Crystallography Open Database

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7054657 CIFC23 H22 N4 O4P 1 21/n 111.4449; 8.9002; 21.338
90; 94.855; 90
2165.7Aakeröy, Christer B.; Wijethunga, Tharanga K.; Desper, John
Molecular electrostatic potential dependent selectivity of hydrogen bonding
New J. Chem., 2015, 39, 822
7054658 CIFC26 H20 Cl F N4 O2P b c a7.8846; 27.1172; 20.7714
90; 90; 90
4441.1Turkoglu, Gulsen; Berber, Halil; Kani, Ibrahim
Synthesis, crystal structure, optical and electrochemical properties of novel diphenylether-based formazan derivatives
New J. Chem., 2015, 39, 2728
7054659 CIFC15 H19 N O3P 1 21 19.7435; 6.5523; 11.959
90; 105.802; 90
734.64Rodríguez, Isabel; Calaza, M. Isabel; Jiménez, Ana I.; Cativiela, Carlos
Synthesis of enantiomerically pure δ-benzylproline derivatives
New J. Chem., 2015, 39, 3310
7054660 CIFC11 H17 N O9 ZnP b c a12.3453; 12.0038; 20.971
90; 90; 90
3107.7Karmakar, Anirban; Guedes da Silva, M. Fátima C.; Hazra, Susanta; Pombeiro, Armando J. L.
Zinc amidoisophthalate complexes and their catalytic application in the diastereoselective Henry reaction
New J. Chem., 2015, 39, 3004
7054661 CIFC11 H21 N O11 ZnP -17.0755; 11.1714; 12.1991
73.152; 82.48; 72.042
877Karmakar, Anirban; Guedes da Silva, M. Fátima C.; Hazra, Susanta; Pombeiro, Armando J. L.
Zinc amidoisophthalate complexes and their catalytic application in the diastereoselective Henry reaction
New J. Chem., 2015, 39, 3004
7054662 CIFC15 H13 N O7 ZnP 21 21 215.2989; 15.3102; 19.3432
90; 90; 90
1569.3Karmakar, Anirban; Guedes da Silva, M. Fátima C.; Hazra, Susanta; Pombeiro, Armando J. L.
Zinc amidoisophthalate complexes and their catalytic application in the diastereoselective Henry reaction
New J. Chem., 2015, 39, 3004
7054663 CIFC15 H17 N O9 ZnP -18.9796; 10.1531; 10.6054
89.721; 77.398; 71.835
894.5Karmakar, Anirban; Guedes da Silva, M. Fátima C.; Hazra, Susanta; Pombeiro, Armando J. L.
Zinc amidoisophthalate complexes and their catalytic application in the diastereoselective Henry reaction
New J. Chem., 2015, 39, 3004
7054664 CIFC11 H10 Br N3 OP 1 21/n 113.5334; 12.3004; 28.098
90; 102.177; 90
4572.1Bustos, Carlos; Molins, Elies; Cárcamo, Juan-Guillermo; Aguilar, Marcelo N.; Sánchez, Christian; Moreno-Villoslada, Ignacio; Nishide, Hiroyuki; Mesías-Salazar, Angela; Zarate, Ximena; Schott, Eduardo
New 3,4,5-trisubstituted isoxazole derivatives with potential biological properties
New J. Chem., 2015, 39, 4295
7054665 CIFC11 H10 N4 O3C 1 2/c 111.765; 11.314; 17.774
90; 95.75; 90
2354Bustos, Carlos; Molins, Elies; Cárcamo, Juan-Guillermo; Aguilar, Marcelo N.; Sánchez, Christian; Moreno-Villoslada, Ignacio; Nishide, Hiroyuki; Mesías-Salazar, Angela; Zarate, Ximena; Schott, Eduardo
New 3,4,5-trisubstituted isoxazole derivatives with potential biological properties
New J. Chem., 2015, 39, 4295
7054666 CIFC16 H16 N2 O S2P 1 21/n 15.0508; 33.692; 8.9618
90; 100.081; 90
1501.5Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Chakraborty, Nirmalya; Acharya, Krishnendu; Mandal, Sudhanshu Sekhar; Ghosh, Saktiprosad; Drew, Michael G. B.; Mondal, Tapan Kumar; Biswas, Sujan
Lewis base controlled supramolecular architectures via non-covalent interactions of dioxomolybdenum(vi) complexes with an ONS donor ligand: DFT calculations and biological study
New J. Chem., 2015, 39, 2778
7054667 CIFC20 H22 Mo N2 O4 S2P 1 21/n 114.489; 7.1442; 21.09
90; 91.518; 90
2182.3Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Chakraborty, Nirmalya; Acharya, Krishnendu; Mandal, Sudhanshu Sekhar; Ghosh, Saktiprosad; Drew, Michael G. B.; Mondal, Tapan Kumar; Biswas, Sujan
Lewis base controlled supramolecular architectures via non-covalent interactions of dioxomolybdenum(vi) complexes with an ONS donor ligand: DFT calculations and biological study
New J. Chem., 2015, 39, 2778
7054668 CIFC21 H21 Cl3 Mo N4 O3 S2P -19.7755; 10.9369; 12.4981
99.619; 96.272; 90.833
1308.81Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Chakraborty, Nirmalya; Acharya, Krishnendu; Mandal, Sudhanshu Sekhar; Ghosh, Saktiprosad; Drew, Michael G. B.; Mondal, Tapan Kumar; Biswas, Sujan
Lewis base controlled supramolecular architectures via non-covalent interactions of dioxomolybdenum(vi) complexes with an ONS donor ligand: DFT calculations and biological study
New J. Chem., 2015, 39, 2778
7054669 CIFC22 H22 Mo N4 O3 S2P 1 21/n 114.272; 11.291; 14.874
90; 102.868; 90
2336.7Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Chakraborty, Nirmalya; Acharya, Krishnendu; Mandal, Sudhanshu Sekhar; Ghosh, Saktiprosad; Drew, Michael G. B.; Mondal, Tapan Kumar; Biswas, Sujan
Lewis base controlled supramolecular architectures via non-covalent interactions of dioxomolybdenum(vi) complexes with an ONS donor ligand: DFT calculations and biological study
New J. Chem., 2015, 39, 2778
7054670 CIFC23.33 H24.96 Mo N3 O4 S2P -17.505; 13.022; 14.463
106.162; 101.97; 105.956
1242.1Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Chakraborty, Nirmalya; Acharya, Krishnendu; Mandal, Sudhanshu Sekhar; Ghosh, Saktiprosad; Drew, Michael G. B.; Mondal, Tapan Kumar; Biswas, Sujan
Lewis base controlled supramolecular architectures via non-covalent interactions of dioxomolybdenum(vi) complexes with an ONS donor ligand: DFT calculations and biological study
New J. Chem., 2015, 39, 2778
7054671 CIFC21 H19 Mo N3 O3 S2P -111.2231; 14.2627; 14.4636
103.729; 97.022; 106.223
2114.93Biswal, Debanjana; Pramanik, Nikhil Ranjan; Chakrabarti, Syamal; Chakraborty, Nirmalya; Acharya, Krishnendu; Mandal, Sudhanshu Sekhar; Ghosh, Saktiprosad; Drew, Michael G. B.; Mondal, Tapan Kumar; Biswas, Sujan
Lewis base controlled supramolecular architectures via non-covalent interactions of dioxomolybdenum(vi) complexes with an ONS donor ligand: DFT calculations and biological study
New J. Chem., 2015, 39, 2778
7054672 CIFC42 H80 N24 O28C 1 2/m 114.8304; 19.0315; 12.5878
90; 94.618; 90
3541.3Zhao, Wenxuan; Wang, Chuanzeng; Zhang, Yunqian; Xue, Saifeng; Zhu, Qianjiang; Tao, Zhu
Supramolecular assembly of a methyl-substituted cucurbit[6]uril and its potential applications in selective sorption
New J. Chem., 2015, 39, 2433
7054673 CIFC24 H18 Cu2 N10 O6 S2P b c a13.3215; 12.3215; 16.7717
90; 90; 90
2752.9Hazra, Susanta; Karmakar, Anirban; Guedes da Silva, Maria de Fátima C.; Dlháň, L'ubor; Boča, Roman; Pombeiro, Armando J. L.
Sulfonated Schiff base dinuclear and polymeric copper(ii) complexes: crystal structures, magnetic properties and catalytic application in Henry reaction
New J. Chem., 2015, 39, 3424
7054674 CIFC26 H18 Cu2 N6 O6 S4P -17.2488; 8.5638; 13.1244
83.205; 89.661; 70.551
762.35Hazra, Susanta; Karmakar, Anirban; Guedes da Silva, Maria de Fátima C.; Dlháň, L'ubor; Boča, Roman; Pombeiro, Armando J. L.
Sulfonated Schiff base dinuclear and polymeric copper(ii) complexes: crystal structures, magnetic properties and catalytic application in Henry reaction
New J. Chem., 2015, 39, 3424
7054675 CIFC14 H11 Cu N5 O4 SP 1 21/c 18.5179; 15.1779; 12.2602
90; 92.219; 90
1583.86Hazra, Susanta; Karmakar, Anirban; Guedes da Silva, Maria de Fátima C.; Dlháň, L'ubor; Boča, Roman; Pombeiro, Armando J. L.
Sulfonated Schiff base dinuclear and polymeric copper(ii) complexes: crystal structures, magnetic properties and catalytic application in Henry reaction
New J. Chem., 2015, 39, 3424
7054676 CIFC29 H28 Dy F12 N5 Ni O11P 1 21/c 117.8522; 10.6611; 19.9365
90; 106.854; 90
3631.4Lu, Xing-Yun; Liu, Yu-Qing; Deng, Xiao-Wei; Zhu, Zhao-Xia; Yao, Min-Xia; Jing, Su
Synthesis, structures and magnetism of heterodinuclear Ni‒Ln complexes: field-induced single-molecule magnet behavior in the dysprosium analogue
New J. Chem., 2015, 39, 3467
7054677 CIFC29 H28 F12 Gd N5 Ni O11P 1 21/c 118.351; 10.8682; 19.911
90; 106.184; 90
3813.7Lu, Xing-Yun; Liu, Yu-Qing; Deng, Xiao-Wei; Zhu, Zhao-Xia; Yao, Min-Xia; Jing, Su
Synthesis, structures and magnetism of heterodinuclear Ni‒Ln complexes: field-induced single-molecule magnet behavior in the dysprosium analogue
New J. Chem., 2015, 39, 3467
7054678 CIFC29 H28 F12 N5 Ni O11 TbP 1 21/c 117.8821; 10.8892; 20.0534
90; 106.038; 90
3752.9Lu, Xing-Yun; Liu, Yu-Qing; Deng, Xiao-Wei; Zhu, Zhao-Xia; Yao, Min-Xia; Jing, Su
Synthesis, structures and magnetism of heterodinuclear Ni‒Ln complexes: field-induced single-molecule magnet behavior in the dysprosium analogue
New J. Chem., 2015, 39, 3467
7054679 CIFC61 H49 F9 N9 O8 Yb ZnC 1 2/c 123.852; 13.2551; 41.053
90; 104.55; 90
12563Yu, Chao; Zhang, Zhao; Liu, Lin; Li, Hongyan; He, Yani; Lü, Xingqiang; Wong, Wai-Kwok; Jones, Richard A.
PMMA-supported hybrid materials doped with highly near-infrared (NIR) luminescent complexes [Zn(L1)(Py)Ln(L2)3] (Ln = Nd, Yb or Er)
New J. Chem., 2015, 39, 3698
7054680 CIFC17 H27 I N2 PtP 1 21/c 112.0156; 12.0304; 13.4566
90; 102.37; 90
1900Ghosh, Biswa Nath; Lentz, Dieter; Schlecht, Sabine
Substituent effects in solution speciation of the mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of pyridines
New J. Chem., 2015, 39, 3536
7054681 CIFC15 H23 I N2 PtP 1 21/n 111.1252; 12.8648; 12.2536
90; 98.742; 90
1733.4Ghosh, Biswa Nath; Lentz, Dieter; Schlecht, Sabine
Substituent effects in solution speciation of the mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of pyridines
New J. Chem., 2015, 39, 3536
7054682 CIFC15 H17 I N4 PtP -19.7124; 10.2867; 10.3892
70.911; 66.286; 73.069
882.64Ghosh, Biswa Nath; Lentz, Dieter; Schlecht, Sabine
Substituent effects in solution speciation of the mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of pyridines
New J. Chem., 2015, 39, 3536
7054683 CIFC18 H26 I2 N4 Pt2P 1 21/n 18.88211; 12.088; 22.6364
90; 99.0938; 90
2399.85Ghosh, Biswa Nath; Lentz, Dieter; Schlecht, Sabine
Substituent effects in solution speciation of the mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of pyridines
New J. Chem., 2015, 39, 3536
7054684 CIFC18 H26 I2 N4 Pt2P 1 21/c 18.0595; 11.2505; 13.6434
90; 106.09; 90
1188.63Ghosh, Biswa Nath; Lentz, Dieter; Schlecht, Sabine
Substituent effects in solution speciation of the mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of pyridines
New J. Chem., 2015, 39, 3536
7054685 CIFC18 H32 I2 N2 O2 Pt2P 1 21/n 110.407; 11.7649; 20.7823
90; 98.377; 90
2517.4Ghosh, Biswa Nath; Lentz, Dieter; Schlecht, Sabine
Substituent effects in solution speciation of the mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of pyridines
New J. Chem., 2015, 39, 3536
7054686 CIFC20 H36 I2 N2 Pt2P n a m10.7003; 12.7871; 18.4091
90; 90; 90
2518.8Ghosh, Biswa Nath; Lentz, Dieter; Schlecht, Sabine
Substituent effects in solution speciation of the mononuclear and dinuclear trimethylplatinum(iv) iodide complexes of pyridines
New J. Chem., 2015, 39, 3536
7054687 CIFC28 H52 N4 O7P 18.999; 14.013; 14.873
66.19; 75.21; 73.6
1624.6M. B. Reddy, Madhusudana; Basuroy, K.; Chandrappa, S.; Dinesh, B.; Vasantha, B.; A. Venkatesha, Manjunath; Balaram, P.
Structural characterization of folded and extended conformations in peptides containing γ amino acids with proteinogenic side chains: crystal structures of γn, (αγ)nand γγδγ sequences
New J. Chem., 2015, 39, 3319
7054688 CIFC34 H64 N4 O9P 1 21 110.6075; 10.735; 19.1418
90; 105.348; 90
2101.97M. B. Reddy, Madhusudana; Basuroy, K.; Chandrappa, S.; Dinesh, B.; Vasantha, B.; A. Venkatesha, Manjunath; Balaram, P.
Structural characterization of folded and extended conformations in peptides containing γ amino acids with proteinogenic side chains: crystal structures of γn, (αγ)nand γγδγ sequences
New J. Chem., 2015, 39, 3319
7054689 CIFC49 H88 N8 O12P 1 21 19.5742; 10.8563; 28.0245
90; 93.811; 90
2906.44M. B. Reddy, Madhusudana; Basuroy, K.; Chandrappa, S.; Dinesh, B.; Vasantha, B.; A. Venkatesha, Manjunath; Balaram, P.
Structural characterization of folded and extended conformations in peptides containing γ amino acids with proteinogenic side chains: crystal structures of γn, (αγ)nand γγδγ sequences
New J. Chem., 2015, 39, 3319
7054690 CIFC39 H74 N4 O7P 15.0768; 8.924; 25.12
98.67; 94.399; 99.374
1104M. B. Reddy, Madhusudana; Basuroy, K.; Chandrappa, S.; Dinesh, B.; Vasantha, B.; A. Venkatesha, Manjunath; Balaram, P.
Structural characterization of folded and extended conformations in peptides containing γ amino acids with proteinogenic side chains: crystal structures of γn, (αγ)nand γγδγ sequences
New J. Chem., 2015, 39, 3319
7054691 CIFC27 H52 N4 O5P 1 21 15.0056; 15.829; 20.317
90; 93.452; 90
1606.9M. B. Reddy, Madhusudana; Basuroy, K.; Chandrappa, S.; Dinesh, B.; Vasantha, B.; A. Venkatesha, Manjunath; Balaram, P.
Structural characterization of folded and extended conformations in peptides containing γ amino acids with proteinogenic side chains: crystal structures of γn, (αγ)nand γγδγ sequences
New J. Chem., 2015, 39, 3319
7054692 CIFC20 H38 N2 O5P 1 21 15.1643; 30.0027; 7.5724
90; 94.261; 90
1170.05M. B. Reddy, Madhusudana; Basuroy, K.; Chandrappa, S.; Dinesh, B.; Vasantha, B.; A. Venkatesha, Manjunath; Balaram, P.
Structural characterization of folded and extended conformations in peptides containing γ amino acids with proteinogenic side chains: crystal structures of γn, (αγ)nand γγδγ sequences
New J. Chem., 2015, 39, 3319
7054693 CIFC34 H64 N4 O7P 1 21 15.1182; 50.153; 7.4046
90; 97.675; 90
1883.68M. B. Reddy, Madhusudana; Basuroy, K.; Chandrappa, S.; Dinesh, B.; Vasantha, B.; A. Venkatesha, Manjunath; Balaram, P.
Structural characterization of folded and extended conformations in peptides containing γ amino acids with proteinogenic side chains: crystal structures of γn, (αγ)nand γγδγ sequences
New J. Chem., 2015, 39, 3319
7054694 CIFC20 H38 N2 O5C 1 2 128.9383; 5.1419; 18.4128
90; 120.323; 90
2364.96M. B. Reddy, Madhusudana; Basuroy, K.; Chandrappa, S.; Dinesh, B.; Vasantha, B.; A. Venkatesha, Manjunath; Balaram, P.
Structural characterization of folded and extended conformations in peptides containing γ amino acids with proteinogenic side chains: crystal structures of γn, (αγ)nand γγδγ sequences
New J. Chem., 2015, 39, 3319
7054695 CIFC33 H63 N5 O8P 19.901; 10.527; 10.553
100.403; 106.665; 93.047
1029.9M. B. Reddy, Madhusudana; Basuroy, K.; Chandrappa, S.; Dinesh, B.; Vasantha, B.; A. Venkatesha, Manjunath; Balaram, P.
Structural characterization of folded and extended conformations in peptides containing γ amino acids with proteinogenic side chains: crystal structures of γn, (αγ)nand γγδγ sequences
New J. Chem., 2015, 39, 3319
7054696 CIFC16 H32 Cd N8 O4 PdC 1 2/c 118.57; 10.3191; 17.2851
90; 133.39; 90
2407Şenocak, Ayşegül; Karadağ, Ahmet; Soylu, Mustafa Serkan; Andaç, Ömer
Two novel cyanido-bridged polymeric complexes with suspension bridge type connections and a series of related complex salts: crystallographic and thermal characterizations
New J. Chem., 2015, 39, 3675
7054697 CIFC10 H16 N6 Ni O2 ZnP b c n11.463; 8.9492; 14.7436
90; 90; 90
1512.5Şenocak, Ayşegül; Karadağ, Ahmet; Soylu, Mustafa Serkan; Andaç, Ömer
Two novel cyanido-bridged polymeric complexes with suspension bridge type connections and a series of related complex salts: crystallographic and thermal characterizations
New J. Chem., 2015, 39, 3675
7054698 CIFC10 H16 Cd N6 Ni O2C 1 2/c 110.8081; 10.4606; 14.2364
90; 107.209; 90
1537.5Şenocak, Ayşegül; Karadağ, Ahmet; Soylu, Mustafa Serkan; Andaç, Ömer
Two novel cyanido-bridged polymeric complexes with suspension bridge type connections and a series of related complex salts: crystallographic and thermal characterizations
New J. Chem., 2015, 39, 3675
7054699 CIFC16 H36 Cd N8 Ni O6P 21 21 219.6656; 14.9615; 17.9211
90; 90; 90
2591.6Şenocak, Ayşegül; Karadağ, Ahmet; Soylu, Mustafa Serkan; Andaç, Ömer
Two novel cyanido-bridged polymeric complexes with suspension bridge type connections and a series of related complex salts: crystallographic and thermal characterizations
New J. Chem., 2015, 39, 3675
7054700 CIFC32 H32 Be2 N4 O6P -18.5367; 8.8067; 10.1596
106.505; 92.538; 97.889
722.6Reglinski, John; Kennedy, Alan R.; Steel, Graham
Tetradentate Schiff base beryllium complexes
New J. Chem., 2015, 39, 2437
7054701 CIFC18 H18 Be N2 O2C 1 c 17.6771; 17.9229; 11.3182
90; 98.385; 90
1540.7Reglinski, John; Kennedy, Alan R.; Steel, Graham
Tetradentate Schiff base beryllium complexes
New J. Chem., 2015, 39, 2437
7054702 CIFC18 H16 N2 O2 SP b n a7.4296; 19.375; 22.676
90; 90; 90
3264.2Salahifar, Eslam; Nematollahi, Davood
Electrochemical generation of a Michael acceptor: a green method for the synthesis of 4-amino-3-(phenylsulfonyl)diphenylamine derivatives
New J. Chem., 2015, 39, 3852
7054703 CIFC19 H21 N3 OP 1 21/n 110.1735; 14.3043; 11.2897
90; 96.376; 90
1632.8Singh, Nongthombam Geetmani; Nagarajaprakash, Rammamorthy; Rani, Jims World Star; Kathing, Chingrishon; Nongrum, Ridaphun; Nongkhlaw, Rishanlang
Nickel nanoparticles assisted regioselective synthesis of pyrazoloquinolinone and triazoloquinazolinone derivatives
New J. Chem., 2015, 39, 3908
7054704 CIFC17 H17 Cl N4 OP -16.0023; 12.317; 12.46
67.981; 77.245; 80.977
830.1Singh, Nongthombam Geetmani; Nagarajaprakash, Rammamorthy; Rani, Jims World Star; Kathing, Chingrishon; Nongrum, Ridaphun; Nongkhlaw, Rishanlang
Nickel nanoparticles assisted regioselective synthesis of pyrazoloquinolinone and triazoloquinazolinone derivatives
New J. Chem., 2015, 39, 3908
7054705 CIFC5 H9 Cd N5 O3C 1 2/c 118.628; 7.56; 14.269
90; 119.874; 90
1742.5Salinas-Castillo, Alfonso; Calahorro, Antonio Jesús; Briones Gil, David; Fairen-Jimenez, David; gandara, felipe; Mendicute-Fierro, Claudio; Seco, José M; Perez-Mendoza, Manuel; Fernández, Belén; Rodriguez-Dieguez, Antonio
Adsorption and Luminescence Properties of First 2D-Cadmium MOF and Gismondine-Like Zinc Coordination Network Based on N-(2-tetrazolethyl)-4'-Glycine Linker
New J. Chem., 2015, 39, 3982-3986
7054706 CIFC5 H7 N5 O2 ZnI 41/a :221.71; 21.71; 6.8793
90; 90; 90
3242.4Salinas-Castillo, Alfonso; Calahorro, Antonio Jesús; Briones Gil, David; Fairen-Jimenez, David; gandara, felipe; Mendicute-Fierro, Claudio; Seco, José M; Perez-Mendoza, Manuel; Fernández, Belén; Rodriguez-Dieguez, Antonio
Adsorption and Luminescence Properties of First 2D-Cadmium MOF and Gismondine-Like Zinc Coordination Network Based on N-(2-tetrazolethyl)-4'-Glycine Linker
New J. Chem., 2015, 39, 3982-3986

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