Crystallography Open Database

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7206639 CIFC6 H14 N2P 21 21 28.4; 5.159; 7.61
90; 90; 90
330Cai, Weizhao; Katrusiak, Andrzej
Enantiomeric crystallization of (±)-trans-1,2-diaminocyclohexane under pressure
CrystEngComm, 2011, 13, 6742
7206640 CIFC6 H14 N2P 21 21 28.345; 5.15; 7.558
90; 90; 90
324.8Cai, Weizhao; Katrusiak, Andrzej
Enantiomeric crystallization of (±)-trans-1,2-diaminocyclohexane under pressure
CrystEngComm, 2011, 13, 6742
7206641 CIFC6 H14 N2P 21 21 28.2; 5.13; 7.4
90; 90; 90
311Cai, Weizhao; Katrusiak, Andrzej
Enantiomeric crystallization of (±)-trans-1,2-diaminocyclohexane under pressure
CrystEngComm, 2011, 13, 6742
7206642 CIFC6 H14 N2P 21 21 28.08; 4.914; 7.33
90; 90; 90
291Cai, Weizhao; Katrusiak, Andrzej
Enantiomeric crystallization of (±)-trans-1,2-diaminocyclohexane under pressure
CrystEngComm, 2011, 13, 6742
7206792 CIFC34 H32 Cu N4 O8P 21 21 222.708; 10.553; 19.758
90; 90; 90
4734.8Yu, Fan; Li, Bao
Temperature-controlled synthesis of two novel coordination polymers modeled by semi-rigid tetrapyridines
CrystEngComm, 2011, 13, 7025
7206952 CIFC34 H26 N6 O7 ZnP 21 21 214.978; 32.6149; 6.3668
90; 90; 90
3110.22Liu, Ying-Ying; Li, Jing; Ma, Jian-Fang; Ma, Ji-Cheng; Yang, Jin
A series of 1D, 2D and 3D coordination polymers based on a 5-(benzonic-4-ylmethoxy)isophthalic acid: syntheses, structures and photoluminescence
CrystEngComm, 2012, 14, 169
7206960 CIFC11 H10 N2P 21 21 27.3655; 11.7786; 5.5546
90; 90; 90
481.89Wallentin, Carl-Johan; Orentas, Edvinas; Johnson, Magnus T.; Báthori, Nikoletta B.; Butkus, Eugenijus; Wendt, Ola F.; Wärnmark, Kenneth; Öhrström, Lars
Synthetic and crystallographic studies of bicyclo[3.3.1]nonane derivatives: from strong to weak hydrogen bonds and the stereochemistry of network formation
CrystEngComm, 2012, 14, 178
7207417 CIFC27 H26 Cu N4 O7P 21 21 215.9321; 17.2033; 9.9871
90; 90; 90
2737.31Kan, Wei-Qiu; Ma, Jian-Fang; Liu, Ying-Ying; Yang, Jin
A series of coordination polymers based on 5-(2-carboxybenzyloxy) isophthalic acid and bis(imidazole) ligands: syntheses, topological structures and photoluminescent properties
CrystEngComm, 2012, 14, 2316
7207940 CIFMg Mo O6 TeP 21 21 25.0378; 5.2691; 8.8985
90; 90; 90
236.208Zhang, Junjie; Zhang, Zhonghan; Sun, Youxuan; Zhang, Chengqian; Zhang, Shaojun; Liu, Yang; Tao, Xutang
MgTeMoO6: A neutral layered material showing strong second-harmonic generation
Journal of Materials Chemistry, 2012, 22, 9921
7208097 CIFC14 H16 N O3 SP 21 21 229.1775; 6.2427; 7.2407
90; 90; 90
1318.87Okuno, Takahiro; Sakoda, Yumeko; Kinuta, Takafumi; Sato, Tomohiro; Tokutome, Hayato; Tajima, Nobuo; Nakano, Yoko; Fujiki, Michiya; Kuroda, Reiko; Imai, Yoshitane
Dependence of solid-state optical properties on binding groups in biphenyl acid/amine supramolecular organic complexes
CrystEngComm, 2012, 14, 4819
7208496 CIFC42 H30 N4 O13 Zn2P 21 21 221.739; 23.577; 7.4591
90; 90; 90
3823.1Dai, Ming; Yan, Wen-Yan; Ren, Zhi-Gang; Wang, Hui-Fang; Gong, Wei-Jie; Li, Fu-Ling; Zhao, Xin; Li, Hong-Xi; Lang, Jian-Ping
Zinc(ii) coordination polymers of tetrakis(4-pyridyl)cyclobutane and various dicarboxylates: Syntheses, structures and luminescent properties
CrystEngComm, 2012, 14, 6230
7208498 CIFC27 H18 N2 O5 ZnP 21 21 230.877; 8.0459; 9.1577
90; 90; 90
2275.1Dai, Ming; Yan, Wen-Yan; Ren, Zhi-Gang; Wang, Hui-Fang; Gong, Wei-Jie; Li, Fu-Ling; Zhao, Xin; Li, Hong-Xi; Lang, Jian-Ping
Zinc(ii) coordination polymers of tetrakis(4-pyridyl)cyclobutane and various dicarboxylates: Syntheses, structures and luminescent properties
CrystEngComm, 2012, 14, 6230
7208759 CIFC6 H12 Ba O12 S2P 21 21 219.875; 7.8394; 8.8456
90; 90; 90
1378.2Zhu, Zhi-Biao; Wan, Wang; Deng, Zhao-Peng; Ge, Zhong-Yi; Huo, Li-Hua; Zhao, Hui; Gao, Shan
Structure modulations in luminescent alkaline earth metal-sulfonate complexes constructed from dihydroxyl-1,5-benzenedisulfonic acid: Influences of metal cations, coordination modes and pH value
CrystEngComm, 2012, 14, 6675
7209019 CIFC20 H22 O4P 21 21 29.4979; 16.7194; 5.6273
90; 90; 90
893.61Yeung, Chi-Tung; Yeung, Ho-Lun; Chan, Wesley Ting Kwok; Yan, Siu-Cheong; Tam, Eric C. Y.; Wong, Ka-Leung; Lee, Chi-Sing; Wong, Wing-Tak
Stereolabile chiral biphenyl hybrids: crystallization-induced dynamic atropselective resolution involving supramolecular interactions
CrystEngComm, 2013, 15, 836
7209147 CIFC10 H12 Cd Cl2 N6 O5P 21 21 213; 16.363; 3.7037
90; 90; 90
787.8Seth, Saikat Kumar
Tuning the formation of MOFs by pH influence: X-ray structural variations and Hirshfeld surface analyses of 2-amino-5-nitropyridine with cadmium chloride
CrystEngComm, 2013, 15, 1772
7209357 CIFAg2 B15 Cs O24P 21 21 217.8109; 22.2177; 5.1321
90; 90; 90
2030.86Bluhm, K.; Wiesch, A.
Ag2 Cs (B15 O24): Ein wasserfreies quaternaeres Silber(I)Borat mit einem neuartigen Boratanion mit helixartigem Aufbau
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 1998, 53, 157-160
7210331 CIFC30 H82 N12 O37 Pd6 S10P 21 21 216.252; 19.15; 22.751
90; 90; 90
7081Lin, Zhengguo; Chen, Baokuan; Feng, Xiao; Wang, Bo; Chi, Yingnan; Fan, Yanxuan; Yang, Xinhang; Huang, Xianqiang; Hu, Changwen
Two chiral multinuclear palladium(ii) complexes comprising alternately arranged isomerous hexanuclear clusters
CrystEngComm, 2013, 15, 6461
7211219 CIFC26 H26 Cd N4 O10P 21 21 216.724; 23.732; 14.189
90; 90; 90
5631.5McCormick, Laura J.; Turner, David R.
Inclined 1D→2D polycatenation of chiral chains with large π-surfaces
CrystEngComm, 2013, 15, 8234
7211261 CIFC20 H26 Ag2 Cl2 N6 O8P 21 21 215.3229; 21.2905; 8.0381
90; 90; 90
2622.3Kelemu, Solomon W.; Steel, Peter J.
Diallylaminoarenes: a new class of versatile ligands for silver(i) that consistently lead to one-dimensional polymeric metallosupramolecular assemblies
CrystEngComm, 2013, 15, 9064
7211470 CIFC36 H82 I24 N10 Pb7P 21 21 215.5866; 32.6596; 9.4273
90; 90; 90
4799Wang, Guan-E; Jiang, Xiao-Ming; Zhang, Ming-Jian; Chen, Hui-Fen; Liu, Bin-Wen; Wang, Ming-Sheng; Guo, Guo-Cong
Crystal structures and optical properties of iodoplumbates hybrids templated by in situ synthesized 1,4-diazabicyclo[2.2.2]octane derivatives
CrystEngComm, 2013, 15, 10399
7211475 CIFC8 H20 Ce2 O22 SP 21 21 27.6439; 22.013; 6.1556
90; 90; 90
1035.8Qi, Jin-Li; Zheng, Yue-Qing; Xu, Wei; Zhu, Hong-Lin; Lin, Jian-Li; Chang, Hai-Sheng
New Ce(iii) sulfate‒tartrate-based MOFs: an insight into the controllable self-assembly of acentric metal‒organic complexes
CrystEngComm, 2013, 15, 10618
7211476 CIFC8 H20 Ce2 O22 SP 21 21 27.6486; 22.019; 6.155
90; 90; 90
1036.6Qi, Jin-Li; Zheng, Yue-Qing; Xu, Wei; Zhu, Hong-Lin; Lin, Jian-Li; Chang, Hai-Sheng
New Ce(iii) sulfate‒tartrate-based MOFs: an insight into the controllable self-assembly of acentric metal‒organic complexes
CrystEngComm, 2013, 15, 10618
7212140 CIFC208 H403.4 O171.7P 21 21 229.4201; 29.8907; 30.6856
90; 90; 90
26984.5Enright, Gary D.; Udachin, Konstantin A.; Ripmeester, John A.
Complex packing motifs templated by a pseudo-spherical guest: the structure of β-cyclodextrin‒adamantane inclusion compounds
CrystEngComm, 2010, 12, 1450
7212380 CIFC24 H23 Cl3 O3P 21 21 215.7123; 17.7118; 8.1342
90; 90; 90
2263.69Higham, Luke T.; Scott, Janet L.; Strauss, Christopher R.
Closing the cavity: reactive and light switchable dienone-ether macrocycles
CrystEngComm, 2010, 12, 2803
7212459 CIFC15 H18 N6 O6P 21 21 27.7489; 28.027; 3.8702
90; 90; 90
840.5Lemmerer, Andreas; Bernstein, Joel; Kahlenberg, Volker
One-pot covalent and supramolecular synthesis of pharmaceutical co-crystals using the API isoniazid: a potential supramolecular reagent
CrystEngComm, 2010, 12, 2856
7212769 CIFC14 H8 O3P 21 21 217.034; 3.893; 7.3497
90; 90; 90
487.38Kinuta, Takafumi; Sato, Tomohiro; Tajima, Nobuo; Kuroda, Reiko; Matsubara, Yoshio; Imai, Yoshitane
Chiral crystallization of ether- and imide-bridged biphenyl compounds without any outside chiral source
CrystEngComm, 2010, 12, 3483
7212783 CIFC8 H62 Mo6 N8 O40 P4P 21 21 214.626; 17.129; 9.684
90; 90; 90
2426.1Tan, Hua-Qiao; Chen, Wei-Lin; Liu, Ding; Li, Yang-Guang; Wang, En-Bo
Spontaneous resolution of a new diphosphonate-functionalized polyoxomolybdate
CrystEngComm, 2010, 12, 4017
7212784 CIFC8 H62 Mo6 N8 O40 P4P 21 21 214.615; 17.148; 9.6756
90; 90; 90
2424.9Tan, Hua-Qiao; Chen, Wei-Lin; Liu, Ding; Li, Yang-Guang; Wang, En-Bo
Spontaneous resolution of a new diphosphonate-functionalized polyoxomolybdate
CrystEngComm, 2010, 12, 4017
7212900 CIFC3 H7 N O3P 21 21 29.9244; 10.369; 4.038
90; 90; 90
415.53Dobrowolski, Jan Cz; Jamróz, Michał H; Kołos, Robert; Rode, Joanna E.; Cyrański, Michał K; Sadlej, Joanna
IR low-temperature matrix, X-ray and ab initio study on L-isoserine conformations.
Physical chemistry chemical physics : PCCP, 2010, 12, 10818-10830
7212955 CIFC22 H16 Ag N2 S8 Se8P 21 21 29.5839; 4.983; 34.645
90; 90; 90
1654.5Golhen, Stéphane; Ouahab, Lahcène; Lebeuze, Albert; Bouayed, Mounir; Delhaes, Pierre; Kashimura, Yoshiaki; Kato, Reizo; Binet, Laurent; Fabre, Jean-Marc
Preparation, crystal structures, EHT band calculations and physical properties of κ-(EDS-EDT-TTF)2[Ag2(CN)3] and α-(BETS)2Ag(CN)2
Journal of Materials Chemistry, 1999, 9, 387
7213172 CIFC11 H12 F N O3P 21 21 29.366; 16.003; 7.598
90; 90; 90
1138.8Banks, John W.; Batsanov, Andrei S.; Howard, Judith A. K.; O’Hagan, David; Rzepa, Henry S.; Martin-Santamaria, Sonsoles
The preferred conformation of α-fluoroamides
Journal of the Chemical Society, Perkin Transactions 2, 1999, 2409
7213195 CIFC23 H23 F N O2 PP 21 21 211.8451; 27.3815; 6.0985
90; 90; 90
1978Kotoris, Christopher C.; Wen, Wendy; Lough, Alan; Taylor, Scott D.
Preparation of chiral α-monofluoroalkylphosphonic acids and their evaluation as inhibitors of protein tyrosine phosphatase 1B
Journal of the Chemical Society, Perkin Transactions 1, 2000, 1271
7213198 CIFC23 H23 F N O2 PP 21 21 212.2726; 24.9928; 6.6447
90; 90; 90
2038.1Kotoris, Christopher C.; Wen, Wendy; Lough, Alan; Taylor, Scott D.
Preparation of chiral α-monofluoroalkylphosphonic acids and their evaluation as inhibitors of protein tyrosine phosphatase 1B
Journal of the Chemical Society, Perkin Transactions 1, 2000, 1271
7213275 CIFC35 H46 Br Cl3 O3P 21 21 219.0851; 19.4641; 9.5618
90; 90; 90
3552Dinger, Maarten B.; Scott, Michael J.
Hydroxy-substituted triarylcarbenium bromides. Synthesis, structure, derivatization and facile conversion to highly substituted xanthenes †
Journal of the Chemical Society, Perkin Transactions 1, 2000, 1741
7213728 CIFC15 H20 N2 O2P 21 21 212.0653; 29.4244; 7.6893
90; 90; 90
2729.81Zhang, Qi; Lu, Liye; Dai, Wenjuan; Mei, Xuefeng
Polymorphism and isomorphism of Huperzine A solvates: structure, properties and form transformation
CrystEngComm, 2014, 16, 1919
7213729 CIFC17.5 H24 N2 O1.5P 21 21 214.7583; 29.841; 7.5013
90; 90; 90
3303.6Zhang, Qi; Lu, Liye; Dai, Wenjuan; Mei, Xuefeng
Polymorphism and isomorphism of Huperzine A solvates: structure, properties and form transformation
CrystEngComm, 2014, 16, 1919
7213731 CIFC15.25 H18.75 N2.25 O1.5P 21 21 212.1; 29.76; 7.7
90; 90; 90
2772.7Zhang, Qi; Lu, Liye; Dai, Wenjuan; Mei, Xuefeng
Polymorphism and isomorphism of Huperzine A solvates: structure, properties and form transformation
CrystEngComm, 2014, 16, 1919
7214399 CIFC35 H36 N4 O12 Zn2P 21 21 216.397; 18.642; 7.9656
90; 90; 90
2434.9Ju, Zemin; Cao, Dapeng; Qin, Ling; Zhang, Chuanlei; Zhang, Mingdao; Shi, Zhiqiang; Zheng, Hegen
Syntheses, characterization, and properties of five coordination compounds based on the ligand tetrakis(4-pyridyloxymethylene)methane
CrystEngComm, 2014, 16, 3917
7214678 CIFC16 H42 Cd6 O39P 21 21 213.7005; 15.6523; 9.4417
90; 90; 90
2024.7Vera-Cruz, Paula; Toscano, Rubén A.; Balmaseda, Jorge; Basterrechea, Mario; Niño, Netzahualcoyotl; Felipe del Castillo, Luis
Synthesis and crystal structure of three new cadmium tartrates with open frameworks
CrystEngComm, 2012, 14, 8606
7214920 CIFC44 H68 N20 O29P 21 21 215.8841; 12.4803; 14.1747
90; 90; 90
2810Chen, Kai; Liang, Li-Li; Liu, Hao-Jing; Tao, Zhu; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang
p-Hydroxybenzoic acid-assisted homochiral 1D-helical coordination polymers from calcium cations and cucurbit[5]uril
CrystEngComm, 2012, 14, 8049
7214922 CIFC40 H40 N25 O20P 21 21 215.8841; 12.4803; 14.1747
90; 90; 90
2810Chen, Kai; Liang, Li-Li; Liu, Hao-Jing; Tao, Zhu; Xue, Sai-Feng; Zhang, Yun-Qian; Zhu, Qian-Jiang
p-Hydroxybenzoic acid-assisted homochiral 1D-helical coordination polymers from calcium cations and cucurbit[5]uril
CrystEngComm, 2012, 14, 8049
7214933 CIFC12 H10 Br2 Cd N4 S4P 21 21 210.999; 16.628; 5.1034
90; 90; 90
933.4Jia, Hong-Li; Jia, Ming-Jun; Ding, Hong; Yu, Jie-Hui; Jin, Juan; Zhao, Jin-Jing; Xu, Ji-Qing
New thiocyanatocadmates with bidentate N-heterocyclic molecules as the templating agents: synthesis and structural characterization
CrystEngComm, 2012, 14, 8000
7215223 CIFC12 H18 O3P 21 21 216.149; 17.459; 8.1259
90; 90; 90
2291.1Gubaidullin, Aidar T.; Samigullina, Aida I.; Bredikhina, Zemfira A.; Bredikhin, Alexander A.
Crystal structure of chiral ortho-alkyl phenyl ethers of glycerol: true racemic compound, normal, false and anomalous conglomerates within the single five-membered family
CrystEngComm, 2014, 16, 6716
7217202 CIFC69 H74 Cl2 Mo2 N2 O8P 21 21 214.6862; 15.6249; 13.2871
90; 90; 90
3049Chen, Yu; Ma, Li; Bian, Zheng; Jin, Rizhe; Kang, Chuanqing; Li, Zongjun; Gao, Xiang; Han, Fushe; Qiu, Xuepeng; Gao, Lianxun
The crystallographic observation of mesitylene‒mesitylene and mesitylene‒CH2Cl2‒mesitylene adducts trapped in an irregular cavity
CrystEngComm, 2014, 16, 8652
7217277 CIFC32 H44 Cl2 Cu N8 O16P 21 21 211.3423; 19.2826; 9.5549
90; 90; 90
2089.74Suman, Kumari; Baig, Fayaz; Kant, Rajani; Gupta, Vivek; Mandal, Sanjay; Sarkar, Madhushree
Is Metal Metathesis a Framework-Templating Strategy to Synthesize Coordination Polymers? Transmetallation Studies involving Flexible ligands
RSC Advances, 2014
7217450 CIFC35 H36 Cl2 N4 OP 21 21 224.1816; 10.4269; 11.7456
90; 90; 90
2961.53Cross, Jacob T.; Rossi, Nicholas A.; Serafin, Mateusz; Wheeler, Kraig A.
Tröger's base quasiracemates and crystal packing tendencies
CrystEngComm, 2014, 16, 7251
7217676 CIFC20 H30 O3P 21 21 215.646; 10.703; 10.876
90; 90; 90
1821Huang, Hong-Li; Qi, Feng-Ming; Yuan, Ji-Cheng; Zhao, Cai-Gui; Yang, Jing-Wei; Fang, Fu-Hu; Wu, Quan-xiang; Gao, Kun; Yuan, Cheng-Shan
Labdane-Type Diterpenoids from Croton laevigatus
RSC Advances, 2014
7218135 CIFC4 H11 N O5P 21 21 212.332; 9.9903; 5.80218
90; 90; 90
714.83Kapustin, E. A.; Minkov, V. S.; Boldyreva, E. V.
Oxidative stress of H2O2on N,N-dimethylglycine: formation of perhydrate crystals and more
CrystEngComm, 2014, 16, 10165
7218734 CIFC24 H54 O22 Sr U2P 21 21 213.4543; 18.4479; 16.4994
90; 90; 90
4095.2Savchenkov, Anton V.; Klepov, Vladislav V.; Vologzhanina, Anna V.; Serezhkina, Larisa B.; Pushkin, Denis V.; Serezhkin, Viktor N.
Trinuclear {Sr[UO2L3]2(H2O)4} and pentanuclear {Sr[UO2L3]4}2−uranyl monocarboxylate complexes (L-acetate or n-butyrate ion)
CrystEngComm, 2015, 17, 740
7219158 CIFC19 H22 N4 O7P 21 21 221.196; 4.605; 10.551
90; 90; 90
1029.9Bera, Santu; Maity, Sibaprasad; Haldar, Debasish
Assembly of encapsulated water in hybrid bisamides: helical and zigzag water chains
CrystEngComm, 2015, 17, 1569

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