Crystallography Open Database
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| 7056268 | CIF | C120 H60 Cl4 N2 | P b c n | 24.182; 17.718; 17.929 90; 90; 90 | 7681.8 | Konarev, Dmitri V.; Troyanov, Sergey I.; Otsuka, Akihiro; Yamochi, Hideki; Saito, Gunzi; Lyubovskaya, Rimma N. Fullerene C60 dianion salt, (Me4N+)2(C602−)·(TPC)2·2C6H4Cl2, where TPC is triptycene, obtained by a multicomponent approach New J. Chem., 2017, 41, 4779-4782 |
| 7056376 | CIF | C21 H17 Cl3 N4 O2 Ru | P b c n | 28.016; 8.6148; 20.3292 90; 90; 90 | 4906.5 | Amabilino, Silvia; Tasse, Marine; Lacroix, Pascal G.; Mallet-Ladeira, Sonia; Pimienta, Véronique; Akl, Joëlle; Sasaki, Isabelle; Malfant, Isabelle Photorelease of nitric oxide (NO) on ruthenium nitrosyl complexes with phenyl substituted terpyridines New J. Chem., 2017, 41, 7371-7383 |
| 7056442 | CIF | C20 H32 Co N6 O7 | P b c n | 15.1068; 9.9563; 17.5608 90; 90; 90 | 2641.3 | Radi, Smaail; El-Massaoudi, Mohamed; Benaissa, Houria; Adarsh, N. N.; Ferbinteanu, Marilena; Devlin, Eamonn; Sanakis, Yiannis; Garcia, Yann Crystal engineering of a series of complexes and coordination polymers based on pyrazole-carboxylic acid ligands New J. Chem., 2017, 41, 8232-8241 |
| 7056548 | CIF | C23 H24 Ce O12.5 | P b c n | 22.702; 7.53; 29.233 90; 90; 90 | 4997 | shi, tian; Chen, Ya-Guang; Ren, Xiao-Yan Synthesis, characterization and properties of lanthanide coordination polymers with 3,5-bis(4-carboxyphenylmethyloxy) benzoic acid New J. Chem., 2017, 41, 11215-11224 |
| 7056549 | CIF | C23 H24 La O12.5 | P b c n | 22.645; 7.6075; 29.26 90; 90; 90 | 5040.7 | shi, tian; Chen, Ya-Guang; Ren, Xiao-Yan Synthesis, characterization and properties of lanthanide coordination polymers with 3,5-bis(4-carboxyphenylmethyloxy) benzoic acid New J. Chem., 2017, 41, 11215-11224 |
| 7056743 | CIF | C4 H6 N6 Ni S2 | P b c n | 8.109; 14.882; 7.304 90; 90; 90 | 881.4 | Bharty, M. K.; Paswan, Santosh; Bharati, P.; Sonkar, Piyush Kumar; Ganesan, Vellaichamy; Butcher, Raymond J. Square planar Ni(II) complexes of acetone N4-phenyl-thiosemicarbazone and in situ generated benzoyl thiosemicarbazide ligand: Synthesis, spectral and structural characterizations, thermal behaviour and electrochemical studies New Journal of Chemistry, 2017, 41, 15466-15474 |
| 7056849 | CIF | C36 H40 Cl2 N10 O22 Zn2 | P b c n | 16.9402; 12.8694; 21.046 90; 90; 90 | 4588.2 | Joshi, Pooja; Hussain, Navid; Ali, Shah Raj; Rishu, Rishu; Bhardwaj, Vimal K. Enhanced activity of trinuclear Zn(ii) complexes towards phosphate ester bond cleavage by introducing three-metal cooperativity New Journal of Chemistry, 2018, 42, 2204 |
| 7056866 | CIF | C22 H10 F3 I3 | P b c n | 5.1221; 17.608; 22.7903 90; 90; 90 | 2055.46 | Li, Lili; Wu, Wen Xin; Liu, Zheng Fei; Jin, Wei Jun Effect of geometry factors on the priority of σ-hole⋯π and π-hole⋯π bond in phosphorescent cocrystals formed by pyrene or phenanthrene and trihaloperfluorobenzenes New Journal of Chemistry, 2018, 42, 10633 |
| 7056932 | CIF | C13 H8 Ag F3 N8 O3 S | P b c n | 11.5086; 13.443; 11.8588 90; 90; 90 | 1834.68 | Jääskeläinen, Sirpa; Appiah, Nana Sakyibea; Koshevoy, Igor; Hirva, Pipsa Impacts of the counter ions on 4,5-dicyano-1-methylimidazole silver coordination New Journal of Chemistry, 2018, 42, 3363 |
| 7057062 | CIF | C16 H18 Li2 Mg N6 O10 | P b c n | 14.752; 8.8836; 16.476 90; 90; 90 | 2159.19 | Song, Ying; Tian, Chong-Bin; Wu, Zhao-Feng; Huang, Xiao-Ying Mg1−xCoxLi2(3,5-pdcH)2(DMF)2 (x = 0, 0.285, 0.575, 1): a series of heterometallic coordination polymers doped with magnetic Co2+ ions New Journal of Chemistry, 2018, 42, 5096 |
| 7057063 | CIF | C8 H9 Co0.14 Li Mg0.36 N3 O5 | P b c n | 14.7495; 8.881; 16.4433 90; 90; 90 | 2153.9 | Song, Ying; Tian, Chong-Bin; Wu, Zhao-Feng; Huang, Xiao-Ying Mg1−xCoxLi2(3,5-pdcH)2(DMF)2 (x = 0, 0.285, 0.575, 1): a series of heterometallic coordination polymers doped with magnetic Co2+ ions New Journal of Chemistry, 2018, 42, 5096 |
| 7057064 | CIF | C8 H9 Co0.29 Li Mg0.21 N3 O5 | P b c n | 14.7194; 8.8624; 16.4634 90; 90; 90 | 2147.64 | Song, Ying; Tian, Chong-Bin; Wu, Zhao-Feng; Huang, Xiao-Ying Mg1−xCoxLi2(3,5-pdcH)2(DMF)2 (x = 0, 0.285, 0.575, 1): a series of heterometallic coordination polymers doped with magnetic Co2+ ions New Journal of Chemistry, 2018, 42, 5096 |
| 7057065 | CIF | C16 H18 Co Li2 N6 O10 | P b c n | 14.7458; 8.8756; 16.4841 90; 90; 90 | 2157.4 | Song, Ying; Tian, Chong-Bin; Wu, Zhao-Feng; Huang, Xiao-Ying Mg1−xCoxLi2(3,5-pdcH)2(DMF)2 (x = 0, 0.285, 0.575, 1): a series of heterometallic coordination polymers doped with magnetic Co2+ ions New Journal of Chemistry, 2018, 42, 5096 |
| 7057097 | CIF | C21 H12 I3 N3 | P b c n | 11.0353; 14.276; 14.2688 90; 90; 90 | 2247.9 | Szell, Patrick M. J.; Siiskonen, Antti; Catalano, Luca; Cavallo, Gabriella; Terraneo, Giancarlo; Priimagi, Arri; Bryce, David L.; Metrangolo, Pierangelo Halogen-bond driven self-assembly of triangular macrocycles New Journal of Chemistry, 2018, 42, 10467 |
| 7057134 | CIF | C58 H68 Cl N13 Ni4 O22 | P b c n | 11.971; 17.2506; 32.9419 90; 90; 90 | 6802.7 | Pramanik, Koushik; Malpaharia, Pijush; Colacio, Enrique; Das, Babulal; Chandra, Swapan K. Octadentate flexible ligands as a platform for a variety of homo and heterometallic complexes containing diphenoxido and phenoxido/azido bridging groups: synthesis, structure and magnetic properties New Journal of Chemistry, 2018, 42, 6332 |
| 7057147 | CIF | C28 H28 N4 O4 Zn | P b c n | 8.688; 14.6001; 23.4501 90; 90; 90 | 2974.5 | Barsukova, Marina O.; Sapchenko, Sergey A.; Kovalenko, Konstantin A.; Samsonenko, Denis G.; Potapov, Andrei S.; Dybtsev, Danil N.; Fedin, Vladimir P. Exploring the multifunctionality in metal‒organic framework materials: how do the stilbenedicarboxylate and imidazolyl ligands tune the characteristics of coordination polymers? New Journal of Chemistry, 2018, 42, 6408 |
| 7057149 | CIF | C28 H28 Co N4 O4 | P b c n | 8.7112; 14.5251; 23.5166 90; 90; 90 | 2975.6 | Barsukova, Marina O.; Sapchenko, Sergey A.; Kovalenko, Konstantin A.; Samsonenko, Denis G.; Potapov, Andrei S.; Dybtsev, Danil N.; Fedin, Vladimir P. Exploring the multifunctionality in metal‒organic framework materials: how do the stilbenedicarboxylate and imidazolyl ligands tune the characteristics of coordination polymers? New Journal of Chemistry, 2018, 42, 6408 |
| 7057175 | CIF | C26 H22 N2 O4 | P b c n | 21.755; 11.303; 16.615 90; 90; 90 | 4085.6 | Kaewnok, Nirawit; Petdum, Anuwut; Sirirak, Jitnapa; Charoenpanich, Adisri; Panchan, Waraporn; Sahasithiwat, Somboon; Sooksimuang, Thanasat; Wanichacheva, Nantanit Novel Cu2±specific “Turn-ON” fluorescent probe based on [5]helicene with very large Stokes shift and its potential application in living cells New Journal of Chemistry, 2018, 42, 5540 |
| 7057212 | CIF | C129 H154 N4 O26 | P b c n | 14.107; 23.359; 42.774 90; 90; 90 | 14095 | Jiang, Shuo; Han, Ying; Cheng, Ming; Sun, Jing; Yan, Chao-Guo; Jiang, Juli; Wang, Leyong Self-locked dipillar[5]arene-based pseudo[1]rotaxanes and bispseudo[1]rotaxanes with different lengths of bridging chains New Journal of Chemistry, 2018, 42, 7603 |
| 7057408 | CIF | C51 H66 Br2 O5 | P b c n | 27.808; 17.183; 21.075 90; 90; 90 | 10070.2 | An, Lin; Wang, Jia-wei; Wang, Chan; Zhou, Shan-shan; Sun, Jing; Yan, Chao-Guo 2,3-Ethylene-bridged dihomooxacalix[4]arenes: synthesis, X-ray crystal structures and highly selective binding properties with anions New Journal of Chemistry, 2018, 42, 10689 |
| 7058199 | CIF | C10.5 H8 Cl O | P b c n | 11.1071; 8.2385; 19.1755 90; 90; 90 | 1754.67 | Kar, Swayamsiddha; Shivalingegowda, Naveen; Krishnappagowda, Lokanath Neratur; Golakoti, Nageswara Rao SiCl4 mediated one-pot synthesis of novel spirobibenzopyrans as potent anticancer agents New Journal of Chemistry, 2019, 43, 4669 |
| 7058344 | CIF | C11 H18 Cl N2 O0.5 | P b c n | 16.1278; 12.2682; 12.5817 90; 90; 90 | 2489.4 | Malan, Frederick P.; Singleton, Eric; van Rooyen, Petrus H.; Landman, Marilé Tandem transfer hydrogenation–epoxidation of ketone substrates catalysed by alkene-tethered Ru(ii)–NHC complexes New Journal of Chemistry, 2019, 43, 8472 |
| 7058519 | CIF | C27 H24 Cl2 F3 N5 O3 Ru | P b c n | 25.0164; 15.6581; 14.4095 90; 90; 90 | 5644.3 | Sasaki, Isabelle; Amabilino, Silvia; Mallet-Ladeira, Sonia; Tassé, Marine; Sournia-Saquet, Alix; Lacroix, Pascal G.; Malfant, Isabelle Further studies on the photoreactivities of ruthenium‒nitrosyl complexes with terpyridyl ligands New Journal of Chemistry, 2019, 43, 11241 |
| 7058576 | CIF | B4 H4 K2 O9 | P b c n | 10.205; 6.629; 12.045 90; 90; 90 | 814.8 | Shi, Tingting; Zhang, Fangfang; Tudi, Abudukadi; Yang, Zhihua; Pan, Shilie K2[B4O5(OH)4]·H2O and K2[B4O5(OH)4]: two new hydrated potassium borates with isolated [B4O5(OH)4]2− units and different structural frameworks New Journal of Chemistry, 2019, 43, 11660 |
| 7058810 | CIF | C17 H10 F6 O2 S2 | P b c n | 12.065; 8.649; 16.45 90; 90; 90 | 1716.6 | Fu, Qiu-Ting; Yan, Xiaodong; Li, Tao; Zhang, Xin-Yue; He, Yue; Zhang, Wen-Da; Liu, Yong; Li, Yunxing; Gu, Zhi-Guo Diarylethene-based conjugated polymer networks for ultrafast photochromic films New Journal of Chemistry, 2019, 43, 15797 |
| 7058821 | CIF | C18 H24 F6 N8 O6 Re6 S10 | P b c n | 22.8829; 11.7447; 16.8444 90; 90; 90 | 4527 | Mikhaylov, Maksim A.; Mironova, Alina D.; Brylev, Konstantin A.; Sukhikh, Taisiya S.; Eltsov, Ilia V.; Stass, Dmitri V.; Gushchin, Artem L.; Kitamura, Noboru; Sokolov, Maxim N. Functionalization of [Re6Q8(CN)6]4− clusters by methylation of cyanide ligands New Journal of Chemistry, 2019, 43, 16338 |
| 7058885 | CIF | C42 H65 Au2 Br3.88 Cl2.12 N5 O2 P2 | P b c n | 22.602; 15.0955; 15.1623 90; 90; 90 | 5173.2 | Branzi, Lorenzo; Baron, Marco; Armelao, Lidia; Rancan, Marzio; Sgarbossa, Paolo; Graiff, Claudia; Pöthig, Alexander; Biffis, Andrea Coordination chemistry of gold with N-Phosphine Oxide-Substituted Imidazolylidenes (POxIms) New Journal of Chemistry, 2019, 43, 17275-17283 |
| 7059075 | CIF | C14 H14 Co N4 O2 S2 | P b c n | 11.4021; 8.2603; 17.7971 90; 90; 90 | 1676.22 | I., Mantasha; Shahid, M.; Kumar, Manjeet; Ansari, Azaj; Akhtar, Muhammad Nadeem; AlDamen, Murad A.; Song, You; Ahmad, Musheer; Khan, Ishaat M. Exploring solvent dependent catecholase activity in transition metal complexes: an experimental and theoretical approach New Journal of Chemistry, 2020, 44, 1371-1388 |
| 7059234 | CIF | C56 H66 Fe4 N4 O6 Pb S6 | P b c n | 13.3801; 12.1406; 36.1701 90; 90; 90 | 5875.6 | Yadav, Reena; Singh, Suryabhan; Trivedi, Manoj; Kociok-Köhn, Gabriele; Rath, Nigam P.; Köhn, Randolf D.; Muddassir, Mohd.; Kumar, Abhinav New main-group ferrocenyldithiocarbamates and conversion to ferrocene oxazolidine-2-thione and -2-one New Journal of Chemistry, 2020, 44, 3268-3277 |
| 7059404 | CIF | Cs Mg2 O10 P3 | P b c n | 7.881; 8.6992; 13.7382 90; 90; 90 | 941.87 | Qian, Zhen; Wu, Hongping; Yu, Hongwei; Hu, Zhanggui; Wang, Jiyang; Wu, Yicheng Synthesis, structure and characterization of three new Mg-containing phosphates with deep-UV cut-off edges New Journal of Chemistry, 2020, 44, 6771-6777 |
| 7059473 | CIF | C10 H5 Br N2 S Te | P b c n | 11.9421; 7.2245; 24.8025 90; 90; 90 | 2139.85 | Romito, Deborah; Biot, Nicolas; Babudri, Francesco; Bonifazi, Davide Non-covalent bridging of bithiophenes through chalcogen bonding grips New Journal of Chemistry, 2020, 44, 6732-6738 |
| 7059561 | CIF | C64 H54 N10 O15 Zn2 | P b c n | 23.392; 11.662; 27.06 90; 90; 90 | 7382 | Meng, Lingshu; Zhao, Lun; Guo, Guanlin; Liu, Xin Multifunctional polymers with interpenetrating structures: luminescence sensing, ECL behaviors, selective detection of Fe3+ ion and rapid removal of anionic dyes New Journal of Chemistry, 2020, 44, 9025-9036 |
| 7059652 | CIF | C42 H31 N11 O10 Zn2 | P b c n | 12.0157; 18.1093; 18.99 90; 90; 90 | 4132.1 | Wang, Jun; Chen, Ning-Ning; Pan, Chen-Dong; Zhang, Chen; Fan, Liming Selective fluorescence sensing properties of a novel two-fold interpenetrating coordination polymer New Journal of Chemistry, 2020, 44, 9411-9418 |
| 7059684 | CIF | C9 H18 B10 N2 | P b c n | 19.235; 7.0992; 21.796 90; 90; 90 | 2976.3 | Shmalko, Akim V.; Anufriev, Sergei A.; Stogniy, Marina Yu.; Suponitsky, Kyrill Yu.; Sivaev, Igor B. Synthesis and structure of 3-arylazo derivatives of ortho-carborane New Journal of Chemistry, 2020, 44, 10199-10202 |
| 7059758 | CIF | C19 H20 Cd N6 O5 S2 | P b c n | 12.008; 14.404; 14.372 90; 90; 90 | 2485.8 | Kiani, Mahsa; Bagherzadeh, Mojtaba; Meghdadi, Soraia; Rabiee, Navid; Abbasi, Alireza; Schenk-Joß, Kurt; Tahriri, Mohammadreza; Tayebi, Lobat; Webster, Thomas J. Development of a novel carboxamide-based off‒on switch fluorescence sensor: Hg2+, Zn2+ and Cd2+ New Journal of Chemistry, 2020, 44, 11841-11852 |
| 7059955 | CIF | C17 H14 Fe N2 O3 | P b c n | 18.433; 10.1869; 15.329 90; 90; 90 | 2878.4 | Kadari, Lingaswamy; Erb, William; Roisnel, Thierry; Radha Krishna, Palakodety; Mongin, Florence Iodoferrocene as a partner in N-arylation of amides New Journal of Chemistry, 2020, 44, 15928-15941 |
| 7060155 | CIF | C36 H42 Dy2 N4 O16 | P b c n | 19.0333; 9.0499; 23.067 90; 90; 90 | 3973.3 | Li, Dawei; Ding, Man-Man; Ge, Yu; Tello Yepes, David Felipe; Sun, Mingyuan; Najib, Muhammad Saleem; Li, Yahong; Zhang, Yi-Quan; Yao, Jin-lei Assembling two Dy2 single-molecule magnets with different energy barriers via fine-tuning the geometries of DyIII sites New Journal of Chemistry, 2020, 44, 20634-20642 |
| 7060191 | CIF | C37 H56 Al2 I4 N6 | P b c n | 17.8187; 17.3288; 16.6003 90; 90; 90 | 5125.79 | Rösch, Andreas; Seifert, Fabian; Vass, Valentin; Görls, Helmar; Kretschmer, Robert Synthesis, structure, and catalytic activity of dinuclear aluminium bis(amidinate) and bis(guanidinate) complexes New Journal of Chemistry, 2021, 45, 972-981 |
| 7060424 | CIF | C64 H72 Co6 N32 O12 | P b c n | 19.6157; 15.3792; 28.243 90; 90; 90 | 8520.2 | Richa,; Rathnam, Muni; Kumar, Akhilesh; Verma, Indresh; Kłak, Julia; Cano, Joan; Mota, Antonio J.; Rajput, Amit; Arora, Himanshu Discrete unusual mixed-bridged trinuclear CoIII2CoII and pentanuclear NiII coordination complexes supported by a phenolate-based ligand: theoretical and experimental magneto-structural study New Journal of Chemistry, 2021, 45, 6053-6066 |
| 7061194 | CIF | C3 H10 Mg N8 O6 | P b c n | 11.89; 16.7; 11.228 90; 90; 90 | 2229.5 | Li, Haibo; Wang, Yanna; Wei, Zhenghe; Xia, Lianghong; Li, Zhimin; Zhang, Tonglai Alkaline metal and alkaline earth metal salts of di(1H-tetrazol-5-yl)methanone (DTO): energetic catalysts for ammonium perchlorate decomposition New Journal of Chemistry, 2022, 46, 4462-4469 |
| 7061225 | CIF | C9 H6 Cl N S | P b c n | 12.5438; 14.9504; 9.298 90; 90; 90 | 1743.7 | Costa, Letícia D.; Guieu, Samuel; Faustino, Maria do Amparo F.; Tomé, Augusto C. Straightforward synthesis of thiazolo[5,4-c]isoquinolines from dithiooxamide and 2-halobenzaldehydes New Journal of Chemistry, 2022, 46, 3602-3615 |
| 7061229 | CIF | C8 H3 Br2 N S | P b c n | 12.4146; 14.9366; 9.6752 90; 90; 90 | 1794.1 | Costa, Letícia D.; Guieu, Samuel; Faustino, Maria do Amparo F.; Tomé, Augusto C. Straightforward synthesis of thiazolo[5,4-c]isoquinolines from dithiooxamide and 2-halobenzaldehydes New Journal of Chemistry, 2022, 46, 3602-3615 |
| 7061231 | CIF | C40 H40 N8 O4 Pd2 S2 | P b c n | 23.4333; 11.7042; 14.6428 90; 90; 90 | 4016.05 | Lobana, Tarlok S.; Sandhu, Amanpreet K.; Hundal, Geeta; Jasinski, Jerry P. Heterocyclic-2-thione derivatives of metals incorporating cyclopalladated azobenzenes of variable nuclearity and N,S-bridged 1D polymer of [bis(pyridine-2-thiolato)mercury(ii)] New Journal of Chemistry, 2022, 46, 2722-2729 |
| 7061232 | CIF | C42 H42 N6 O4 Pd2 S2 | P b c n | 23.367; 11.818; 14.969 90; 90; 90 | 4133.7 | Lobana, Tarlok S.; Sandhu, Amanpreet K.; Hundal, Geeta; Jasinski, Jerry P. Heterocyclic-2-thione derivatives of metals incorporating cyclopalladated azobenzenes of variable nuclearity and N,S-bridged 1D polymer of [bis(pyridine-2-thiolato)mercury(ii)] New Journal of Chemistry, 2022, 46, 2722-2729 |
| 7061278 | CIF | C20 H30 Cd2 N4 O15 | P b c n | 12.0648; 17.3104; 13.4411 90; 90; 90 | 2807.13 | Zhang, Hongbi; Liu, Xueguang; Shao, Yongliang; Liu, Wei; Liu, Weisheng Study on the synthesis and host–guest luminescence properties of a novel Cd(ii)-picolinate coordination polymer New Journal of Chemistry, 2022, 46, 4257-4261 |
| 7061365 | CIF | C90 H88 Dy4 N6 O23 | P b c n | 14.3608; 20.9814; 30.9223 90; 90; 90 | 9317.2 | Panja, Anangamohan; Jagličić, Zvonko; Herchel, Radovan; Brandão, Paula; Pramanik, Kuheli; Jana, Narayan Ch. The first exploration of coordination chemistry using a methyl substituted o-vanillin based ligand: an example starting with Dy4/Zn2Dy2 systems displaying slow relaxation of magnetization New Journal of Chemistry, 2022, 46, 5627-5637 |
| 7061513 | CIF | C31 H49 Cl N6 O3 | P b c n | 46.389; 9.2469; 15.7793 90; 90; 90 | 6768.6 | Kumari, Annu; Dehaen, Wim; Chopra, Deepak; Dey, Swapan Imidazopyridine–fluoride interaction: solvent-switched AIE effects via S⋯O conformational locking New Journal of Chemistry, 2022, 46, 10628-10636 |
| 7061520 | CIF | C18 H30 B2 Fe N20 O3 | P b c n | 8.3469; 15.7421; 22.5116 90; 90; 90 | 2958 | Horniichuk, Oleksandr Ye.; Ridier, Karl; Molnár, Gábor; Kotsyubynsky, Volodymyr O.; Shova, Sergiu; Amirkhanov, Vladimir M.; Gural'skiy, Il’ya A.; Salmon, Lionel; Bousseksou, Azzedine Solvatomorphism, polymorphism and spin crossover in bis[hydrotris(1,2,3-triazol-1-yl)borate]iron(ii) New Journal of Chemistry, 2022, 46, 11734-11740 |
| 7061528 | CIF | C26 H22 Cl N O6 | P b c n | 32.278; 11.396; 12.247 90; 90; 90 | 4504.9 | Liu, Xueyan; Sun, Jing; Yan, Chao-Guo Convenient construction of polycyclic architectures via multicomponent reaction of amino acids, dialkyl but-2-ynedioates and 2-(o-hydroxyarylidene)-1,3-indanediones New Journal of Chemistry, 2022, 46, 11877-11882 |
| 7061584 | CIF | C45 H44 Cl6 N8 O2 Zn4 | P b c n | 25.473; 11.826; 16.454 90; 90; 90 | 4957 | Naskar, Barnali; Das Mukhopadhyay, Chitrangada; Goswami, Sanchita A new diformyl phenol based chemosensor selectively detects Zn2+ and Co2+ in the nanomolar range in 100% aqueous medium and HCT live cells New Journal of Chemistry, 2022, 46, 11946-11955 |
| 7061697 | CIF | C40 H44 Cd2 Fe2 I4 N4 O9 | P b c n | 22.384; 14.7774; 14.2404 90; 90; 90 | 4710.4 | Laha, Soumik; Sathapathi, Dibyendu; Das, Mainak; Das, Manik; Ray, Partha Pratim; Bag, Arijit; Samanta, Bidhan Chandra; Das, Uttam Kumar; Maity, Tithi Synthesis, characterization and multi-dimensional application approach for two distinctive tetra nuclear, first-time reported, Fe3+/Hg2+ and Fe3+/Cd2+ clusters from a new Fe3+ containing metalloligand New Journal of Chemistry, 2022, 46, 16730-16742 |
| 7061750 | CIF | C5 H10 Cl2 N8 O8 | P b c n | 28.4221; 5.9548; 25.7279 90; 90; 90 | 4354.4 | Gribov, Pavel S.; Suponitsky, Kyrill Yu.; Sheremetev, Aleksei B. Efficient synthesis of N-(chloromethyl)nitramines via TiCl4-catalyzed chlorodeacetoxylation New Journal of Chemistry, 2022, 46, 17548-17553 |
| 7061765 | CIF | C68 H62 Cu2 O4 P4 S2 | P b c n | 21.0124; 23.775; 12.1359 90; 90; 90 | 6062.7 | Kumar, Krishna; Tiwari, Priyanka; Kant, Rajni; Bhattacharya, Subrato Synthesis and structural studies of Cu(i) methylthiosalicylate complexes and their catalytic application in thiol-yne click reaction New Journal of Chemistry, 2022, 46, 17854-17864 |
| 7061896 | CIF | C11 H12 Cl N3 O | P b c n | 28.11; 10.0413; 8.0483 90; 90; 90 | 2271.7 | Ajormal, Fatemeh; Bikas, Rahman; Noshiranzadeh, Nader; Kozakiewicz-Piekarz, Anna; Lis, Tadeusz Green catalytic synthesis of symmetric and non-symmetric β-hydroxy-1,2,3-triazoles by using epichlorohydrin in the presence of Cu(ii) coordination compounds containing oxazole ligands New Journal of Chemistry, 2022, 46, 19468-19481 |
| 7062248 | CIF | C80 H92 Li N8 Nd O6 S4 Si2 | P b c n | 19.8134; 22.6439; 17.0123 90; 90; 90 | 7632.6 | Mironova, Olga A.; Ryadun, Aleksey A.; Sukhikh, Taisiya S.; Pushkarevsky, Nikolay A.; Konchenko, Sergey N. Synthesis and photophysical properties of rare earth (La, Nd, Gd, Y, Ho) complexes with silanediamido ligands bearing a chelating phenylbenzothiazole chromophore New Journal of Chemistry, 2023, 47, 3406-3416 |
| 7062251 | CIF | C80 H92 Li N8 O6 S4 Si2 Y | P b c n | 19.5493; 22.503; 17.3269 90; 90; 90 | 7622.4 | Mironova, Olga A.; Ryadun, Aleksey A.; Sukhikh, Taisiya S.; Pushkarevsky, Nikolay A.; Konchenko, Sergey N. Synthesis and photophysical properties of rare earth (La, Nd, Gd, Y, Ho) complexes with silanediamido ligands bearing a chelating phenylbenzothiazole chromophore New Journal of Chemistry, 2023, 47, 3406-3416 |
| 7062297 | CIF | C31 H41.64 N7 O10.32 V2 | P b c n | 39.6854; 12.6155; 7.4106 90; 90; 90 | 3710.13 | Soltani, Fatemeh; Bikas, Rahman; Heydari, Neda; Kozakiewicz-Piekarz, Anna Dinuclear oxidovanadium complexes with dihydrazone ligands derived from diethyl 2,6-dimethylpyridine-3,5-dicarboxylate obtained from Hantzsch reaction; crystal structure and catalytic activity New Journal of Chemistry, 2023, 47, 6102-6113 |
| 7062361 | CIF | C8 H6 Br2 O3 S2 | P b c n | 25.0891; 9.7366; 9.1903 90; 90; 90 | 2245.03 | Youssef, Khaled; Allain, Magali; Cauchy, Thomas; Gohier, Frédéric Dimerization reactions with oxidized brominated thiophenes New Journal of Chemistry, 2023, 47, 7375-7380 |
| 7062418 | CIF | C39 H36 Cl2 N4 O11 S2 | P b c n | 25.8268; 16.275; 10.0472 90; 90; 90 | 4223.2 | Suraj,; Swamy, K. C. Kumara Ring expansion/opening reactions of epoxy ene-amides: access to azabicyclononene, tetrahydropyridine and tetrazole scaffolds New Journal of Chemistry, 2023, 47, 9061-9065 |
| 7062688 | CIF | F2 Mg2 O7 Pb2 Si2 | P b c n | 7.0395; 10.9134; 10.0979 90; 90; 90 | 775.77 | Zhang, Zhiyuan; Deng, Lihan; Xu, Die; Hu, Mei; Wu, Zhencheng; Su, Xin; Huang, Yineng Mg2Pb2Si2O7F2: a new lead-containing alkali earth metal silicate fluoride with a short cutoff edge New Journal of Chemistry, 2023, 47, 17413-17419 |
| 7062857 | CIF | C70 H78 N4 S3 | P b c n | 25.5231; 18.844; 12.4455 90; 90; 90 | 5985.8 | Jang, Jae Gyu; Kim, Tae-hoon; Kim, Sung Hyun; Hong, Jong-In Enhancing thermoelectric performance of single-walled carbon nanotube/reduced graphene oxide composites with small organic molecules as a novel additive New Journal of Chemistry, 2023, 47, 21692-21699 |
| 7062911 | CIF | C6 Ce2 O17 | P b c n | 22.06; 12.96; 10.61 90; 90; 90 | 3033 | Assi, Navid; Lahoud, Christophe; Brázda, Petr; Zákutná, Dominika; Rainer, Daniel N.; Hraníček, Jakub; Rohlíček, Jan; Tyrpekl, Václav Hydrothermal conversion of cerium oxalate to CeO2: a parade of oxalate and water coordination modes New Journal of Chemistry, 2024, 48, 1071-1075 |
| 7063270 | CIF | C4 H4 Cd N10 | P b c n | 7.9084; 10.8324; 9.4962 90; 90; 90 | 813.5 | Hou, Tianjiao; Leng, Huiting; Chen, Mengjia; Luo, Jun; Zhang, Chong; Zhang, Yu; Yi, Zhenxin; Zhang, Shunlin; Shen, Xuan Integrating three types of structure reinforcements abounding in heat-resistant explosives to construct a 3D solvent-free EMOF with superb stability New Journal of Chemistry, 2024, 48, 12697-12705 |
| 7063482 | CIF | C2 N6 O4 Rb2 | P b c n | 10.05; 9.42575; 9.12606 90; 90; 90 | 864.5 | Guo, Jinkun; Huang, Shiliang; Wei, Liyuan; Lang, Qing; Hao, Wenjia; Xu, Yuangang; Liu, Yu; Lu, Ming Dinitromethyltetrazole (DNMT)-based energetic coordination polymers (ECPs) as lead-free primary explosives and laser initiators New Journal of Chemistry, 2024, 48, 18014-18021 |
| 7064104 | CIF | C26 H12 Br4 | P b c n | 13.9215; 19.7974; 7.626 90; 90; 90 | 2101.8 | Maliha, Sunjida Reza; Datta, Saptarshi; Badiganti, Jahnavi; Rajamoni, Jagan; Szatkowski, Lukasz; Xu, Jinjia Study of halogen substitution effects on the structural and electronic properties of overcrowded alkene rotors New Journal of Chemistry, 2025, 49, 20558-20566 |
| 7100049 | CIF | C8 H22 Ga N3 | P b c n | 11.01; 11.706; 9.4523 90; 90; 90 | 1218.2 | Wayne Gladfelter; Benjamin E. Kuccera; Bing Luo Mono- and digallane complexes of a tridentate amido-diamine ligand Chemical Communications, 2005 |
| 7100173 | CIF | C28 H46 Al B2 N4 | P b c n | 17.252; 8.9108; 20.212 90; 90; 90 | 3107.1 | C. T; B. Rene; E. Dana; F. Chantall; S. Gabriele; T.Heikki M. Stable Spirocyclic Neutral Radicals: Aluminum and Gallium Boraamidinates Chemical Communications, 2005 |
| 7100174 | CIF | C28 H46 B2 Ga N4 | P b c n | 17.173; 8.9446; 20.337 90; 90; 90 | 3123.8 | C. T; B. Rene; E. Dana; F. Chantall; S. Gabriele; T. Heikki M. Stable Spirocyclic Neutral Radicals: Aluminum and Gallium Boraamidinates Chemical Communications, 2005 |
| 7100542 | CIF | C31 H31 N12 O2.5 S1.5 | P b c n | 31.1325; 8.5333; 22.961 90; 90; 90 | 6099.9 | Louis Cuccia; Todd C. Sutherland; Liyan Xing; Ulrich Ziener Hydrogen Bond Directed Synthesis of Pyridazine and Naphthyridine Containing Macrocycles Chemical Communications, 2005 |
| 7100916 | CIF | C6 H4 Br2 O3 | P b c n | 5.4011; 12.8974; 10.9478 90; 90; 90 | 762.63 | A. Nangia; Binoy K. Saha First example of ice-like boat water hexamer tape structure in a supramolecular organic host Chemical Communications, 2006 |
| 7101401 | CIF | C20 H20 Zr | P b c n | 14.261; 6.462; 17.607 90; 90; 90 | 1622.6 | Gerhard Erker; Gereon Dierker; Roland Frohlich; Stefan Grimme; Gerald Kehr Stereo-Electronic Interaction in Complex Molecules: Cyclopropyl Conjugation with Lewis Acidic Centres Across Connecting Carbon Carbon Triple Bonds Chemical Communications, 2006 |
| 7101436 | CIF | C34 H82 N8 O4 Zn5 | P b c n | 11.369; 15.909; 25.86 90; 90; 90 | 4677.3 | Norbert Mitzel; Raphael J. F. Berger; Roland Frohlich; Surajit Jana First mixed hydrazide/hydroxylamide metal aggregates - fine tuning the N:O content of zinc compounds Chemical Communications, 2006 |
| 7101734 | CIF | C9.5 H22 Cl3 Cu N3 | P b c n | 13.791; 14.531; 15.053 90; 90; 90 | 3016.58 | Steed, Jonathan W; Goeta, Andrés E; Lipkowski, Janusz; Swierczynski, Dariusz; Panteleon, Vicky; Handa, Sheetal Templated crystal nucleation: mixed crystals of very different copper(II) N,N',N''-trimethyltriazacyclononane complexes. Chemical communications (Cambridge, England), 2007, 813-815 |
| 7101882 | CIF | C14 H44 O2 Si7 | P b c n | 10.1051; 23.259; 25.278 90; 90; 90 | 5941.2 | Krempner, Clemens; Ludwig, Ralf; Flemming, Anke; Miethchen, Ralf; Köckerling, Martin Twisted oxygen-containing oligosilanes–unprecedented examples of sigma-n mixed conjugated systems. Chemical communications (Cambridge, England), 2007, 1810-1812 |
| 7101961 | CIF | C8 H11 I3 N7 Rh | P b c n | 27.32; 8.204; 15.373 90; 90; 90 | 3445.7 | Poyatos, Macarena; McNamara, William; Incarvito, Chris; Peris, Eduardo; Crabtree, Robert H A planar chelating bitriazole N-heterocyclic carbene ligand and its rhodium(III) and dirhodium(II) complexes. Chemical communications (Cambridge, England), 2007, 2267-2269 |
| 7101996 | CIF | C19 H30 K N O10 S2 Ti | P b c n | 33.882; 8.511; 19.052 90; 90; 90 | 5494 | Jilek, Robert E; Tripepi, Giovanna; Urnezius, Eugenijus; Brennessel, William W; Young, Jr, Victor G; Ellis, John E Zerovalent titanium-sulfur complexes. Novel dithiocarbamato derivatives of Ti(CO)6: [Ti(CO)4(S2CNR2)]-. Chemical communications (Cambridge, England), 2007, 2639-2641 |
| 7102011 | CIF | C51 H71 Cl3 Eu N21 O13 | P b c n | 19.2068; 28.499; 24.321 90; 90; 90 | 13313 | Li, Yongjun; Huffman, John C; Flood, Amar H Can terdentate 2,6-bis(1,2,3-triazol-4-yl)pyridines form stable coordination compounds? Chemical communications (Cambridge, England), 2007, 2692-2694 |
| 7102920 | CIF | C48 H67 Fe | P b c n | 22.0866; 10.9907; 17.4459 90; 90; 90 | 4234.9 | Ni, Chengbao; Ellis, Bobby D; Fettinger, James C; Long, Gary J; Power, Philip P Univalent transition metal complexes of arenes stabilized by a bulky terphenyl ligand: differences in the stability of Cr(I), Mn(I) or Fe(I) complexes. Chemical communications (Cambridge, England), 2008, 1014-1016 |
| 7103160 | CIF | C22 H16 B2 F8 Ir2 N4 O4 | P b c n | 10.8097; 32.184; 19.7274 90; 90; 90 | 6863.2 | Patra, Sanjib K; Rahaman, S M Wahidur; Majumdar, Moumita; Sinha, Arup; Bera, Jitendra K A rare unsupported iridium(II) dimer, [IrCl2(CO)2]2. Chemical communications (Cambridge, England), 2008, 2511-2513 |
| 7103270 | CIF | C16 H17 N O | P b c n | 15.772; 6.743; 24.033 90; 90; 90 | 2556 | Kang, Jun Yong; Bugarin, Alejandro; Connell, Brian T Conversion of nitrosobenzenes to isoxazolidines: an efficient cascade process utilizing reactive nitrone intermediates. Chemical communications (Cambridge, England), 2008, 3522-3524 |
| 7103326 | CIF | C17 H26 Cl2 Cu N2 O2 | P b c n | 16.542; 24.736; 10.4427 90; 90; 90 | 4272.9 | Forgan, Ross S; Davidson, James E; Galbraith, Stuart G; Henderson, David K; Parsons, Simon; Tasker, Peter A; White, Fraser J Transport of metal salts by zwitterionic ligands; simple but highly efficient salicylaldoxime extractants. Chemical communications (Cambridge, England), 2008, 4049-4051 |
| 7103469 | CIF | C22 H39 O3 P | P b c n | 44.018; 9.17; 23.309 90; 90; 90 | 9409 | Ionkin, Alex S; Marshall, William J; Fish, Brian M; Schiffhauer, Matthew F; McEwen, Charles N A stable enol in small ring systems: clear differentiation between penta- and tri-valency of phosphorus atoms. Chemical communications (Cambridge, England), 2008, 5432-5434 |
| 7103523 | CIF | C30 H20 Cl2 F6 O4 Ru2 S2 | P b c n | 20.883; 13.9416; 11.3024 90; 90; 90 | 3290.7 | Motoyama, Keiko; Koike, Takashi; Akita, Munetaka Remarkable switching behavior of bimodally stimuli-responsive photochromic dithienylethenes with redox-active organometallic attachments. Chemical communications (Cambridge, England), 2008, 5812-5814 |
| 7103527 | CIF | C100 H74 Cl2 Fe4 N24 O9 S4 | P b c n | 14.2935; 24.0498; 28.334 90; 90; 90 | 9740.1 | Zhao, Yonggang; Guo, Dong; Liu, Yang; He, Cheng; Duan, Chunying A mixed-valence (Fe(II))(2)(Fe(III))(2) square for molecular expression of quantum cellular automata. Chemical communications (Cambridge, England), 2008, 5725-5727 |
| 7103637 | CIF | C3 H4 N O | P b c n | 8.3253; 11.5995; 6.7148 90; 90; 90 | 648.44 | Holbrey, John D.; Reichert, W. Matthew; Tkatchenko, Igor; Bouajila, Ezzedine; Walter, Olaf; Tommasi, Immacolata; Rogers, Robin D. 1,3-Dimethylimidazolium-2-carboxylate: the unexpected synthesis of an ionic liquid precursor and carbene-CO2 adduct Chemical Communications (Cambridge, United Kingdom), 2003, 28-29 |
| 7103638 | CIF | C6 H8 N2 O2 | P b c n | 8.334; 11.605; 6.706 90; 90; 90 | 648.5 | Holbrey, John D.; Reichert, W. Matthew; Tkatchenko, Igor; Bouajila, Ezzedine; Walter, Olaf; Tommasi, Immacolata; Rogers, Robin D. 1,3-Dimethylimidazolium-2-carboxylate: the unexpected synthesis of an ionic liquid precursor and carbene-CO2 adduct Chemical Communications (Cambridge, United Kingdom), 2003, 28-29 |
| 7103736 | CIF | C21 H27 B N2 | P b c n | 16.068; 7.2471; 16.1949 90; 90; 90 | 1885.84 | J.A.C.Clyburne; A.J.Jennings; H.Jong; I.D.McKenzie; T.Ramnial Chemical communications (Cambridge, England), 2003 |
| 7103963 | CIF | C42 H56 N4 Ni2 O4 S2 | P b c n | 13.0112; 13.8925; 22.1485 90; 90; 90 | 4003.5 | Harrop, Todd C.; Olmstead, Marilyn M.; Mascharak, Pradip K. Dioxygen activation by a dinuclear nickel thiolate complex: structural characterization of the ligand oxidized product Chemical Communications (Cambridge, United Kingdom), 2003, 410-411 |
| 7104377 | CIF | C54 H44 B2 Cl4 Cu F4 N8 | P b c n | 22.128; 8.5689; 27.299 90; 90; 90 | 5176 | Miao, Qing; Shin, Ji-Young; Patrick, Brian O; Dolphin, David Self-assembly of oligomeric linear dipyrromethene metal complexes. Chemical communications (Cambridge, England), 2009, 34, 2541-2543 |
| 7104379 | CIF | C54 H44 B2 Cl4 F4 N8 Ni | P b c n | 22.249; 8.5705; 27.197 90; 90; 90 | 5186.1 | Miao, Qing; Shin, Ji-Young; Patrick, Brian O; Dolphin, David Self-assembly of oligomeric linear dipyrromethene metal complexes. Chemical communications (Cambridge, England), 2009, 34, 2541-2543 |
| 7104556 | CIF | C38 H24 N6 O Pt | P b c n | 20.479; 11.794; 12.66 90; 90; 90 | 3057.8 | Ni, Jun; Zhang, Li-Yi; Wen, Hui-Min; Chen, Zhong-Ning Luminescence vapochromic properties of a platinum(II) complex with 5,5'-bis(trimethylsilylethynyl)-2,2'-bipyridine. Chemical communications (Cambridge, England), 2009, 34, 3801-3803 |
| 7104645 | CIF | C69 H142 Cd4 Cl3 N31 O24 | P b c n | 35.5933; 20.8616; 22.2038 90; 90; 90 | 16487.1 | Ouellette, Wayne; Zubieta, Jon Solid state coordination chemistry of microporous metal-organic frameworks of the cadmium(ii)-4-pyridyltetrazolate family: the structural influences of chloride incorporation. Chemical communications (Cambridge, England), 2009, 34, 4533-4535 |
| 7104699 | CIF | C32 H32 O4 | P b c n | 16.3207; 19.5389; 17.188 90; 90; 90 | 5481.1 | Kennedy, Stuart; Dalgarno, Scott J Modulation of nanotube packing through the controlled self-assembly of tris-p-carboxylatocalix[4]arenes. Chemical communications (Cambridge, England), 2009, 34, 5275-5277 |
| 7104746 | CIF | C24 H40 Ca Cl4 Co N4 O6 | P b c n | 12.474; 13.189; 27.709 90; 90; 90 | 4558.7 | Duriska, Martin B; Neville, Suzanne M; Batten, Stuart R Variable length ligands: a new class of bridging ligands for supramolecular chemistry and crystal engineering. Chemical communications (Cambridge, England), 2009, 34, 5579-5581 |
| 7104755 | CIF | C64 H74 Fe O4 | P b c n | 12.3259; 19.1534; 22.7301 90; 90; 90 | 5366.2 | Ni, Chengbao; Power, Philip P Insertion reactions of a two-coordinate iron diaryl with dioxygen and carbon monoxide. Chemical communications (Cambridge, England), 2009, 34, 5543-5545 |
| 7104886 | CIF | C8 H3 F4 N2 S2 | P b c n | 17.1674; 23.2395; 10.6653 90; 90; 90 | 4255 | Clarke, Caroline S.; Haynes, Delia A.; Rawson, Jeremy M.; Bond, Andrew D. Small molecule fixation by a dithiadiazolyl radical: X-ray crystal structures of (CF3C6H3FCNSSN)2and (CF3C6H3FCNSSN)2˙G (G = N2, Ar, CO2and SO2) Chemical Communications (Cambridge, United Kingdom), 2003, 2774-2775 |
| 7104887 | CIF | C8 H3 F4 N2 S2 | P b c n | 17.1277; 23.2356; 10.6532 90; 90; 90 | 4239.7 | Clarke, Caroline S.; Haynes, Delia A.; Rawson, Jeremy M.; Bond, Andrew D. Small molecule fixation by a dithiadiazolyl radical: X-ray crystal structures of (CF3C6H3FCNSSN)2and (CF3C6H3FCNSSN)2˙G (G = N2, Ar, CO2and SO2) Chemical Communications (Cambridge, United Kingdom), 2003, 2774-2775 |
| 7104888 | CIF | C8 H3 F4 N2 S2 | P b c n | 17.1483; 23.2411; 10.661 90; 90; 90 | 4248.9 | Clarke, Caroline S.; Haynes, Delia A.; Rawson, Jeremy M.; Bond, Andrew D. Small molecule fixation by a dithiadiazolyl radical: X-ray crystal structures of (CF3C6H3FCNSSN)2and (CF3C6H3FCNSSN)2˙G (G = N2, Ar, CO2and SO2) Chemical Communications (Cambridge, United Kingdom), 2003, 2774-2775 |
| 7104889 | CIF | C8 H3 F4 N2 S2 | P b c n | 17.1333; 23.2358; 10.6538 90; 90; 90 | 4241.34 | Clarke, Caroline S.; Haynes, Delia A.; Rawson, Jeremy M.; Bond, Andrew D. Small molecule fixation by a dithiadiazolyl radical: X-ray crystal structures of (CF3C6H3FCNSSN)2and (CF3C6H3FCNSSN)2˙G (G = N2, Ar, CO2and SO2) Chemical Communications (Cambridge, United Kingdom), 2003, 2774-2775 |
| 7105108 | CIF | C60 H60 N9 O4 | P b c n | 32.166; 9.8996; 16.4069 90; 90; 90 | 5224.4 | Savarimuthu Philip Anthony; Sunil Varughese; Sylvia M. Draper Switching and tuning organic solid-state luminescence via a supramolecular approach Chem. Commun., 2009, 7500-7502 |
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