Crystallography Open Database

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1556678 CIFC21 H13 NP 1 21/c 112.2207; 8.2084; 14.738
90; 105.697; 90
1423.3Lucenti, E.; Forni, A.; Marinotto, D.; Previtali, A.; Righetto, S.; Cariati, E.
Tuning the Linear and Nonlinear Optical Properties of Pyrene-Pyridine Chromophores by Protonation and Complexation to d10 Metal Centers
Inorganics, 2019, 7, 38
1556679 CIFC23 H17 NP -18.2054; 9.7248; 10.4571
85.133; 79.4; 74.341
789.21Lucenti, E.; Forni, A.; Marinotto, D.; Previtali, A.; Righetto, S.; Cariati, E.
Tuning the Linear and Nonlinear Optical Properties of Pyrene-Pyridine Chromophores by Protonation and Complexation to d10 Metal Centers
Inorganics, 2019, 7, 38
1556680 CIFC23 H17 Cu I NP 1 21/c 120.4752; 4.502; 20.208
90; 103.158; 90
1813.86Lucenti, E.; Forni, A.; Marinotto, D.; Previtali, A.; Righetto, S.; Cariati, E.
Tuning the Linear and Nonlinear Optical Properties of Pyrene-Pyridine Chromophores by Protonation and Complexation to d10 Metal Centers
Inorganics, 2019, 7, 38
1556681 CIFC46 H32 N2 O4 ZnP n m a12.5192; 24.7373; 11.2498
90; 90; 90
3484Lucenti, E.; Forni, A.; Marinotto, D.; Previtali, A.; Righetto, S.; Cariati, E.
Tuning the Linear and Nonlinear Optical Properties of Pyrene-Pyridine Chromophores by Protonation and Complexation to d10 Metal Centers
Inorganics, 2019, 7, 38
1556682 CIFC15 H33 B10 Cl Ge N2P c a 2116.166; 11.279; 12.294
90; 90; 90
2241.6Liebing, P.; Harmgarth, N.; Zorner, F.; Engelhardt, F.; Hilfert, L.; Busse, S.; Edelmann, F.T.
Synthesis and Structural Characterization of Two New Main Group Element Carboranylamidinates
Inorganics, 2019, 7, 41
1556683 CIFC9 H25 B10 Cl2 N2 SbC 1 2/c 126.796; 8.141; 18.666
90; 103.29; 90
3963Liebing, P.; Harmgarth, N.; Zorner, F.; Engelhardt, F.; Hilfert, L.; Busse, S.; Edelmann, F.T.
Synthesis and Structural Characterization of Two New Main Group Element Carboranylamidinates
Inorganics, 2019, 7, 41
1556684 CIFC60 H70 Ni P2 S2P -110.7068; 16.6627; 17.9475
117.108; 92.836; 106.327
2675.5Alrefai, R.; Eggenweiler, H.; Schubert, H.; Berkefeld, A.
Understanding Factors that Control the Structural (Dis)Assembly of Sulphur-Bridged Bimetallic Sites
Inorganics, 2019, 7, 42
1556685 CIFC38 H44 F6 N Ni O4 P S3P -18.9541; 14.157; 16.8972
104.278; 98.592; 97.958
2017.85Alrefai, R.; Eggenweiler, H.; Schubert, H.; Berkefeld, A.
Understanding Factors that Control the Structural (Dis)Assembly of Sulphur-Bridged Bimetallic Sites
Inorganics, 2019, 7, 42
1556686 CIFC4 H20 B6 N3 O13.5 ZnC 1 2/c 126.0212; 9.1562; 13.6318
90; 99.58; 90
3202.55Altahan, M.A.; Beckett, M.A.; Coles, S.J.; Horton, P.N.
Hexaborate(2-) and Dodecaborate(6-) Anions as Ligands to Zinc(II) Centres: Self-Assembly and Single-Crystal XRD Characterization of [Zn{k3O-B6O7(OH)6}(k3N-dien)].0.5H2O (dien = NH(CH2-CH2NH2)2), (NH4)2[Zn{k2O-B6O7(OH)6}2 (H2O)2].2H2O and (1,3-pnH2)3[(k1N-H3N{CH2}3NH2) Zn{k3O-B12O18(OH)6}]2.14H2O (1,3-pn = 1,3-diaminopropane)
Inorganics, 2019, 7, 44
1556687 CIFB12 H28 N2 O30 ZnP -17.4831; 7.8551; 11.0111
108.065; 95.02; 90.118
612.68Altahan, M.A.; Beckett, M.A.; Coles, S.J.; Horton, P.N.
Hexaborate(2-) and Dodecaborate(6-) Anions as Ligands to Zinc(II) Centres: Self-Assembly and Single-Crystal XRD Characterization of [Zn{k3O-B6O7(OH)6}(k3N-dien)].0.5H2O (dien = NH(CH2-CH2NH2)2), (NH4)2[Zn{k2O-B6O7(OH)6}2 (H2O)2].2H2O and (1,3-pnH2)3[(k1N-H3N{CH2}3NH2) Zn{k3O-B12O18(OH)6}]2.14H2O (1,3-pn = 1,3-diaminopropane)
Inorganics, 2019, 7, 44
1556688 CIFC7.5 H49 B12 N5 O31 ZnP -19.3681; 10.691; 19.2746
82.954; 76.156; 68.655
1744.44Altahan, M.A.; Beckett, M.A.; Coles, S.J.; Horton, P.N.
Hexaborate(2-) and Dodecaborate(6-) Anions as Ligands to Zinc(II) Centres: Self-Assembly and Single-Crystal XRD Characterization of [Zn{k3O-B6O7(OH)6}(k3N-dien)].0.5H2O (dien = NH(CH2-CH2NH2)2), (NH4)2[Zn{k2O-B6O7(OH)6}2 (H2O)2].2H2O and (1,3-pnH2)3[(k1N-H3N{CH2}3NH2) Zn{k3O-B12O18(OH)6}]2.14H2O (1,3-pn = 1,3-diaminopropane)
Inorganics, 2019, 7, 44
1556689 CIFC22 H40 I16 N8P -18.3; 16.191; 21.221
108.167; 94.071; 104.453
2589.3Savastano, M.; Martinez-Camarena, A.; Bazzicalupi, C.; Delgado-Pinar, E.; Llinares, J.M.; Mariani, P.; Verdejo, B.; Garcia-Espana, E.; Bianchi, A.
Stabilization of Supramolecular Networks of Polyiodides with Protonated Small Tetra-azacyclophanes
Inorganics, 2019, 7, 48
1556690 CIFC14 H23 I14 N4 OP 1 21/m 19.226; 13.06; 17.377
90; 104.671; 90
2025.5Savastano, M.; Martinez-Camarena, A.; Bazzicalupi, C.; Delgado-Pinar, E.; Llinares, J.M.; Mariani, P.; Verdejo, B.; Garcia-Espana, E.; Bianchi, A.
Stabilization of Supramolecular Networks of Polyiodides with Protonated Small Tetra-azacyclophanes
Inorganics, 2019, 7, 48
1556691 CIFC15 H25 Cl3 Cu N2 O4P -17.706; 10.274; 13.666
93.846; 92.271; 107.216
1029.1Butsch, K.; Sandleben, A.; Dokoohaki, M.H.; Zolghadr, A.R.; Klein, A.
Pyridine-2,6-Dicarboxylic Acid Esters (pydicR2) as O,N,O-Pincer Ligands in CuII Complexes
Inorganics, 2019, 7, 53
1556692 CIFC14 H6 Cl2 Cu3 N2 O14P -18.185; 9.5; 9.682
69.01; 66.97; 89.04
640.2Butsch, K.; Sandleben, A.; Dokoohaki, M.H.; Zolghadr, A.R.; Klein, A.
Pyridine-2,6-Dicarboxylic Acid Esters (pydicR2) as O,N,O-Pincer Ligands in CuII Complexes
Inorganics, 2019, 7, 53
1556693 CIFC19 H11 I2 N O4P b c a13.52; 14.455; 19.496
90; 90; 90
3810Butsch, K.; Sandleben, A.; Dokoohaki, M.H.; Zolghadr, A.R.; Klein, A.
Pyridine-2,6-Dicarboxylic Acid Esters (pydicR2) as O,N,O-Pincer Ligands in CuII Complexes
Inorganics, 2019, 7, 53
1556694 CIFC10 H12 N4 NiC 1 2/c 19.5916; 33.666; 13.3219
90; 105.255; 90
4150.2Wang, D.; Moutet, J.; Tricoire, M.; Cordier, M.; Nocton, G.
Reactive Heterobimetallic Complex Combining Divalent Ytterbium and Dimethyl Nickel Fragments
Inorganics, 2019, 7, 58
1556695 CIFC37 H50 N4 Ni YbP -19.4362; 10.7558; 17.0271
103.204; 94.65; 93.872
1670.3Wang, D.; Moutet, J.; Tricoire, M.; Cordier, M.; Nocton, G.
Reactive Heterobimetallic Complex Combining Divalent Ytterbium and Dimethyl Nickel Fragments
Inorganics, 2019, 7, 58
1556696 CIFC56 H53 B Br Ir O3 P4C 1 2/c 140.6382; 12.2295; 24.2274
90; 125.09; 90
9852.3Maser, L.; Schneider, C.; Alig, L.; Langer, R.
Comparing the Acidity of (R3P)2BH-Based Donor Groups in Iridium Pincer Complexes
Inorganics, 2019, 7, 61
1556697 CIFC43 H45 Br2 N5 PdP 1 21/n 120.957; 8.1726; 22.929
90; 106.623; 90
3763Messelberger, J.; Grunwald, A.; Stegner, P.; Senft, L.; Heinemann, F.W.; Munz, D.
Transmetalation from Magnesium-NHCs-Convenient Synthesis of Chelating pi-Acidic NHC Complexes
Inorganics, 2019, 7, 65
1556698 CIFC50 H60 Br2 Mg N8P 1 21/n 119.086; 12.8472; 20.6882
90; 111.643; 90
4715.1Messelberger, J.; Grunwald, A.; Stegner, P.; Senft, L.; Heinemann, F.W.; Munz, D.
Transmetalation from Magnesium-NHCs-Convenient Synthesis of Chelating pi-Acidic NHC Complexes
Inorganics, 2019, 7, 65
1556705 CIFC16 H32 Cu N6 O4P 1 21/c 124.916; 9.3586; 9.3255
90; 92.291; 90
2172.8Nesterova, O.V.; Kopylovich, M.N.; Nesterov, D.S.
A Comparative Study of the Catalytic Behaviour of Alkoxy-1,3,5-Triazapentadiene Copper(II) Complexes in Cyclohexane Oxidation
Inorganics, 2019, 7, 82
1556706 CIFC10 H16 Cl2 Cu N4 O2P -15.6535; 10.3149; 13.5498
108.336; 95.921; 98.615
732.01Gayfullina, R.; Jaaskelainen, S.; Koshevoy, I.O.; Hirva, P.
Activation of the Cyano Group at Imidazole via Copper Stimulated Alcoholysis
Inorganics, 2019, 7, 87
1556707 CIFC14 H16 Cl4 Cu2 N8 O2P -17.1887; 7.4368; 10.5356
82.585; 89.776; 84.799
556.22Gayfullina, R.; Jaaskelainen, S.; Koshevoy, I.O.; Hirva, P.
Activation of the Cyano Group at Imidazole via Copper Stimulated Alcoholysis
Inorganics, 2019, 7, 87
1556708 CIFC14 H16 Br4 Cu2 N8 O2P -17.3978; 7.6151; 10.7043
81.023; 88.684; 84.835
593.2Gayfullina, R.; Jaaskelainen, S.; Koshevoy, I.O.; Hirva, P.
Activation of the Cyano Group at Imidazole via Copper Stimulated Alcoholysis
Inorganics, 2019, 7, 87
1556709 CIFC8 H10 Br2 Cu N4 OP -17.3737; 8.4147; 10.6554
83.614; 76.079; 75.706
620.91Gayfullina, R.; Jaaskelainen, S.; Koshevoy, I.O.; Hirva, P.
Activation of the Cyano Group at Imidazole via Copper Stimulated Alcoholysis
Inorganics, 2019, 7, 87
1557223 CIFC55.6 H49 Br2 Cl2 Cu F6 N2 O1.9 P3P -110.93; 14.2927; 19.2894
70.366; 86.491; 73.206
2715Nohara, Isaak; Keller, Aramis; Tarassenko, Nikolai; Prescimone, Alessandro; Constable, Edwin C.; Housecroft, Catherine E.
Heteroleptic [Cu(P^P)(N^N)][PF6] Compounds with Isomeric Dibromo-1,10-Phenanthroline Ligands
Inorganics, 2020, 8, 4
1557224 CIFC49 H36 Br2 Cl2 Cu F6 N2 O P3P -112.4032; 18.9805; 22.0591
70.33; 77.791; 87.292
4777.9Nohara, Isaak; Keller, Aramis; Tarassenko, Nikolai; Prescimone, Alessandro; Constable, Edwin C.; Housecroft, Catherine E.
Heteroleptic [Cu(P^P)(N^N)][PF6] Compounds with Isomeric Dibromo-1,10-Phenanthroline Ligands
Inorganics, 2020, 8, 4
1557225 CIFC50 H39 Br2 Cu F6 N2 O1.5 P3P -115.1949; 18.5322; 18.5423
107.867; 104.444; 101.088
4603.2Nohara, Isaak; Keller, Aramis; Tarassenko, Nikolai; Prescimone, Alessandro; Constable, Edwin C.; Housecroft, Catherine E.
Heteroleptic [Cu(P^P)(N^N)][PF6] Compounds with Isomeric Dibromo-1,10-Phenanthroline Ligands
Inorganics, 2020, 8, 4
1557226 CIFC54.9 H47.2 Br2 Cl2.2 Cu F6 N2 O1.7 P3P -110.1768; 13.7504; 20.1505
90.204; 98.12; 99.535
2751.9Nohara, Isaak; Keller, Aramis; Tarassenko, Nikolai; Prescimone, Alessandro; Constable, Edwin C.; Housecroft, Catherine E.
Heteroleptic [Cu(P^P)(N^N)][PF6] Compounds with Isomeric Dibromo-1,10-Phenanthroline Ligands
Inorganics, 2020, 8, 4
1557227 CIFC52.1 H40.2 Br2 Cl2.2 Cu F6 N2 O P3C 1 2/m 133.3182; 14.105; 11.8205
90; 102.059; 90
5432.5Nohara, Isaak; Keller, Aramis; Tarassenko, Nikolai; Prescimone, Alessandro; Constable, Edwin C.; Housecroft, Catherine E.
Heteroleptic [Cu(P^P)(N^N)][PF6] Compounds with Isomeric Dibromo-1,10-Phenanthroline Ligands
Inorganics, 2020, 8, 4
1557742 CIFC2 H0.064 D0.936 O5 SbP n m a5.8207; 11.2873; 6.3126
90; 90; 90
414.74Kohlmann, Holger; Rauchmaul, Anne; Keilholz, Simon; Franz, Alexandra
Crystal Structure and Thermal Behavior of SbC2O4OH and SbC2O4OD
Inorganics, 2020, 8, 21
1558002 CIFC12 H10 O3 S2C 1 2/c 130.24; 3.9413; 20.418
90; 107.77; 90
2317.4Ahmadi, Mohsen; Correia, Jevy; Chrysochos, Nicolas; Schulzke, Carola
A Mixed-Valence Tetra-Nuclear Nickel Dithiolene Complex: Synthesis, Crystal Structure, and the Lability of Its Nickel Sulfur Bonds
Inorganics, 2020, 8, 27
1558003 CIFC72 H74 K2 N2 Ni4 O14 S12P 1 21/n 113.588; 19.062; 16.764
90; 100.11; 90
4274.7Ahmadi, Mohsen; Correia, Jevy; Chrysochos, Nicolas; Schulzke, Carola
A Mixed-Valence Tetra-Nuclear Nickel Dithiolene Complex: Synthesis, Crystal Structure, and the Lability of Its Nickel Sulfur Bonds
Inorganics, 2020, 8, 27
1558185 CIFC47 H37 Cl Cu F6 N2 O P3P 1 21/c 110.4786; 18.9864; 22.1096
90; 100.077; 90
4330.87Meyer, Marco; Brunner, Fabian; Prescimone, Alessandro; Constable, Edwin C.; Housecroft, Catherine E.
Chimera Diimine Ligands in Emissive [Cu(P^P)(N^N)][PF6] Complexes
Inorganics, 2020, 8, 33
1558186 CIFC50 H41 Cl Cu F6 N2 O P3P -111.4363; 14.0871; 14.803
89.133; 68.457; 88.73
2217.62Meyer, Marco; Brunner, Fabian; Prescimone, Alessandro; Constable, Edwin C.; Housecroft, Catherine E.
Chimera Diimine Ligands in Emissive [Cu(P^P)(N^N)][PF6] Complexes
Inorganics, 2020, 8, 33
1558187 CIFC29 H27 N O SnP 1 21/n 19.3351; 18.4709; 14.3598
90; 93.846; 90
2470.5Bender, Desiree N.; Lough, Alan J.; Wylie, R. Stephen; Gossage, Robert A.; Foucher, Daniel A.
Preparation and DFT Studies of κ2C,N-Hypercoordinated Oxazoline Organotins: Monomer Constructs for Stable Polystannanes
Inorganics, 2020, 8, 35
1558188 CIFC23 H22 Cl N O SnP -19.1303; 9.302; 24.2461
90.942; 91.775; 91.724
2056.99Bender, Desiree N.; Lough, Alan J.; Wylie, R. Stephen; Gossage, Robert A.; Foucher, Daniel A.
Preparation and DFT Studies of κ2C,N-Hypercoordinated Oxazoline Organotins: Monomer Constructs for Stable Polystannanes
Inorganics, 2020, 8, 35
1558189 CIFC17 H17 Br2 N O SnP 1 21/n 110.5295; 10.0336; 17.1396
90; 96.677; 90
1798.5Bender, Desiree N.; Lough, Alan J.; Wylie, R. Stephen; Gossage, Robert A.; Foucher, Daniel A.
Preparation and DFT Studies of κ2C,N-Hypercoordinated Oxazoline Organotins: Monomer Constructs for Stable Polystannanes
Inorganics, 2020, 8, 35
1558190 CIFC18 H19 Br2 N O SnP -18.453; 10.2368; 11.7987
93.059; 101.936; 108.325
940.5Bender, Desiree N.; Lough, Alan J.; Wylie, R. Stephen; Gossage, Robert A.; Foucher, Daniel A.
Preparation and DFT Studies of κ2C,N-Hypercoordinated Oxazoline Organotins: Monomer Constructs for Stable Polystannanes
Inorganics, 2020, 8, 35
1558191 CIFC30 H29 N O SnP 21 21 218.4502; 18.9557; 31.5231
90; 90; 90
5049.4Bender, Desiree N.; Lough, Alan J.; Wylie, R. Stephen; Gossage, Robert A.; Foucher, Daniel A.
Preparation and DFT Studies of κ2C,N-Hypercoordinated Oxazoline Organotins: Monomer Constructs for Stable Polystannanes
Inorganics, 2020, 8, 35
1558192 CIFC133 H101 Cl5 I3 N9 Ni12 O35P -119.422; 22.654; 25.321
115.783; 92.992; 106.118
9443Perlepe, Panagiota S.; Pantelis, Konstantinos N.; Cunha-Silva, Luís; Bekiari, Vlasoula; Escuer, Albert; Stamatatos, Theocharis C.
Rare Nuclearities in Ni(II) Cluster Chemistry: An Unprecedented {Ni12} Nanosized Cage from the Use of N-Naphthalidene-2-Amino-5-Chlorobenzoic Acid
Inorganics, 2020, 8, 32
1558993 CIFC62 H53 Ag2 N9 O6 P4P 1 21/n 19.2947; 18.5982; 18.3144
90; 90.534; 90
3165.78Artem’ev, Alexander V.; Davydova, Maria P.; Berezin, Alexey S.; Samsonenko, Denis G.
Synthesis and Thermochromic Luminescence of Ag(I) Complexes Based on 4,6-Bis(diphenylphosphino)-Pyrimidine
Inorganics, 2020, 8, 46
1558994 CIFC36 H34 Ag2 B2 F8 N6 P2P 21 21 2113.2478; 15.6986; 19.701
90; 90; 90
4097.25Artem’ev, Alexander V.; Davydova, Maria P.; Berezin, Alexey S.; Samsonenko, Denis G.
Synthesis and Thermochromic Luminescence of Ag(I) Complexes Based on 4,6-Bis(diphenylphosphino)-Pyrimidine
Inorganics, 2020, 8, 46
1559473 CIFB2 Ba H14 N2P n c 26.7784; 6.7175; 8.6991
90; 90; 90
396.1Grinderslev, Jakob B.; Amdisen, Mads B.; Jensen, Torben R.
Synthesis, Crystal Structures and Thermal Properties of Ammine Barium Borohydrides
Inorganics, 2020, 8, 57
1559474 CIFB2 Ba H11 NP 21 21 215.08626; 9.37609; 12.9631
90; 90; 90
618.2Grinderslev, Jakob B.; Amdisen, Mads B.; Jensen, Torben R.
Synthesis, Crystal Structures and Thermal Properties of Ammine Barium Borohydrides
Inorganics, 2020, 8, 57
1562365 CIFB K1.78 Na1.22 O14 Si4 UC m c e15.5471; 14.3403; 11.7315
90; 90; 90
2615.5Pace, Kristen A.; Klepov, Vladislav V.; Smith, Mark D.; Williams, Travis; Morrison, Gregory; Lauterbach, Jochen A.; Misture, Scott T.; zur Loye, Hans-Conrad
Hydrothermal Synthesis and Structural Investigation of a Crystalline Uranyl Borosilicate
Inorganics, 2021, 9, 25
1562366 CIFC40.5 H34 F6 N7 O4.5 P RuP 1 21/c 18.431; 35.524; 13.404
90; 99.315; 90
3962Shiga, Takuya; Tachibana, Minami; Oshio, Hiroki; Nihei, Masayuki
Synthesis of a Ru(II) Complex with a Naphthoquinone-Annelated Imidazole Ligand Exhibiting Proton-Responsive Redox and Luminescent Behavior
Inorganics, 2021, 9, 24
1563173 CIFC16 H22 Cl2 N4 RuP 1 21/n 19.3972; 17.3629; 12.9511
90; 97.019; 90
2097.3Matveevskaya, Vladislava V.; Pavlov, Dmitry I.; Samsonenko, Denis G.; Ermakova, Ekaterina A.; Klyushova, Lyubov S.; Baykov, Sergey V.; Boyarskiy, Vadim P.; Potapov, Andrei S.
Synthesis and Structural Characterization of Half-Sandwich Arene‒Ruthenium(II) Complexes with Bis(imidazol-1-yl)methane, Imidazole and Benzimidazole
Inorganics, 2021, 9, 34
1563174 CIFC36 H52 Cl4 N8 O2 Ru2P 1 21/c 111.7136; 10.34; 17.0882
90; 101.06; 90
2031.26Matveevskaya, Vladislava V.; Pavlov, Dmitry I.; Samsonenko, Denis G.; Ermakova, Ekaterina A.; Klyushova, Lyubov S.; Baykov, Sergey V.; Boyarskiy, Vadim P.; Potapov, Andrei S.
Synthesis and Structural Characterization of Half-Sandwich Arene‒Ruthenium(II) Complexes with Bis(imidazol-1-yl)methane, Imidazole and Benzimidazole
Inorganics, 2021, 9, 34

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