Crystallography Open Database

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7118380 CIFC20 H37 B7 Ir2P -19.1768; 9.2116; 16.3496
99.379; 101.76; 102.741
1288.09Borthakur, Rosmita; Mondal, Bijan; Nandi, Purbasha; Ghosh, Sundargopal
Hypoelectronic isomeric diiridaboranes [(Cp*Ir)2B6H6]: the "Rule-Breakers"(Cp* = η(5)-C5Me5).
Chemical communications (Cambridge, England), 2016, 52, 3199-3202
7118381 CIFC20 H36 B6 Ir2P 1 21/c 116.4805; 19.9995; 16.6991
90; 117.242; 90
4893.5Borthakur, Rosmita; Mondal, Bijan; Nandi, Purbasha; Ghosh, Sundargopal
Hypoelectronic isomeric diiridaboranes [(Cp*Ir)2B6H6]: the "Rule-Breakers"(Cp* = η(5)-C5Me5).
Chemical communications (Cambridge, England), 2016, 52, 3199-3202
7118382 CIFC23 H26 N O3 PP -18.6783; 11.3201; 12.0032
111.032; 94.279; 105.86
1038.96Wang, Jieping; Siqueira, Gilberto; Müller, Georgina; Rentsch, Daniel; Huch, Anja; Tingaut, Philippe; Levalois-Grützmacher, Joëlle; Grützmacher, Hansjörg
Synthesis of new bis(acyl)phosphane oxide photoinitiators for the surface functionalization of cellulose nanocrystals.
Chemical communications (Cambridge, England), 2016, 52, 2823-2826
7118383 CIFC20 H15 N3 OP 1 21/n 19.7059; 15.7541; 10.525
90; 95.513; 90
1601.91Sadhu, Pradeep; Punniyamurthy, Tharmalingam
Copper(ii)-mediated regioselective N-arylation of pyrroles, indoles, pyrazoles and carbazole via dehydrogenative coupling.
Chemical communications (Cambridge, England), 2016, 52, 2803-2806
7118384 CIFC25 H17 F N2 O2P 1 21/c 110.9284; 18.6077; 10.9054
90; 118.516; 90
1948.6Rajkumar, Subramani; Antony Savarimuthu, S.; Senthil Kumaran, Rajendran; Nagaraja, C. M.; Gandhi, Thirumanavelan
Expedient synthesis of new cinnoline diones by Ru-catalyzed regioselective unexpected deoxygenation-oxidative annulation of propargyl alcohols with phthalazinones and pyridazinones.
Chemical communications (Cambridge, England), 2016, 52, 2509-2512
7118385 CIFC23 H15 N3 O4P 1 21/c 122.748; 10.773; 15.613
90; 102.346; 90
3737.7Rajkumar, Subramani; Antony Savarimuthu, S.; Senthil Kumaran, Rajendran; Nagaraja, C. M.; Gandhi, Thirumanavelan
Expedient synthesis of new cinnoline diones by Ru-catalyzed regioselective unexpected deoxygenation-oxidative annulation of propargyl alcohols with phthalazinones and pyridazinones.
Chemical communications (Cambridge, England), 2016, 52, 2509-2512
7118386 CIFC11 H14 O2 SP 1 21/c 123.952; 5.752; 14.804
90; 100.445; 90
2005.8Albarghouti, Ghassan; Kotikalapudi, Ramesh; Lankri, David; Valerio, Viviana; Tsvelikhovsky, Dmitry
Cascade Pd(ii)-catalyzed Wacker lactonization-Heck reaction: rapid assembly of spiranoid lactones.
Chemical communications (Cambridge, England), 2016, 52, 3095-3098
7118387 CIFC53 H100 N12 Ni2 O24P 1 2/c 118.257; 8.475; 28.615
90; 129.59; 90
3412Jiang, Xiang; Kou, Hui-Zhong
Solid state reconstructive phase transition from porous supramolecular network to porous coordination polymer.
Chemical communications (Cambridge, England), 2016, 52, 2952-2955
7118388 CIFC57 H92 N12 Ni2 O16I 41/a27.286; 27.286; 8.343
90; 90; 90
6212Jiang, Xiang; Kou, Hui-Zhong
Solid state reconstructive phase transition from porous supramolecular network to porous coordination polymer.
Chemical communications (Cambridge, England), 2016, 52, 2952-2955
7118389 CIFC20 H28 Cu N2 O4P -17.5787; 8.0875; 9.6138
72.4479; 68.0319; 85.0439
520.8Paquet, C.; Lacelle, T.; Deore, B.; Kell, A. J.; Liu, X.; Korobkov, I.; Malenfant, P. R. L.
Pyridine-copper(ii) formates for the generation of high conductivity copper films at low temperatures.
Chemical communications (Cambridge, England), 2016, 52, 2605-2608
7118392 CIFCs1.5 H130 Na14.5 Ni7 O180 P4 W30P -112.7488; 12.7765; 25.7791
92.399; 101.831; 104.172
3966Bassil, Bassem S.; Xiang, Yixian; Haider, Ali; Hurtado, Jaime; Novitchi, Ghenadie; Powell, Annie K.; Bossoh, A. Martin; Mbomekallé, Israël M; de Oliveira, Pedro; Kortz, Ulrich
Heptanickel(ii) double-cubane core in wells-dawson heteropolytungstate, [Ni7(OH)6(H2O)6(P2W15O56)2](16.).
Chemical communications (Cambridge, England), 2016, 52, 2601-2604
7118393 CIFC25 H17 N O2 S2P 1 21/c 111.3452; 17.9768; 10.1595
90; 110.197; 90
1944.63Ward, Jonathan S.; Nobuyasu, Roberto S.; Batsanov, Andrei S.; Data, Przemyslaw; Monkman, Andrew P.; Dias, Fernando B.; Bryce, Martin R.
The interplay of thermally activated delayed fluorescence (TADF) and room temperature organic phosphorescence in sterically-constrained donor-acceptor charge-transfer molecules.
Chemical communications (Cambridge, England), 2016, 52, 2612-2615
7118394 CIFC41 H32 Cl2 N2 O2 S3C 1 2/c 120.7971; 11.4101; 15.4184
90; 98.56; 90
3618Ward, Jonathan S.; Nobuyasu, Roberto S.; Batsanov, Andrei S.; Data, Przemyslaw; Monkman, Andrew P.; Dias, Fernando B.; Bryce, Martin R.
The interplay of thermally activated delayed fluorescence (TADF) and room temperature organic phosphorescence in sterically-constrained donor-acceptor charge-transfer molecules.
Chemical communications (Cambridge, England), 2016, 52, 2612-2615
7118395 CIFC42 H34 N2 O2 S3I 1 2/a 112.7719; 13.6832; 19.915
90; 98.962; 90
3437.9Ward, Jonathan S.; Nobuyasu, Roberto S.; Batsanov, Andrei S.; Data, Przemyslaw; Monkman, Andrew P.; Dias, Fernando B.; Bryce, Martin R.
The interplay of thermally activated delayed fluorescence (TADF) and room temperature organic phosphorescence in sterically-constrained donor-acceptor charge-transfer molecules.
Chemical communications (Cambridge, England), 2016, 52, 2612-2615
7118396 CIFC42 H34 N2 O3 S3P 1 21/c 111.6805; 15.8659; 19.4344
90; 98.323; 90
3563.68Ward, Jonathan S.; Nobuyasu, Roberto S.; Batsanov, Andrei S.; Data, Przemyslaw; Monkman, Andrew P.; Dias, Fernando B.; Bryce, Martin R.
The interplay of thermally activated delayed fluorescence (TADF) and room temperature organic phosphorescence in sterically-constrained donor-acceptor charge-transfer molecules.
Chemical communications (Cambridge, England), 2016, 52, 2612-2615
7118397 CIFC26 H26 N2 Ni O6P b c a11.4913; 18.0722; 22.1742
90; 90; 90
4605Shao, Haiyan; Muduli, Subas K.; Tran, Phong D.; Soo, Han Sen
Enhancing electrocatalytic hydrogen evolution by nickel salicylaldimine complexes with alkali metal cations in aqueous media.
Chemical communications (Cambridge, England), 2016, 52, 2948-2951
7118398 CIFC26 H26 F6 K N2 Ni O6 PP 1 21/n 19.4723; 18.6903; 15.7123
90; 96.0152; 90
2766.4Shao, Haiyan; Muduli, Subas K.; Tran, Phong D.; Soo, Han Sen
Enhancing electrocatalytic hydrogen evolution by nickel salicylaldimine complexes with alkali metal cations in aqueous media.
Chemical communications (Cambridge, England), 2016, 52, 2948-2951
7118399 CIFC160 H112 O34P -112.8218; 15.8756; 38.6736
93.295; 93.991; 102.38
7649.3Ichiro Hisaki; Nobuaki Ikenaka; Norimitsu Tohnai; Mikiji Miyata
Polymorphs of layered assemblies of hydrogen-bonded hexagonal networks caused by conformational frustration
Chem.Commun., 2016, 52, 300
7118400 CIFC80 H72 N4 O18P -114.5203; 16.0332; 18.9168
103.209; 94.7721; 106.869
4049.79Ichiro Hisaki; Nobuaki Ikenaka; Norimitsu Tohnai; Mikiji Miyata
Polymorphs of layered assemblies of hydrogen-bonded hexagonal networks caused by conformational frustration
Chem.Commun., 2016, 52, 300
7118401 CIFC166 H126 N2 O36P -115.3014; 20.3447; 28.1624
101.571; 99.3676; 103.554
8144.6Ichiro Hisaki; Nobuaki Ikenaka; Norimitsu Tohnai; Mikiji Miyata
Polymorphs of layered assemblies of hydrogen-bonded hexagonal networks caused by conformational frustration
Chem.Commun., 2016, 52, 300
7118402 CIFC68 H44 O14P -114.5303; 14.9461; 20.2579
102.355; 101.544; 99.0611
4117.4Ichiro Hisaki; Nobuaki Ikenaka; Norimitsu Tohnai; Mikiji Miyata
Polymorphs of layered assemblies of hydrogen-bonded hexagonal networks caused by conformational frustration
Chem.Commun., 2016, 52, 300
7118403 CIFC60 H36 O12P -115.4431; 20.9868; 28.0527
103.362; 98.9655; 105.805
8275.7Ichiro Hisaki; Nobuaki Ikenaka; Norimitsu Tohnai; Mikiji Miyata
Polymorphs of layered assemblies of hydrogen-bonded hexagonal networks caused by conformational frustration
Chem.Commun., 2016, 52, 300
7118404 CIFC68 H44 O14P -119.1278; 22.403; 22.3984
60.046; 87.4093; 81.0545
8209.05Ichiro Hisaki; Nobuaki Ikenaka; Norimitsu Tohnai; Mikiji Miyata
Polymorphs of layered assemblies of hydrogen-bonded hexagonal networks caused by conformational frustration
Chem.Commun., 2016, 52, 300
7118405 CIFC33 H39 Cl3 N2 O3 Ru SP 1 21 17.7787; 22.469; 9.7911
90; 104.593; 90
1656.08B. Vilhanova; J. Vaclavik; P. Sot; J. Pechacek; J. Zapal; R. Pazout; J. Maixner; M. Kuzmac; P. Kacer
Enantioselective hydrogenation of cyclic imines catalysed by Noyori-Ikariya half-sandwich complexes and their analogues
Chem.Commun., 2016, 52, 362
7118406 CIFC200 H274 Dy18 N18 O135 Zn12C 1 2/c 135.409; 30.501; 31.789
90; 115.52; 90
30983Nikoleta Stavgianoudaki; Milosz Siczek; Tadeusz Lis; Ross Inglis; Constantinos J. Milios
A triacontanuclear [Zn12Dy18] cluster: a ring of [Dy4] cubes
Chem.Commun., 2016, 52, 343
7118407 CIFC16 H13 NP b c a16.7246; 7.1468; 20.102
90; 90; 90
2402.7Kai Chen; Zi-Zhong Zhu; Jia-Xin Liu; Xiang-Ying Tang; Yin Wei; Min Shi
Substrate-controlled Rh(II)-catalyzed single-electron-transfer (SET): divergent synthesis of fused indoles
Chem.Commun., 2016, 52, 350
7118408 CIFC19 H17 N OP 1 21/n 19.2535; 14.994; 10.714
90; 101.697; 90
1455.7Kai Chen; Zi-Zhong Zhu; Jia-Xin Liu; Xiang-Ying Tang; Yin Wei; Min Shi
Substrate-controlled Rh(II)-catalyzed single-electron-transfer (SET): divergent synthesis of fused indoles
Chem.Commun., 2016, 52, 350
7118409 CIFC66 H49 N6 O8 TlP 1 21/n 114.4652; 17.501; 23.3205
90; 91.874; 90
5900.6Victoria Ndoyom; Luca Fusaro; Thierry Roisnel; Stephane Le Gac; Bernard Boitrel
Spontaneous Tl(I)-to-Tl(III) oxidation in dynamic heterobimetallic Hg(II)/Tl(I) porphyrin complexes
Chem.Commun., 2016, 52, 517
7118410 CIFC95.5 H129.25 F12 N3.75 O24 P2C 1 c 131.6051; 13.3823; 24.6753
90; 90.155; 90
10436.4Danyu Xia; Peifa Wei; Bingbing Shi; Feihe Huang
A pillar[6]arene-based [2]pseudorotaxane in solution and in the solid state and its photo-responsive self-assembly behavior in solution
Chem.Commun., 2016, 52, 513
7118411 CIFC19 H18 Eu N3 O10P 1 21 19.7675; 7.1607; 15.8901
90; 107.9; 90
1057.59Hai-Yang Li; Hong Xu; Shuang-Quan Zang; Thomas C. W. Mak
A viologen-functionalized chiral Eu-MOF as a platform for multifunctional switchable material
Chem.Commun., 2016, 52, 525
7118412 CIFC35 H48 F3 Ge N3 O3 SP 1 21/n 111.7454; 24.4796; 13.3037
90; 115.166; 90
3462Bochao Su; Rakesh Ganguly; Yongxin Li; Rei Kinjo
Synthesis, characterization, and electronic structures of a methyl germyliumylidene ion and germylone-group VI metal complexes
Chem.Commun., 2016, 52, 613
7118413 CIFC36 H47 Cr Ge N3 O6P 1 21/c 110.2157; 22.5884; 15.2996
90; 97.648; 90
3499.07Bochao Su; Rakesh Ganguly; Yongxin Li; Rei Kinjo
Synthesis, characterization, and electronic structures of a methyl germyliumylidene ion and germylone-group VI metal complexes
Chem.Commun., 2016, 52, 613
7118414 CIFC36 H47 Ge Mo N3 O6P 1 21/c 110.3172; 22.6231; 15.3939
90; 97.423; 90
3562.9Bochao Su; Rakesh Ganguly; Yongxin Li; Rei Kinjo
Synthesis, characterization, and electronic structures of a methyl germyliumylidene ion and germylone-group VI metal complexes
Chem.Commun., 2016, 52, 613
7118415 CIFC36 H47 Ge N3 O6 WP 1 21/c 110.3691; 22.617; 15.3476
90; 97.055; 90
3572Bochao Su; Rakesh Ganguly; Yongxin Li; Rei Kinjo
Synthesis, characterization, and electronic structures of a methyl germyliumylidene ion and germylone-group VI metal complexes
Chem.Commun., 2016, 52, 613
7118416 CIFC33 H33 N3P -18.299; 12.11; 13.39
76.13; 87.13; 87.08
1304Qitao Tan; Huanhuan Chen; Huaida Xia; Bingxin Liu; Bin Xu
Parent and trisubstituted triazacoronenes: synthesis, crystal structure and physicochemical properties
Chem.Commun., 2016, 52, 537
7118417 CIFC16 H23 F12 N3 Ru Sb2P 1 21/c 18.3829; 18.5671; 17.8534
90; 98.919; 90
2745.21Zhao, Yinsong; He, Zhen; Li, Shiqing; Tang, Junbin; Gao, Ge; Lan, Jingbo; You, Jingsong
An air-stable half-sandwich Ru(II) complex as an efficient catalyst for [3+2] annulation of 2-arylcyclo-2-enones with alkynes.
Chemical communications (Cambridge, England), 2016, 52, 4613-4616
7118418 CIFC20 H18 OP 1 21/c 19.7368; 8.7212; 17.6929
90; 97.34; 90
1490.11Zhao, Yinsong; He, Zhen; Li, Shiqing; Tang, Junbin; Gao, Ge; Lan, Jingbo; You, Jingsong
An air-stable half-sandwich Ru(II) complex as an efficient catalyst for [3+2] annulation of 2-arylcyclo-2-enones with alkynes.
Chemical communications (Cambridge, England), 2016, 52, 4613-4616
7118419 CIFC18 H14 Cl3 N SP -17.7687; 9.4304; 12.8027
101.342; 104.75; 102.507
853.44Yu, Liu-Zhu; Hu, Xu-Bo; Xu, Qin; Shi, Min
Thermally induced formal [3+2] cyclization of ortho-aminoaryl-tethered alkylidenecyclopropanes: facile synthesis of furoquinoline and thienoquinoline derivatives.
Chemical communications (Cambridge, England), 2016, 52, 2701-2704
7118420 CIFC17 H12 Cl N OP -18.277; 8.861; 20.949
78.278; 83.751; 64.58
1358.4Yu, Liu-Zhu; Hu, Xu-Bo; Xu, Qin; Shi, Min
Thermally induced formal [3+2] cyclization of ortho-aminoaryl-tethered alkylidenecyclopropanes: facile synthesis of furoquinoline and thienoquinoline derivatives.
Chemical communications (Cambridge, England), 2016, 52, 2701-2704
7118421 CIFC17 H13 Cl2 N OP -17.7899; 9.516; 11.134
99.138; 97.433; 109.903
751.1Yu, Liu-Zhu; Hu, Xu-Bo; Xu, Qin; Shi, Min
Thermally induced formal [3+2] cyclization of ortho-aminoaryl-tethered alkylidenecyclopropanes: facile synthesis of furoquinoline and thienoquinoline derivatives.
Chemical communications (Cambridge, England), 2016, 52, 2701-2704
7118422 CIFC18 H22 N2 O8 TiP 1 21/n 110.9669; 14.7049; 13.0353
90; 113.016; 90
1934.82Brennan, Bradley J.; Chen, Jeffrey; Rudshteyn, Benjamin; Chaudhuri, Subhajyoti; Mercado, Brandon Q.; Batista, Victor S.; Crabtree, Robert H.; Brudvig, Gary W.
Molecular titanium-hydroxamate complexes as models for TiO2 surface binding.
Chemical communications (Cambridge, England), 2016, 52, 2972-2975
7118423 CIFC54 H72 N6 O21 S6 Ti3R -3 c :H15.7049; 15.7049; 53.457
90; 90; 120
11418.4Brennan, Bradley J.; Chen, Jeffrey; Rudshteyn, Benjamin; Chaudhuri, Subhajyoti; Mercado, Brandon Q.; Batista, Victor S.; Crabtree, Robert H.; Brudvig, Gary W.
Molecular titanium-hydroxamate complexes as models for TiO2 surface binding.
Chemical communications (Cambridge, England), 2016, 52, 2972-2975
7118424 CIFC36 H40 Cl8 N4 O10 Ti2P 1 21/n 112.1927; 10.0654; 19.3484
90; 102.042; 90
2322.3Brennan, Bradley J.; Chen, Jeffrey; Rudshteyn, Benjamin; Chaudhuri, Subhajyoti; Mercado, Brandon Q.; Batista, Victor S.; Crabtree, Robert H.; Brudvig, Gary W.
Molecular titanium-hydroxamate complexes as models for TiO2 surface binding.
Chemical communications (Cambridge, England), 2016, 52, 2972-2975
7118425 CIFC24 O25 Zn4R -3 m :H18.2657; 18.2657; 22.3708
90; 90; 120
6463.8Bai, Linyi; Tu, Binbin; Qi, Yi; Gao, Qiang; Liu, Dong; Liu, Zhizhou; Zhao, Lingzhi; Li, Qiaowei; Zhao, Yanli
Enhanced performance in gas adsorption and Li ion batteries by docking Li(+) in a crown ether-based metal-organic framework.
Chemical communications (Cambridge, England), 2016, 52, 3003-3006
7118426 CIFC99 H152 Ge2 Si4P -116.3223; 17.6076; 18.3797
71.478; 77.643; 67.458
4600.3Nieder, David; Yildiz, Cem B.; Jana, Anukul; Zimmer, Michael; Huch, Volker; Scheschkewitz, David
Dimerization of a marginally stable disilenyl germylene to tricyclic systems: evidence for reversible NHC-coordination.
Chemical communications (Cambridge, England), 2016, 52, 2799-2802
7118427 CIFC95.5 H152 Ge2 Si4C 1 2/c 133.8499; 26.2285; 20.2919
90; 97.911; 90
17844.3Nieder, David; Yildiz, Cem B.; Jana, Anukul; Zimmer, Michael; Huch, Volker; Scheschkewitz, David
Dimerization of a marginally stable disilenyl germylene to tricyclic systems: evidence for reversible NHC-coordination.
Chemical communications (Cambridge, England), 2016, 52, 2799-2802
7118428 CIFC22 H18 F3 N O2P 1 21/c 113.9588; 8.5515; 16.218
90; 104.782; 90
1871.8Jiang, Quanbin; Guo, Tenglong; Wu, Kaikai; Yu, Zhengkun
Rhodium(iii)-catalyzed sp(2) C-H bond addition to CF3-substituted unsaturated ketones.
Chemical communications (Cambridge, England), 2016, 52, 2913-2915
7118429 CIFC18 H32 N O6 SiP 21 21 216.826; 9.791; 30.82
90; 90; 90
2059.8Jian-Liang Ye; Yang Liu; Zhi-Ping Yang; Pei-Qiang Huang
The asymmetric total synthesis of (+)-N-acetyl norloline
Chem.Commun., 2016, 52, 561
7118430 CIFC24 H21 B F2 N4P -18.4892; 8.7454; 14.2585
83.179; 79.851; 84.564
1031.68Dan Wu; Li Shao; Yang Li; Qinglian Hu; Feihe Huang; Guocan Yu; Guping Tang
A boron difluoride dye showing the aggregation-induced emission feature and high sensitivity to intra- and extra-cellular pH changes
Chem.Commun., 2016, 52, 541
7118431 CIFC43 H52 Ni P2 SiP 1 21/c 120.474; 22.468; 17.673
90; 110.92; 90
7594LaPierre, Etienne A.; Piers, Warren E.; Spasyuk, Denis M.; Bi, David W.
Activation of Si-H bonds across the nickel carbene bond in electron rich nickel PCcarbeneP pincer complexes.
Chemical communications (Cambridge, England), 2016, 52, 1361-1364

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