Crystallography Open Database

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7052910 CIFC16 H46 Cl2 Cu2 N4 O14P 21 21 216.226; 16.2256; 5.601
90; 90; 90
1474.61Maclaren, Jana K.; Sanchiz, Joaquín; Gili, Pedro; Janiak, Christoph
Hydrophobic-exterior layer structures and magnetic properties of trinuclear copper complexes with chiral amino alcoholate ligands
New Journal of Chemistry, 2012, 36, 1596
7052936 CIFC65 H106.08 Cl6 O39.04 SP 21 21 226.907; 29.784; 20.352
90; 90; 90
16310Cruickshank, Dyanne L.; Bourne, Susan A.; Caira, Mino R.
A solid-state study of the inclusion of endosulfan in native and derivatised cyclodextrins using X-ray diffraction and thermoanalytical methods
New Journal of Chemistry, 2012, 36, 2007
7053618 CIFC58 H57 Cl6 N2 P4 RhP 21 21 219.416; 24.922; 10.803
90; 90; 90
5227.4Buchard, Antoine; Payet, Elina; Auffrant, Audrey; Goff, Xavier Le; Floch, Pascal Le
Iminophosphorane-based [P2N2] rhodium complexes: synthesis, reactivity, and application in catalysed transfer hydrogenation of polar bonds
New Journal of Chemistry, 2010, 34, 2943
7053673 CIFC25 H35 Br Cl4 Cr N OP 21 21 212.321; 25.157; 9.3501
90; 90; 90
2898.2Sun, Mingtai; Mu, Ying; Wu, Qiaolin; Gao, Wei; Ye, Ling
Synthesis, structures and ethylene polymerization behavior of half-metallocene chromium(iii) catalysts bearing salicylaldiminato ligands
New Journal of Chemistry, 2010, 34, 2979
7053750 CIFC39 H38 N3 O4.5P 21 21 217.6804; 18.0029; 10.2337
90; 90; 90
3257.37Suwinska, Kinga; Shkurenko, Oleksandr; Mbemba, Cyrille; Leydier, Antoine; Jebors, Said; Coleman, Anthony W.; Matar, Rima; Falson, Pierre
Trianionic calix[4]arene monoalkoxy derivatives: synthesis, solid-state structures and self-assembly properties
New Journal of Chemistry, 2008, 32, 1988
7053751 CIFC40 H39 N3 O4P 21 21 217.6752; 17.6984; 10.6227
90; 90; 90
3323Suwinska, Kinga; Shkurenko, Oleksandr; Mbemba, Cyrille; Leydier, Antoine; Jebors, Said; Coleman, Anthony W.; Matar, Rima; Falson, Pierre
Trianionic calix[4]arene monoalkoxy derivatives: synthesis, solid-state structures and self-assembly properties
New Journal of Chemistry, 2008, 32, 1988
7053754 CIFC30 H29 N2 O2.5P 21 21 216.2996; 24.9; 5.747
90; 90; 90
2332.5Imai, Yoshitane; Kawano, Kenta; Nakano, Yoko; Kawaguchi, Kakuhiro; Harada, Takunori; Sato, Tomohiro; Fujiki, Michiya; Kuroda, Reiko; Matsubara, Yoshio
Control of circularly polarized luminescence (CPL) properties by supramolecular complexation
New Journal of Chemistry, 2008, 32, 1110
7055217 CIFC29 H22 Cd1.5 N4 O7P 21 21 215.7377; 21.1254; 11.7487
90; 90; 90
3906Xu, Zhong-Xuan; Liu, Liyang; Zhang, Jian
A pair of homochiral porous metal‒organic frameworks with a helical metal-carboxylate layer
New J. Chem., 2016, 40, 1927
7055218 CIFC29 H22 Cd1.5 N4 O7P 21 21 215.6969; 20.9233; 11.7168
90; 90; 90
3848.2Xu, Zhong-Xuan; Liu, Liyang; Zhang, Jian
A pair of homochiral porous metal‒organic frameworks with a helical metal-carboxylate layer
New J. Chem., 2016, 40, 1927
7056913 CIFC3 N8 O6P 21 21 27.7188; 16.867; 6.4384
90; 90; 90
838.23Ma, Qing; Gu, Hao; Huang, Jinglun; Nie, Fude; Fan, Guijuan; Liao, Longyu; Yang, Wei
Formation of trinitromethyl functionalized 1,2,4-triazole-based energetic ionic salts and a zwitterionic salt directed by an intermolecular and intramolecular metathesis strategy
New Journal of Chemistry, 2018, 42, 2376
7057484 CIFC54 H52 Ag Cl Fe2 N2 O6 P2P 21 21 211.2448; 19.9704; 11.2323
90; 90; 90
2522.4Bárta, Ondřej; Drusan, Michal; Císařová, Ivana; Šebesta, Radovan; Štěpnička, Petr
Synthesis and structural characterisation of Group 11 metal complexes with a phosphinoferrocene oxazoline
New Journal of Chemistry, 2018, 42, 11450
7057983 CIFC28 H25 N2 O5 ReP 21 21 217.8677; 12.9186; 10.731
90; 90; 90
2476.99Skiba, Joanna; Kowalczyk, Aleksandra; Stączek, Paweł; Bernaś, Tytus; Trzybiński, Damian; Woźniak, Krzysztof; Schatzschneider, Ulrich; Czerwieniec, Rafał; Kowalski, Konrad
Luminescent fac-[Re(CO)3(phen)] carboxylato complexes with non-steroidal anti-inflammatory drugs: synthesis and mechanistic insights into the in vitro anticancer activity of fac-[Re(CO)3(phen)(aspirin)]
New Journal of Chemistry, 2019, 43, 573
7057984 CIFC29 H21 N2 O6 ReP 21 21 26.16143; 46.2179; 9.40358
90; 90; 90
2677.84Skiba, Joanna; Kowalczyk, Aleksandra; Stączek, Paweł; Bernaś, Tytus; Trzybiński, Damian; Woźniak, Krzysztof; Schatzschneider, Ulrich; Czerwieniec, Rafał; Kowalski, Konrad
Luminescent fac-[Re(CO)3(phen)] carboxylato complexes with non-steroidal anti-inflammatory drugs: synthesis and mechanistic insights into the in vitro anticancer activity of fac-[Re(CO)3(phen)(aspirin)]
New Journal of Chemistry, 2019, 43, 573
7058316 CIFC17 H22 O4P 21 21 27.6481; 30.186; 6.7702
90; 90; 90
1563Tănase, Constantin I.; Cocu, Florea; Drăghici, Constantin; Hanganu, Anamaria; Pintilie, Lucia; Maganu, Maria; Munteanu, Cristian V. A.; Shova, Sergiu
Secondary compounds in the catalytic hydrogenation of enone and allylic alcohol prostaglandin intermediates: isolation, characterization, and X-ray crystallography
New Journal of Chemistry, 2019, 43, 7582
7058969 CIFC34 H46 O4P 21 21 212.2984; 14.6289; 7.9467
90; 90; 90
1429.71Brüllingen, Eric; Neudörfl, Jörg-Martin; Goldfuss, Bernd
Ligand's electronegativity controls the sense of enantioselectivity in BIFOP-X palladium-catalyzed allylic alkylations
New Journal of Chemistry, 2019, 43, 15743
7060299 CIFC40 H43 Eu N12 O9P 21 21 211.3607; 17.4615; 10.4929
90; 90; 90
2081.5Bryleva, Yuliya A.; Ustimenko, Yuliya P.; Plyusnin, Victor F.; Mikheilis, Alexsandr V.; Shubin, Aleksandr A.; Glinskaya, Ludmila A.; Komarov, Vladislav Yu.; Agafontsev, Alexander M.; Tkachev, Alexey V.
Ln(iii) complexes with a chiral 1H-pyrazolo[3,4-b]pyridine derivative fused with a (−)-α-pinene moiety: synthesis, crystal structure, and photophysical studies in solution and in the solid state
New Journal of Chemistry, 2021, 45, 2276-2284
7060742 CIFC18 H12 B2 O4P 21 21 222.542; 4.7936; 6.9265
90; 90; 90
748.46Cheng, Jun; Lu, Chengrong; Zhao, Bei
Cycloaddition of carbon dioxide and epoxides catalyzed by rare earth metal complexes bearing a Trost ligand
New Journal of Chemistry, 2021, 45, 13096-13103
7061449 CIFC18 H10 Fe N6 NiP 21 21 217.604; 7.008; 7.319
90; 90; 90
902.9Terrero, R.; Avila, Y.; Mojica, R.; Cano, A.; Gonzalez, M.; Avila, M.; Reguera, E.
Thermally induced spin-crossover in the Fe(3-ethynylpyridine)2[M(CN)4] series with M = Ni, Pd, and Pt. The role of the electron density found at the CN 5σ orbital
New Journal of Chemistry, 2022, 46, 9618-9628
7061450 CIFC18 H10 Fe N6 PdP 21 21 217.639; 7.2987; 7.4677
90; 90; 90
961.4Terrero, R.; Avila, Y.; Mojica, R.; Cano, A.; Gonzalez, M.; Avila, M.; Reguera, E.
Thermally induced spin-crossover in the Fe(3-ethynylpyridine)2[M(CN)4] series with M = Ni, Pd, and Pt. The role of the electron density found at the CN 5σ orbital
New Journal of Chemistry, 2022, 46, 9618-9628
7061753 CIFC58 H60 N6 Ni3 O16P 21 21 218.1188; 24.6086; 7.652
90; 90; 90
3411.9Mahish, Manas Kumar; Carrella, Luca M.; Patra, Apu; Saren, Dama; Zangrando, Ennio; Vojtíšek, Pavel; Rentschler, Eva; Manna, Subal Chandra
Tryptophan moiety ligand based tri/tetranuclear Ni(ii) complexes: syntheses, structure and magnetic properties
New Journal of Chemistry, 2022, 46, 16899-16906
7062661 CIFC35 H59 N OP 21 21 237.284; 12.3609; 6.9822
90; 90; 90
3217.8Iftime, Manuela-Maria; Ailiesei, Gabriela Liliana; Shova, Sergiu; Miron, Camelia; Tanaka, Hiromasa; Hori, Masaru; Marin, Luminita
New betulin imine derivatives with antioxidant and selective antitumor activity
New Journal of Chemistry, 2023, 47, 16551-16563
7062760 CIFC60 H46 Co2 N8 O12P 21 21 218.3153; 19.6079; 8.6585
90; 90; 90
3109.48Yan, Mei-Hua; Ray, Manaswini; Wang, Jun; Lu, Lu; Zhang, Wei; Muddassir, Mohd.; Mohanty, Aurobinda
Structural diversity of three new Co(ii)-based MOFs as a UV light-driven photocatalyst: photocatalytic performance
New Journal of Chemistry, 2023, 47, 19167-19176
7062930 CIFC50 H33 N25P 21 21 221.273; 7.2489; 15.064
90; 90; 90
2323Korotina, Anna V.; Tolshchina, Svetlana G.; Gazizov, Denis A.; Steparuk, Alexander S.; Kim, Grigory A.; Demina, Nadezhda S.; Ganebnykh, Ilya N.; Slepukhin, Pavel A.; Aleksandrov, Alexey E.; Tameev, Alexey R.; Rusinov, Gennady L.
Novel helix-shape bis[1,2,4]triazolo[4,3-b:3′,4′-f][1,2,4,5]tetrazines: synthesis, optical and charge-transfer properties
New Journal of Chemistry, 2024, 48, 1983-1991
7063128 CIFC24 H24 N2 O4P 21 21 213.243; 20.798; 7.7513
90; 90; 90
2134.92Bakija, Marija; Perić, Berislav; Kirin, Srećko I.
Oxazoline amino acid bioconjugates: one-pot synthesis and analysis of supramolecular interactions
New Journal of Chemistry, 2024, 48, 8702-8719
7100001 CIFC13 H16 N4 O2P 21 21 232.0792; 14.408; 7.2035
90; 90; 90
3329.44Jon Parquette; Judith C. Gallucci; Adam J. Preston
The Influence of Sterics on the Formation of Polar 1-D Hydrogen-Bonded Networks
Chemical Communications, 2005
7100513 CIFC12 H27 O23.5 Pr2P 21 21 27.5802; 28.044; 6.1008
90; 90; 90
1296.9Ian Williams; John A. Cha; Stephen S.-Y. Chui; Andy L.-F. Leung; Herman H. Y. Sung; Samadara Thushari; Yu-Fong Yen.
Microporous chiral metal coordination polymers: hydrothermal synthesis, channel engineering and thermal stability of lanthanide tartrates
Chemical Communications, 2005
7100516 CIFC58 H70 Cl6 O12 Ti2P 21 21 214.8415; 25.3203; 8.0438
90; 90; 90
3022.8Chemical Communications, 2005
7100636 CIFC10 H18 N4 O2P 21 21 29.705; 7.66; 7.818
90; 90; 90
581.23Jian Sun; Chuanling Cheng; Fan Jiang; Chao Wang; Siyu Wei; Yun-Dong Wu; Yu Zhang
Protonated N'-benzyl-N'-prolyl Proline Hydrazide as Highly Enantioselective Catalyst for Direct Asymmetric Aldol Reaction
Chemical Communications, 2006
7100839 CIFC50 H76 Si4 Sn2P 21 21 221.232; 24.238; 10.398
90; 90; 90
5351Alan Cowley; Jamie N. Jones
pi-Indenyl tin(II) and lead(II) compounds
Chemical Communications, 2005
7101552 CIFC44 H50 Cl6 F12 N4 Pd2 Sb2P 21 21 216.179; 15.653; 10.866
90; 90; 90
2751.7Hoi Lun Kwong; Ho-Lun Yeung; Wing-Sze Lee; Wing-Tak Wong
Stereoselective formation of a single-stranded helicate: Structure of a bis(Palladium-allyl)quaterpyridine complex and its use in catalytic enantioselective allylic substitution
Chemical Communications, 2006
7101669 CIFC56 H51.5 Cl6.5 P4P 21 21 215.2377; 20.5124; 8.7621
90; 90; 90
2738.7Stallinger, Silvia; Reitsamer, Christian; Schuh, Walter; Kopacka, Holger; Wurst, Klaus; Peringer, Paul
Novel route to carbodiphosphoranes producing a new P,C,P pincer carbene ligand.
Chemical communications (Cambridge, England), 2007, 510-512
7102052 CIFC10 H10 Ag B F4 N4 SP 21 21 27.608; 8.883; 9.914
90; 90; 90
670Black, Cory A; Hanton, Lyall R; Spicer, Mark D
A coordination polymer strategy for anion encapsulation: anion-pi interactions in (4,4) nets formed from Ag(I) salts and a flexible pyrimidine ligand.
Chemical communications (Cambridge, England), 2007, 3171-3173
7102053 CIFC10 H10 Ag Cl N4 O4 SP 21 21 27.7198; 9.1284; 9.7867
90; 90; 90
689.66Black, Cory A; Hanton, Lyall R; Spicer, Mark D
A coordination polymer strategy for anion encapsulation: anion-pi interactions in (4,4) nets formed from Ag(I) salts and a flexible pyrimidine ligand.
Chemical communications (Cambridge, England), 2007, 3171-3173
7102054 CIFC10 H10 Ag F6 N4 P SP 21 21 27.8018; 9.0824; 9.902
90; 90; 90
701.6Black, Cory A; Hanton, Lyall R; Spicer, Mark D
A coordination polymer strategy for anion encapsulation: anion-pi interactions in (4,4) nets formed from Ag(I) salts and a flexible pyrimidine ligand.
Chemical communications (Cambridge, England), 2007, 3171-3173
7102395 CIFC26.375 H31 Cl0.75 N8 O6.125P 21 21 225.0498; 20.9704; 11.7186
90; 90; 90
6155.8Odriozola, Ibon; Kyritsakas, Nathalie; Lehn, Jean-Marie
Structural codons: linearity/helicity interconversion by pyridine/pyrimidine exchange in molecular strands.
Chemical communications (Cambridge, England), 2004, 62-63
7102867 CIFC26 H34 I2 N2 O2P 21 21 213.088; 13.546; 7.532
90; 90; 90
1335.35Clayden, Jonathan; Vallverdú, Lluís; Clayton, James; Helliwell, Madeleine
Conformational switching between diastereoisomeric atropisomers of arenedicarboxamides induced by complexation with Lewis acids.
Chemical communications (Cambridge, England), 2008, 561-563
7102882 CIFC62 H74 N4 O14P 21 21 213.7716; 15.0164; 15.8042
90; 90; 90
3268.3Tanaka, Koichi; Oda, Shinji; Shiro, Motoo
A novel chiral porous metal-organic framework: asymmetric ring opening reaction of epoxide with amine in the chiral open space.
Chemical communications (Cambridge, England), 2008, 820-822
7102966 CIFC18 H18 Cu2 N4 O8P 21 21 221.424; 6.897; 7.8
90; 90; 90
1152.5Ingleson, Michael J; Barrio, Jorge Perez; Bacsa, John; Dickinson, Calum; Park, Hyunsoo; Rosseinsky, Matthew J
Generation of a solid Brønsted acid site in a chiral framework.
Chemical communications (Cambridge, England), 2008, 1287-1289
7103066 CIFC39 H57 N2 O P2 Si3 YP 21 21 218.7425; 22.3897; 10.4415
90; 90; 90
4381.7Liddle, Stephen T; McMaster, Jonathan; Green, Jennifer C; Arnold, Polly L
Synthesis and structural characterisation of an yttrium-alkyl-alkylidene.
Chemical communications (Cambridge, England), 2008, 1747-1749
7103197 CIFC23 H25 Br O10P 21 21 215.9364; 15.936; 18.6763
90; 90; 90
4743.2Bertelsen, Søren; Johansen, Rasmus L; Jørgensen, Karl Anker
Controlling the formation of 1 out of 64 stereoisomers using organocatalysis.
Chemical communications (Cambridge, England), 2008, 3016-3018
7103198 CIFC23 H25 Br O10P 21 21 215.9402; 15.9657; 18.6847
90; 90; 90
4755.2Bertelsen, Søren; Johansen, Rasmus L; Jørgensen, Karl Anker
Controlling the formation of 1 out of 64 stereoisomers using organocatalysis.
Chemical communications (Cambridge, England), 2008, 3016-3018
7103713 CIFC26 H27 N OP 21 21 216.847; 22.696; 5.6162
90; 90; 90
2147.3Hayes, J. F.; Prévost, N.; Prokeš, I.; Shipman, M.; Slawin, A. M. Z.; Twin, H.
Aziridinyl anions from a chiral, nonracemic 2-isopropylidineaziridine: surprisingly diastereoselective alkylation reactions
Chemical Communications (Cambridge, United Kingdom), 2003, 1344-1345
7104022 CIFC47 H56 Cl3 Fe N2 P2 RuP 21 21 222.663; 13.305; 14.5132
90; 90; 90
4376.2Leong, Carolyn G.; Akotsi, Okwado M.; Ferguson, Michael J.; Bergens, Steven H.
A ruthenium catalyst that does not require an N‒H ligand to achieve high enantioselectivity for hydrogenation of an alkyl-aryl ketone
Chemical Communications (Cambridge, United Kingdom), 2003, 750-751
7104081 CIFC26 H22 Co N8 S2P 21 21 216.4121; 19.4406; 9.3903
90; 90; 90
2996.1Mok Shin, Dong; Su Lee, In; Keun Chung, Young; Soo Lah, Myoung
Coordination polymers based on square planar Co(II) node and linear spacer: solvent-dependent pseudo-polymorphism and an unprecedented interpenetrating structure containing both 2D and 3D topological isomers
Chemical Communications (Cambridge, United Kingdom), 2003, 1036-1037
7104316 CIFC60 H60 Cu2 F12 N8 P2 S4P 21 21 216.41; 22.331; 11.2911
90; 90; 90
4137.6Tsang, Chui-Shan; Yeung, Ho-Lun; Wong, Wing-Tak; Kwong, Hoi-Lun
Diastereoselective formation of a dicopper(i) helicate with a chiral tetradentate pyridylthiazole ligand.
Chemical communications (Cambridge, England), 2009, 34, 1999-2001
7104579 CIFC11 H13 Cl N2P 21 21 214.8792; 7.4397; 10.0119
90; 90; 90
1108.3Tsai, Andy S; Wilson, Rebecca M; Harada, Hitoshi; Bergman, Robert G; Ellman, Jonathan A
Rhodium catalyzed enantioselective cyclization of substituted imidazoles via C-H bond activation.
Chemical communications (Cambridge, England), 2009, 34, 3910-3912
7105351 CIFC28 H32 N2 O4P 21 21 212.366; 27.132; 7.849
90; 90; 90
2633.5Yuan, Guozan; Zhu, Chengfeng; Liu, Yan; Fang, Yu; Cui, Yong
Water clusters induced assembly of chiral organic microstructures showing reversible phase transformations and luminescence switching.
Chemical communications (Cambridge, England), 2010, 46, 2307-2309
7105645 CIFC27 H22 Br N O2P 21 21 214.772; 11.1689; 13.281
90; 90; 90
2191.2Wang, Liang-Liang; Peng, Lin; Bai, Jian-Fei; Huang, Qing-Chun; Xu, Xiao-Ying; Wang, Li-Xin
Highly organocatalytic asymmetric Michael-ketone aldol-dehydration domino reaction: straightforward approach to construct six-membered spirocyclic oxindoles.
Chemical communications (Cambridge, England), 2010, 46, 8064-8066
7105737 CIFC16.45 H16.675 Cl2 N2.225 PdP 21 21 221.0215; 8.29; 9.0928
90; 90; 90
1584.59Steven Wales; Anthony Willis; Paul Keller
The first stereoselective syntheses of 2,2'-biindoline
Chem.Commun., 2010, 46, 9226
7105849 CIFC88 H120 Al4 N8 O4 Zn2P 21 21 225.1451; 31.1622; 14.4981
90; 90; 90
11360.4Janusz Lewinski; Tomasz Kaczorowski; Iwona Justyniak; Daniel Prochowicz
Development of Chiral N,N-Ditopic Metalloligands Based on Cinchona Alkaloids for Constructing Homochiral Coordination Polymers
Chem.Commun., 2011, 47, 950

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