQYBUEVYUCG-UHFFFAOYSA-N

InChI: InChI=1S/2C4H9.2CH3O.Sn/c2*1-3-4-2;2*1-2;/h2*1,3-4H2,2H3;2*1H3;/q;;2*-1;+2

Cas#: 1260119-00-3        Compound CID:  164886345

Formula:  C₄₈H₃₄N₆O₃₂Zr₆        Molecular Weight: 1754.15

IUPAC Name: 2-aminoterephthalic acid;zirconium;octahydrate

SMILES: C1=CC(=C(C=C1C(=O)O)N)C(=O)O.C1=CC(=C(C=C1C(=O)O)N)C(=O)O.C1=CC(=C(C=C1C(=O)O)N)C(=O)O.C1=CC(=C(C=C1C(=O)O)N)C(=O)O.C1=CC(=C(C=C1C(=O)O)N)C(=O)O.C1=CC(=C(C=C1C(=O)O)N)C(=O)O.O.O.O.O.O.O.O.O.[Zr].[Zr].[Zr].[Zr].[Zr].[Zr]

InChIKey: NVQXJDDKUVIYOG-UHFFFAOYSA-N

InChI: InChI=1S/6C8H7NO4.8H2O.6Zr/c6*9-6-3-4(7(10)11)1-2-5(6)8(12)13;;;;;;;;;;;;;;/h6*1-3H,9H2,(H,10,11)(H,12,13);8*1H2;;;;;;

Cas#: 59061-53-9        Compound CID:  15245636

Formula:  C₈H₁₀N₄Zn        Molecular Weight: 227.58

IUPAC Name: zinc;2-methylimidazol-3-ide

SMILES: CC1=NC=C[N-]1.CC1=NC=C[N-]1.[Zn+2]

InChIKey: MFLKDEMTKSVIBK-UHFFFAOYSA-N

InChI: InChI=1S/2C4H5N2.Zn/c2*1-4-5-2-3-6-4;/h2*2-3H,1H3;/q2*-1;+2

Cas#: 1309760-94-8        Compound CID:  154703048

Formula:  C₄₈H₃₄N₆O₃₆Ti₈        Molecular Weight: 1653.74

IUPAC Name: 2-aminoterephthalate;oxygen(2-);titanium(4+);tetrahydroxide

SMILES: C1=CC(=C(C=C1C(=O)[O-])N)C(=O)[O-].C1=CC(=C(C=C1C(=O)[O-])N)C(=O)[O-].C1=CC(=C(C=C1C(=O)[O-])N)C(=O)[O-].C1=CC(=C(C=C1C(=O)[O-])N)C(=O)[O-].C1=CC(=C(C=C1C(=O)[O-])N)C(=O)[O-].C1=CC(=C(C=C1C(=O)[O-])N)C(=O)[O-].[OH-].[OH-].[OH-].[OH-].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4]

InChIKey: JMUQHBVQFASBBK-UHFFFAOYSA-A

InChI: InChI=1S/6C8H7NO4.4H2O.8O.8Ti/c6*9-6-3-4(7(10)11)1-2-5(6)8(12)13;;;;;;;;;;;;;;;;;;;;/h6*1-3H,9H2,(H,10,11)(H,12,13);4*1H2;;;;;;;;;;;;;;;;/q;;;;;;;;;;8*-2;8*+4/p-16

Cas#: 96392-77-7        Compound CID:  5200652

Formula:  C₁₆H₁₄Br₂        Molecular Weight: 366.1

IUPAC Name: 5,11-dibromotricyclo[8.2.2.24,7]hexadeca-1(12),4,6,10,13,15-hexaene

SMILES: C1CC2=C(C=C(CCC3=C(C=C1C=C3)Br)C=C2)Br

InChIKey: QDMAXRJHDMKTQH-UHFFFAOYSA-N

InChI: InChI=1S/C16H14Br2/c17-15-9-11-1-5-13(15)8-4-12-2-6-14(7-3-11)16(18)10-12/h1-2,5-6,9-10H,3-4,7-8H2

Cas#: 120-80-9        Compound CID:  289

Formula:  C₆H₆O₂        Molecular Weight: 110.11

IUPAC Name: benzene-1,2-diol

SMILES: C1=CC=C(C(=C1)O)O

InChIKey: YCIMNLLNPGFGHC-UHFFFAOYSA-N

InChI: InChI=1S/C6H6O2/c7-5-3-1-2-4-6(5)8/h1-4,7-8H

Cas#: 120-80-9(methanol)       

Formula:        

SMILES: Oc1ccccc1O

InChIKey: YCIMNLLNPGFGHC-UHFFFAOYSA-N

InChI: 1S/C6H6O2/c7-5-3-1-2-4-6(5)8/h1-4,7-8H

Cas#: 1494801-76-1        Compound CID:  112722440

Formula:  C₁₄H₂₂N₃S        Molecular Weight: 250.4

IUPAC Name: N-(2-phenylsulfanylethyl)-2-pyrrolidin-1-ylethanamine

SMILES: C1CCN(C1)CCNCCSC2=CC=CC=C2

InChIKey: HFHFGIYGEBDJAA-UHFFFAOYSA-N

InChI: InChI=1S/C14H22N2S/c1-2-6-14(7-3-1)17-13-9-15-8-12-16-10-4-5-11-16/h1-3,6-7,15H,4-5,8-13H2

Cas#: 1179894-18-8        Compound CID:  60698108

Formula:  C₁₄H₂₂N₂OS        Molecular Weight: 266.4

IUPAC Name: 2-morpholin-4-yl-N-(2-phenylsulfanylethyl)ethanamine

SMILES: C1COCCN1CCNCCSC2=CC=CC=C2

InChIKey: QZXXNGSHWPYOBV-UHFFFAOYSA-N

InChI: InChI=1S/C14H22N2OS/c1-2-4-14(5-3-1)18-13-7-15-6-8-16-9-11-17-12-10-16/h1-5,15H,6-13H2

Cas#: 1803572-24-8        Compound CID:  73014170

Formula:  C₁₁H₁₃NO₄・HCl        Molecular Weight: 259.69

IUPAC Name: 2-amino-3-[4-(carboxymethyl)phenyl]propanoic acid;hydrochloride

SMILES: C1=CC(=CC=C1CC(C(=O)O)N)CC(=O)O.Cl

InChIKey: UHQUHPFJRUJHRH-UHFFFAOYSA-N

InChI: InChI=1S/C11H13NO4.ClH/c12-9(11(15)16)5-7-1-3-8(4-2-7)6-10(13)14;/h1-4,9H,5-6,12H2,(H,13,14)(H,15,16);1H