Crystallography Open Database

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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
7219547 CIFC14 H13.33333 Ba Li2 N5.33333 O9.33333P 21 21 210.8783; 28.3945; 9.2141
90; 90; 90
2846.09Song, Ying; Lin, Chen-Sheng; Zhang, Ming-Jian; Wei, Qi; Feng, Mei-Ling; Huang, Xiao-Ying
Assembly of noncentrosymmetric coordination polymers by the integration of acentric Ba(ii)/Sr(ii) and Li(i) coordination polyhedra
CrystEngComm, 2015, 17, 3418
7220106 CIFC26 H52 N5 O10 P3P 21 21 212.4915; 13.3518; 9.9705
90; 90; 90
1662.92Gutowska, Natalia; Seliger, Piotr; Andrijewski, Grzegorz; Siwy, Mariola; Małecka, Magdalena; Kusz, Joachim
Single and double crown macrocyclic derivatives of cyclotriphosphazene as receptors of silver(i) ions
RSC Adv., 2015, 5, 38435
7220624 CIFC136 H98 N10 O28 Zn5P 21 21 214.2642; 42.291; 9.6129
90; 90; 90
5799Zhao, Lun; Guo, Huadong; Tang, Dong; Zhang, Min
Syntheses, characterization and properties of nine novel Zn(ii) coordination polymers based on 4,4′-(phenylazanediyl)dibenzoic acid and various N-donor ligands
CrystEngComm, 2015, 17, 5451
7221618 CIFC117 H148 Cl10 N12 Ti4P 21 21 221.8842; 28.7235; 9.4156
90; 90; 90
5918.6Nomura, Kotohiro; Patamma, Srisuda; Matsuda, Hideshi; Katao, Shohei; Tsutsumi, Ken; Fukuda, Hiroya
Synthesis of Half-Titanocenes Containing 1,3-Imidazolidin-2-Iminato Ligands of type, Cp*TiCl2[1,3-R2(CH2N)2C=N]: Highly Active Catalyst Precursors in Ethylene (Co)polymerisation
RSC Adv., 2015
7222452 CIFC22 H19 In N2 O8P 21 21 219.7244; 17.0814; 9.9554
90; 90; 90
3354.18Qian, Jinjie; Yu, Panpan; Su, Kongzhao; Dong, Youqing; Huang, Shaoming; Hong, Maochun
Crystal structure, morphology and sorption behaviour of porous indium-tetracarboxylate framework materials
CrystEngComm, 2015, 17, 8512
7223438 CIFC45 H44 O28 Zn6P 21 21 217.382; 10.4516; 15.97
90; 90; 90
2901.3McCormick, Laura J.; Morris, Samuel A.; Slawin, Alexandra M. Z.; Teat, Simon J.; Morris, Russell E.
Coordination polymers of 5-substituted isophthalic acid.
CrystEngComm / RSC, 2016, 18, 1123-1132
7223776 CIFC56 H99 Ag7 N21 O0.5P 21 21 225.5782; 25.6108; 11.5927
90; 90; 90
7594.1Yang, Xiao; Wang, Yu; Zhou, Hao-Long; Liu, Yi-Jiang; He, Chun-Ting; Lin, Rui-Biao; Zhang, Jie-Peng
Guest-containing supramolecular isomers of silver(i) 3,5-dialkyl-1,2,4-triazolates: syntheses, structures, and structural transformation behaviours
CrystEngComm, 2015, 17, 8843
7223872 CIFC26 H34 O3 SP 21 21 29.7748; 36.406; 6.5704
90; 90; 90
2338.2Huang, Mingming; Hu, Liangzhen; Shen, Hang; Liu, Qing; Hussain, Muhammad Ijaz; Pan, Jing; Xiong, Yan
Sulfination of alcohols with sodium sulfinates promoted by BF3·OEt2: an unexpected access
Green Chem., 2016, 18, 1874
7224179 CIFC12 H8 I6 N2 O2 RuP 21 21 215.6811; 7.3656; 9.4737
90; 90; 90
1094.22Ding, Xin; Tuikka, Matti J.; Hirva, Pipsa; Kukushkin, Vadim Yu.; Novikov, Alexander S.; Haukka, Matti
Fine-tuning halogen bonding properties of diiodine through halogen‒halogen charge transfer ‒ extended [Ru(2,2′-bipyridine)(CO)2X2]·I2systems (X = Cl, Br, I)
CrystEngComm, 2016, 18, 1987
7224648 CIFC87 H72 La2 N2 O40P 21 21 220.164; 16.345; 16.679
90; 90; 90
5497Sun, Jing-Wen; Li, Shang-Ju; Yan, Peng-Fei; Yao, Xu; Li, Guang-Ming
In situ recrystallization of lanthanide coordination polymers: from 1D ladder chains to 1D linear chains
CrystEngComm, 2016, 18, 3079
7224649 CIFC44 H36 Lu N O20P 21 21 220.052; 16.35; 16.623
90; 90; 90
5450Sun, Jing-Wen; Li, Shang-Ju; Yan, Peng-Fei; Yao, Xu; Li, Guang-Ming
In situ recrystallization of lanthanide coordination polymers: from 1D ladder chains to 1D linear chains
CrystEngComm, 2016, 18, 3079
7224650 CIFC44 H36 Gd N O20P 21 21 220.14; 16.625; 16.701
90; 90; 90
5592Sun, Jing-Wen; Li, Shang-Ju; Yan, Peng-Fei; Yao, Xu; Li, Guang-Ming
In situ recrystallization of lanthanide coordination polymers: from 1D ladder chains to 1D linear chains
CrystEngComm, 2016, 18, 3079
7224651 CIFC44 H36 N O20 PrP 21 21 220.285; 16.776; 16.805
90; 90; 90
5718.8Sun, Jing-Wen; Li, Shang-Ju; Yan, Peng-Fei; Yao, Xu; Li, Guang-Ming
In situ recrystallization of lanthanide coordination polymers: from 1D ladder chains to 1D linear chains
CrystEngComm, 2016, 18, 3079
7224656 CIFC44 H36 Ce N O20P 21 21 220.195; 16.765; 16.778
90; 90; 90
5680.5Sun, Jing-Wen; Li, Shang-Ju; Yan, Peng-Fei; Yao, Xu; Li, Guang-Ming
In situ recrystallization of lanthanide coordination polymers: from 1D ladder chains to 1D linear chains
CrystEngComm, 2016, 18, 3079
7224657 CIFC44 H36 N Nd O20P 21 21 220.169; 16.722; 16.759
90; 90; 90
5652.2Sun, Jing-Wen; Li, Shang-Ju; Yan, Peng-Fei; Yao, Xu; Li, Guang-Ming
In situ recrystallization of lanthanide coordination polymers: from 1D ladder chains to 1D linear chains
CrystEngComm, 2016, 18, 3079
7225292 CIFC35 H50 O7P 21 21 214.955; 32.318; 6.8184
90; 90; 90
3295.4Zhou, Li na; Yin, Qiuxiang; Du, Shichao; Hao, Hongxun; Li, Yanfeng; Mingyan, Liu; Hou, Baohong
Crystal structure, thermal crystal form transformation, desolvation process and desolvation kinetics of two novel solvates of ciclesonide
RSC Adv., 2016
7225902 CIFC17 H16 N2 O3 SP 21 21 211.9242; 26.5717; 5.0373
90; 90; 90
1596.05Mary Sheeba, Mani; Muthu Tamizh, M.; Babu, S. Ganesh; Bhuvanesh, Nattamai; Karvembu, R.
Ru(II)-p-cymene complexes containing ester of chiral D/L-phenylalanine derived aroylthiourea ligands for enantioselective reduction of pro-chiral ketones
RSC Adv., 2016
7226223 CIFC19 H26 O4P 21 21 220.3794; 9.1072; 9.1422
90; 90; 90
1696.79Li, Xin; Li, Xiao-Ming; Li, Xiao-Dong; Xu, Gang-Ming; Liu, Yang; Wang, Bin-Gui
20-Nor-isopimarane cycloethers from the deep-sea sediment-derived fungus Aspergillus wentii SD-310
RSC Adv., 2016, 6, 75981
7226516 CIFC27 H18 N2 O7 ZnP 21 21 215.7341; 19.19; 8.3925
90; 90; 90
2534Liu, Bo; Zhou, Hui-Fang; Guan, Zheng-Hui; Hou, Lei; Cui, Bin; Wang, Yao-Yu
Cleavage of a C‒C σ bond between two phenyl groups under mild conditions during the construction of Zn(ii) organic frameworks
Green Chem., 2016, 18, 5418
7226540 CIFC30 H20 Cu2 N4P 21 21 218.0922; 28.182; 16.7188
90; 90; 90
8524.5Grzywa, Maciej; Denysenko, Dmytro; Schaller, Andreas; Kalytta-Mewes, Andreas; Volkmer, Dirk
Flexible chiral pyrazolate-based metal‒organic framework containing saddle-type CuI4(pyrazolate)4units
CrystEngComm, 2016, 18, 7883
7226817 CIFC20 H38 Cu2 N4 O17P 21 21 211.2493; 16.5313; 8.4611
90; 90; 90
1573.5Zhang, Zhi-Hui; Yang, Xu-Sheng; Zhang, Qing-Qing; Wang, Liang; He, Ming-Yang; Chen, Qun; huang, Xian-Feng
Structure-Induced Catalysis Enhancement of Cu-Amino Catalysts for Rapidly Selective Oxidation of Sulfides in the Presence of H2O2
RSC Adv., 2016
7227178 CIFC15 H23 O3.5P 21 21 216.315; 17.05; 5.2386
90; 90; 90
1457.2Lin, Jie; Wang, Renlei; Xu, Guohua; Ding, Zhengfeng; Zhu, Xueshen; Liu, Xingzhong; Zou, Jian; Chen, Guodong; Li, Li; Liu, Ling
New cadinane sesquiterpenoids from the basidiomycetous fungus Pholiota sp.
RSC Adv., 2016
7227940 CIFC19 H13 Br2 Cl N2 O4P 21 21 220.5261; 9.0318; 10.5375
90; 90; 90
1953.52Novais, Juliana S.; Campos, Vinicius R.; Silva, Ana Carolina J. A.; de Souza, Maria C. B. V.; Ferreira, Vitor F.; Keller, Vitor G. L.; Ferreira, Matheus O.; Dias, Flaviana R. F.; Vitorino, Maíra I.; Sathler, Plínio C.; Santana, Marcos V.; Resende, Jackson A. L. C.; Castro, Helena C.; Cunha, Anna C.
Synthesis and antimicrobial evaluation of promising 7-arylamino-5,8-dioxo-5,8-dihydroisoquinoline-4-carboxylates and their halogenated amino compounds for treating Gram-negative bacterial infections
RSC Adv., 2017, 7, 18311
7228168 CIFC34 H32 Co N2 O2P 21 21 215.1696; 16.2061; 5.6087
90; 90; 90
1378.8Powers, Xian B.; Ghiassi, Kamran B.; Greenfield, Joshua T.; Olmstead, Marilyn M.; Balch, Alan L.
Interrelationships between the tetrahedral and planar polymorphs of bis(3-ethylamino-1-phenyl-but-2-en-1-ono)nickel(ii) and structural comparisons with related CoII, NiII, CuII, and ZnII complexes
CrystEngComm, 2017
7228177 CIFC34 H32 N2 O2 ZnP 21 21 215.2491; 16.231; 5.5977
90; 90; 90
1385.5Powers, Xian B.; Ghiassi, Kamran B.; Greenfield, Joshua T.; Olmstead, Marilyn M.; Balch, Alan L.
Interrelationships between the tetrahedral and planar polymorphs of bis(3-ethylamino-1-phenyl-but-2-en-1-ono)nickel(ii) and structural comparisons with related CoII, NiII, CuII, and ZnII complexes
CrystEngComm, 2017
7228214 CIFC105 H95 Mn4 N15 O39P 21 21 218.324; 23.774; 14.04
90; 90; 90
6116Boer, Stephanie A.; Turner, David R.
A robust metallomacrocyclic motif for the formation interpenetrated coordination polymers
CrystEngComm, 2017, 19, 2402
7228216 CIFC60.3 H42.3 N8 O17 Zn2P 21 21 217.345; 22.362; 13.817
90; 90; 90
5359Boer, Stephanie A.; Turner, David R.
A robust metallomacrocyclic motif for the formation interpenetrated coordination polymers
CrystEngComm, 2017, 19, 2402
7228217 CIFC102 H88 Cd4 N14 O38P 21 21 218.674; 23.894; 14.086
90; 90; 90
6285Boer, Stephanie A.; Turner, David R.
A robust metallomacrocyclic motif for the formation interpenetrated coordination polymers
CrystEngComm, 2017, 19, 2402
7228232 CIFC27 H18 Ag B Cl2 F4 N2P 21 21 216.4929; 12.677; 11.4596
90; 90; 90
2396Fukushima, Misaki; Kikkawa, Shoko; hikawa, hidemasa; Azumaya, Isao
Synthesis and Solvent Vapor Induced Transformations of Crystals of 1D Coordination Polymer Assembled with Continuous Void Space
CrystEngComm, 2017

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