Crystallography Open Database
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Searching space group like 'P 63'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7111342 | CIF | C49 H59 Cl2 N9 O3 | P 63 | 13.5462; 13.5462; 14.8813 90; 90; 120 | 2364.87 | Haberhauer, Gebhard; Oeser, Thomas; Rominger, Frank A C3-symmetric molecular scaffold for the construction of large receptors Chemical Communications, 2004, 2044-2045 |
| 7112029 | CIF | C33 H48 Fe N5 O6 S3 | P 63 | 13.6656; 13.6656; 12.2841 90; 90; 120 | 1986.7 | Nathaniel S. Sickerman; Sonja M. Peterson; Joseph W. Ziller; A. S. Borovik Synthesis, structure and reactivity of FeII/III-NH3 complexes bearing a tripodal sulfonamido ligand Chem.Commun., 2014, 50, 2515 |
| 7112030 | CIF | C33 H48 Ga N5 O6 S3 | P 63 | 13.645; 13.645; 12.2882 90; 90; 120 | 1981.4 | Nathaniel S. Sickerman; Sonja M. Peterson; Joseph W. Ziller; A. S. Borovik Synthesis, structure and reactivity of FeII/III-NH3 complexes bearing a tripodal sulfonamido ligand Chem.Commun., 2014, 50, 2515 |
| 7112844 | CIF | C92 H118 Ag3 B3 Cl4 F12 N12 O3 | P 63 | 14.5393; 14.5393; 27.7615 90; 90; 120 | 5082.3 | Wang, Dehui; Zhang, Bingguang; He, Cheng; Wu, Pengyan; Duan, Chunying A new chiral N-heterocyclic carbene silver(I) cylinder: synthesis, crystal structure and catalytic properties. Chemical communications (Cambridge, England), 2010, 46, 4728-4730 |
| 7112845 | CIF | C47 H62 B3 F12 N7 O | P 63 | 17.0096; 17.0096; 11.8953 90; 90; 120 | 2980.5 | Wang, Dehui; Zhang, Bingguang; He, Cheng; Wu, Pengyan; Duan, Chunying A new chiral N-heterocyclic carbene silver(I) cylinder: synthesis, crystal structure and catalytic properties. Chemical communications (Cambridge, England), 2010, 46, 4728-4730 |
| 7114534 | CIF | C24 H15 Cl9 N6 O9 | P 63 | 14.6173; 14.6173; 8.3838 90; 90; 120 | 1551.3 | Jetti, Ram K. R.; Thallapally, Praveen K.; Nangia, Ashwini; Lam, Chi-Keung; Mak, Thomas C. W. 2,4,6-Tris(4-nitrophenoxy)-1,3,5-triazine: a hexagonal host framework stabilised by the NO2-trimer supramolecular synthon Chemical Communications, 2002, 952 |
| 7114838 | CIF | C27 H15 Cl3 I3 N3 O3 | P 63 | 15.4817; 15.4817; 7.0107 90; 90; 120 | 1455.22 | Jetti, Ram K. R.; Nangia, Ashwini; Xue, Feng; Mak, Thomas C. W. Polar host‒guest assembly mediated by halogen‥π interaction: inclusion complexes of 2,4,6-tris(4-halophenoxy)-1,3,5-triazine (halo = chloro, bromo) with trihalobenzene (halo = bromo, iodo) Chemical Communications, 2001, 919 |
| 7114839 | CIF | C27 H15 Br6 N3 O3 | P 63 | 15.442; 15.442; 6.9909 90; 90; 120 | 1443.7 | Jetti, Ram K. R.; Nangia, Ashwini; Xue, Feng; Mak, Thomas C. W. Polar host‒guest assembly mediated by halogen‥π interaction: inclusion complexes of 2,4,6-tris(4-halophenoxy)-1,3,5-triazine (halo = chloro, bromo) with trihalobenzene (halo = bromo, iodo) Chemical Communications, 2001, 919 |
| 7114840 | CIF | C27 H15 Br3 I3 N3 O3 | P 63 | 15.6268; 15.6268; 7.0464 90; 90; 120 | 1490.2 | Jetti, Ram K. R.; Nangia, Ashwini; Xue, Feng; Mak, Thomas C. W. Polar host‒guest assembly mediated by halogen‥π interaction: inclusion complexes of 2,4,6-tris(4-halophenoxy)-1,3,5-triazine (halo = chloro, bromo) with trihalobenzene (halo = bromo, iodo) Chemical Communications, 2001, 919 |
| 7115027 | CIF | C21 H27 K Mn O1.5 | P 63 | 9.086; 9.086; 19.164 90; 90; 120 | 1370.1 | Bond, Andrew D.; Layfield, Richard A.; MacAllister, Judith A.; Rawson, Jeremy M.; Wright, Dominic S.; McPartlin, Mary The first observation of the [Cp3Mn]‒ anion; structures of hexagonal [(η2-Cp)3MnK·1.5thf] and ion-separated [(η2-Cp)3Mn]2[Mg(thf)6]·2thf Chemical Communications, 2001, 1956 |
| 7116732 | CIF | C36 H24 Co3 N13 Na O15.25 | P 63 | 13.1191; 13.1191; 16.014 90; 90; 120 | 2386.92 | Ru-Xin Yao; Xin Cui; Jun Wang; Xian-Ming Zhang A homochiral magnet based on D3 symmetric [(NaO3)Co3] clusters: from spontaneous resolution to absolute chiral induction Chem.Commun., 2015, 51, 5108 |
| 7116733 | CIF | C36 H27 Co3 N13 Na O15 | P 63 | 13.1177; 13.1177; 16.005 90; 90; 120 | 2385.07 | Ru-Xin Yao; Xin Cui; Jun Wang; Xian-Ming Zhang A homochiral magnet based on D3 symmetric [(NaO3)Co3] clusters: from spontaneous resolution to absolute chiral induction Chem.Commun., 2015, 51, 5108 |
| 7117871 | CIF | C9 H16 Co N O5 P | P 63 | 18.3143; 18.3143; 6.1688 90; 90; 120 | 1791.9 | Liu, Xun-Gao; Bao, Song-Song; Huang, Jian; Otsubo, Kazuya; Feng, Jian-Shen; Ren, Min; Hu, Feng-Chun; Sun, Zhihu; Zheng, Li-Min; Wei, Shiqiang; Kitagawa, Hiroshi Homochiral metal phosphonate nanotubes. Chemical communications (Cambridge, England), 2015, 51, 15141-15144 |
| 7117872 | CIF | C9 H16 Co N O5 P | P 63 | 18.288; 18.288; 6.168 90; 90; 120 | 1786.5 | Liu, Xun-Gao; Bao, Song-Song; Huang, Jian; Otsubo, Kazuya; Feng, Jian-Shen; Ren, Min; Hu, Feng-Chun; Sun, Zhihu; Zheng, Li-Min; Wei, Shiqiang; Kitagawa, Hiroshi Homochiral metal phosphonate nanotubes. Chemical communications (Cambridge, England), 2015, 51, 15141-15144 |
| 7117873 | CIF | C9 H16 N Ni O5 P | P 63 | 18.0812; 18.0812; 6.1296 90; 90; 120 | 1735.5 | Liu, Xun-Gao; Bao, Song-Song; Huang, Jian; Otsubo, Kazuya; Feng, Jian-Shen; Ren, Min; Hu, Feng-Chun; Sun, Zhihu; Zheng, Li-Min; Wei, Shiqiang; Kitagawa, Hiroshi Homochiral metal phosphonate nanotubes. Chemical communications (Cambridge, England), 2015, 51, 15141-15144 |
| 7117874 | CIF | C9 H16 N Ni O5 P | P 63 | 18.1621; 18.1621; 6.168 90; 90; 120 | 1762 | Liu, Xun-Gao; Bao, Song-Song; Huang, Jian; Otsubo, Kazuya; Feng, Jian-Shen; Ren, Min; Hu, Feng-Chun; Sun, Zhihu; Zheng, Li-Min; Wei, Shiqiang; Kitagawa, Hiroshi Homochiral metal phosphonate nanotubes. Chemical communications (Cambridge, England), 2015, 51, 15141-15144 |
| 7118505 | CIF | C1.33 H9.77 Al B5 N1.33 O10.88 | P 63 | 21.4013; 21.4013; 7.1696 90; 90; 120 | 2843.8 | Cao, Gao-Juan; Wei, Qi; Cheng, Jian-Wen; Cheng, Lin; Yang, Guo-Yu A zeolite CAN-type aluminoborate with gigantic 24-ring channels. Chemical communications (Cambridge, England), 2016, 52, 1729-1732 |
| 7118830 | CIF | C192 H240 B6.25 F25 Fe4 N38 | P 63 | 40.6845; 40.6845; 34.133 90; 90; 120 | 48929 | Zhang, Feng-Li; Chen, Jia-Qian; Qin, Long-Fang; Tian, Lei; Li, Zaijun; Ren, Xuehong; Gu, Zhi-Guo Metal-center exchange of tetrahedral cages: single crystal to single crystal and spin-crossover properties. Chemical communications (Cambridge, England), 2016, 52, 4796-4799 |
| 7119024 | CIF | C61.4 H43.6 Cl4 N2 O6.2 | P 63 | 29.44; 29.44; 11.679 90; 90; 120 | 8766 | Midori Nagamoto; Daisuke Yamauchi; Takahiro Nishimura Iridium-catalyzed asymmetric [3+2] annulation of aromatic ketimines with alkynes via C-H activation: unexpected inversion of the enantioselectivity induced by protic acids Chem.Commun., 2016, 52, 5876 |
| 7122954 | CIF | C9 H16 Fe N O5 P | P 63 | 18.3354; 18.3354; 6.1492 90; 90; 120 | 1790.32 | Jia, Jia-Ge; Feng, Jian-Shen; Huang, Xin-Da; Bao, Song-Song; Zheng, Li-Min Homochiral Iron(II)-based metal-organic nanotubes: metamagnetism and selective nitric oxide adsorption in confined channel Chemical Communications, 2019 |
| 7122955 | CIF | C9 H16 Fe N O5 P | P 63 | 18.4179; 18.4179; 6.1607 90; 90; 120 | 1809.84 | Jia, Jia-Ge; Feng, Jian-Shen; Huang, Xin-Da; Bao, Song-Song; Zheng, Li-Min Homochiral Iron(II)-based metal-organic nanotubes: metamagnetism and selective nitric oxide adsorption in confined channel Chemical Communications, 2019 |
| 7123192 | CIF | C3 H15 Cl O25 Y8 | P 63 | 9.5089; 9.5089; 14.673 90; 90; 120 | 1148.97 | Zhang, Yiting; Long, Ying; Dong, Xuehua; Wang, Lei; Huang, Ling; Zeng, Hongmei; Lin, Zhien; Wang, Xin; Zou, Guohong Y8O(OH)15(CO3)3Cl: An Excellent Short-Wave UV Nonlinear Optical Material Exhibiting Infrequent Three-Dimensional Inorganic Cationic Framework Chemical Communications, 2019 |
| 7123736 | CIF | C51 H54 N6 O9 | P 63 | 19.4557; 19.4557; 7.0842 90; 90; 120 | 2322.28 | Basuyaux, Gaëtan; Desmarchelier, Alaric; Gontard, Geoffrey; Vanthuyne, Nicolas; Moussa, Jamal; Amouri, Hani Haniel; Raynal, Matthieu; Bouteiller, Laurent Extra hydrogen bonding interactions by peripheral indole groups stabilize benzene-1,3,5-tricarboxamide helical assemblies Chemical Communications, 2019 |
| 7124713 | CIF | C36 H41 N3 O10 S3 | P 63 | 14.5223; 14.5223; 10.2703 90; 90; 120 | 1875.8 | Fowler, Jonathan M.; Thorp-Greenwood, Flora L; Warriner, Stuart L.; Willans, Charlotte E.; Hardie, Michaele J. M12L8 metallo-supramolecular cube with cyclotriguaiacylene-type ligand: spontaneous resolution of cube and its constituent host ligand. Chemical communications (Cambridge, England), 2016, 52, 8699-8702 |
| 7127011 | CIF | C55 H92 Li N4 O4 P3 Sn | P 63 | 13.6945; 13.6945; 18.3276 90; 90; 120 | 2976.7 | Dorantes, Michael J.; Moore, James T.; Bill, Eckhard; Mienert, Bernd; Lu, Connie C. Bimetallic iron-tin catalyst for N<sub>2</sub> to NH<sub>3</sub> and a silyldiazenido model intermediate. Chemical communications (Cambridge, England), 2020, 56, 11030-11033 |
| 7128362 | CIF | C42.75 H51 N6 O0.75 | P 63 | 20.45; 20.45; 5.9423 90; 90; 120 | 2152.1 | He, Donglin; Clowes, Rob; Little, Marc A.; Liu, Ming; Cooper, Andrew I. Creating porosity in a trianglimine macrocycle by heterochiral pairing. Chemical communications (Cambridge, England), 2021, 57, 6141-6144 |
| 7129930 | CIF | C41 H77 Ca Cu6 N6 O33 S6 V | P 63 | 17.8884; 17.8884; 12.8853 90; 90; 120 | 3570.8 | Negro, Cristina; Bilanin Artigado, Cristina; Qu, Xiaoni; Oliver-Meseguer, Judit; Ferrando-Soria, Jesús; Leyva-Perez, Antonio; Armentano, Donatella; Pardo, Emilio Epoxidation vs. dehydrogenation of allylic alcohols: Heterogenization of the VO(acac)2 catalyst in a metal-organic framework Chemical Communications, 2022 |
| 7131143 | CIF | C18 H27 B2 Co F8 N12 P S | P 63 | 9.9868; 9.9868; 16.0438 90; 90; 120 | 1385.77 | Landart-Gereka, Aritz; Quesada-Moreno, María Mar; Palacios, María A; Díaz-Ortega, Ismael F; Nojiri, Hiroyuki; Ozerov, Mykhaylo; Krzystek, J.; Colacio, Enrique Pushing up the easy-axis magnetic anisotropy and relaxation times in trigonal prismatic Co<sup>II</sup> mononuclear SMMs by molecular structure design. Chemical communications (Cambridge, England), 2023, 59, 952-955 |
| 7131144 | CIF | C18 H27 Cl2 Co N12 O8 P S | P 63 | 10.1198; 10.1198; 16.131 90; 90; 120 | 1430.7 | Landart-Gereka, Aritz; Quesada-Moreno, María Mar; Palacios, María A; Díaz-Ortega, Ismael F; Nojiri, Hiroyuki; Ozerov, Mykhaylo; Krzystek, J.; Colacio, Enrique Pushing up the easy-axis magnetic anisotropy and relaxation times in trigonal prismatic Co<sup>II</sup> mononuclear SMMs by molecular structure design. Chemical communications (Cambridge, England), 2023, 59, 952-955 |
| 7131318 | CIF | Cl2 Ge3 Li0 S9 Sr4 | P 63 | 9.5194; 9.5194; 11.726 90; 90; 120 | 920.24 | Song, Yufei; Qian, Zhen; Zhou, Boru; Yu, Hongwei; Hu, Zhanggui; Wang, Jiyang; Wu, Yicheng; Wu, Hongping A non-centrosymmetric chalcohalide synthesized through the combination of chemical tailoring with aliovalent substitution. Chemical communications (Cambridge, England), 2023, 59, 3309-3312 |
| 7132462 | CIF | C9 H15 F3 O3 | P 63 | 11.4469; 11.4469; 4.7028 90; 90; 120 | 533.66 | Haridas, Shyamkumar V.; von Delius, Max Synthesis and supramolecular properties of all-<i>cis</i>-2,4,6-trifluorocyclohexane-1,3,5-triol. Chemical communications (Cambridge, England), 2024, 60, 606-609 |
| 7150409 | CIF | C47 H42 F18 N7 P3 | P 63 | 11.9328; 11.9328; 20.0477 90; 90; 120 | 2472.18 | Belcher, Warwick J.; Fabre, Muriel; Farhan, Tamer; Steed, Jonathan W. Pyridinium CH...anion and pi-stacking interactions in modular tripodal anion binding hosts: ATP binding and solid-state chiral induction. Organic & biomolecular chemistry, 2006, 4, 781-786 |
| 7150820 | CIF | C11 H16 O4 | P 63 | 14.3428; 14.3428; 8.9246 90; 90; 120 | 1589.96 | Burton, Jonathan W.; Anderson, Edward A.; O'Sullivan, Paul T.; Collins, Ian; Davies, John E.; Bond, Andrew D.; Feeder, Neil; Holmes, Andrew B. The Claisen rearrangement approach to fused bicyclic medium-ring oxacycles Organic & Biomolecular Chemistry, 2008, 6, 693-702 |
| 7150878 | CIF | C18 H28 N2 O3 | P 63 | 21.127; 21.127; 7.5223 90; 90; 120 | 2907.7 | Matsuhira, Takashi; Yamamoto, Hitoshi; Okamura, Taka-aki; Ueyama, Norikazu Manipulation of an intramolecular NH⋯O hydrogen bond by photoswitching between stable E/Z isomers of the cinnamate framework Organic & Biomolecular Chemistry, 2008, 6, 1926-1933 |
| 7200897 | CIF | Bi2.5 F0.1 H0.9 Na2.5 O12.9 P3 | P 63 | 9.5049; 9.5049; 6.9484 90; 90; 120 | 543.64 | Zhou, Yan; Huang, Ya-Xi; Pan, Yuanming; Mi, Jin-Xiao Single-crystal microtubes of a novel apatite-type compound, (Na2.5Bi2.5)(PO4)3(F,OH), with well-faceted hexagonal cross sections CrystEngComm, 2009, 11, 1863 |
| 7201779 | CIF | C26 H41 Cr Mn N3 O14 | P 63 | 9.41; 9.41; 17.809 90; 90; 120 | 1365.7 | Coronado, Eugenio; Giménez-Saiz, Carlos; Gómez-García, Carlos J.; Romero, Francisco M.; Tarazón, Ana Layered ferromagnets hosting tetraalkylammonium-substituted nitronyl nitroxide free radicals Journal of Materials Chemistry, 2008, 18, 929 |
| 7202508 | CIF | I3 In O9 | P 63 | 9.541; 9.541; 5.266 90; 90; 120 | 415.14 | Phanon, Delphine; Mosset, Alain; Gautier-Luneau, Isabelle New materials for infrared non-linear optics. Syntheses, structural characterisations, second harmonic generation and optical transparency of M(IO3)3 metallic iodates Journal of Materials Chemistry, 2007, 17, 1123 |
| 7202572 | CIF | La8.898 O25.96 Si6 | P 63 | 9.725; 9.725; 7.189 90; 90; 120 | 588.814 | Beaudet-Savignat, S.; Vincent, A.; Lambert, S.; Gervais, F. Oxide ion conduction in Ba, Ca and Sr doped apatite-type lanthanum silicates Journal of Materials Chemistry, 2007, 17, 2078 |
| 7202573 | CIF | Ba1.076 La8.924 O25.869 Si6 | P 63 | 9.74; 9.74; 7.267 90; 90; 120 | 597.04 | Beaudet-Savignat, S.; Vincent, A.; Lambert, S.; Gervais, F. Oxide ion conduction in Ba, Ca and Sr doped apatite-type lanthanum silicates Journal of Materials Chemistry, 2007, 17, 2078 |
| 7202574 | CIF | La8.898 O25.886 Si6 Sr | P 63 | 9.705; 9.705; 7.215 90; 90; 120 | 588.516 | Beaudet-Savignat, S.; Vincent, A.; Lambert, S.; Gervais, F. Oxide ion conduction in Ba, Ca and Sr doped apatite-type lanthanum silicates Journal of Materials Chemistry, 2007, 17, 2078 |
| 7202575 | CIF | Ca1.258 La8.742 O25.879 Si6 | P 63 | 9.68; 9.68; 7.161 90; 90; 120 | 581.106 | Beaudet-Savignat, S.; Vincent, A.; Lambert, S.; Gervais, F. Oxide ion conduction in Ba, Ca and Sr doped apatite-type lanthanum silicates Journal of Materials Chemistry, 2007, 17, 2078 |
| 7203310 | CIF | C18 H9 Cl3 N6 O3 | P 63 | 17.249; 17.249; 12.0227 90; 90; 120 | 3097.9 | Saha, Binoy K.; Nangia, Ashwini Self-assembled organic tubular host for van der Waals guest inclusion CrystEngComm, 2006, 8, 440 |
| 7203794 | CIF | C3 H15 N6 P S | P 63 | 9.1213; 9.1213; 7.1103 90; 90; 120 | 512.31 | Chandrasekhar, Vadapalli; Azhakar, Ramachandran A tubular architecture in a phosphorus based trihydrazide, {P(S)[N(CH3)NH2]3} CrystEngComm, 2005, 7, 346 |
| 7207235 | CIF | C34 H42 B4 Cu4 F16 N12 O6 | P 63 | 14.384; 14.384; 15.215 90; 90; 120 | 2726.2 | Maekawa, Masahiko; Tominaga, Toshi; Sugimoto, Kunihisa; Okubo, Takashi; Kuroda-Sowa, Takayoshi; Munakata, Megumu; Kitagawa, Susumu Framework dimensionality of copper(i) coordination polymers of 4,4′-bipyrimidine controlled by anions and solvents CrystEngComm, 2012, 14, 1345 |
| 7216066 | CIF | C48 H44 B Cu6 F4 I5 N12 O S6 | P 63 | 13.5662; 13.5662; 20.1867 90; 90; 120 | 3217.5 | Peng, Rong; Wu, Tao; Li, Dan A chiral coordination polymer containing copper(i) iodide layer composed of intersecting [CuI]n helices CrystEngComm, 2005, 7, 595 |
| 7216096 | CIF | C30 H24 N6 O6 | P 63 | 15.393; 15.393; 6.6615 90; 90; 120 | 1366.9 | Süss, Heike I.; Neels, Antonia; Hulliger, J. 2,4,6-Tris(4-cyanophenoxy)-1,3,5-triazine (CNPOT): Trigonal synthons in crystal engineering CrystEngComm, 2005, 7, 370 |
| 7218067 | CIF | C3 H7 N O6 Zn | P 63 | 12.5946; 12.5946; 8.2087 90; 90; 120 | 1127.65 | Zhang, Zhiying; Li, Wei; Carpenter, Michael A.; Howard, Christopher J.; Cheetham, Anthony K. Elastic properties and acoustic dissipation associated with a disorder‒order ferroelectric transition in a metal‒organic framework CrystEngComm, 2015, 17, 370 |
| 7220709 | CIF | Fe0.5 Ge La3 Se7 | P 63 | 10.7186; 10.7186; 6.0797 90; 90; 120 | 604.91 | He, Jianqiao; Wang, Zhe; Zhang, Xian; Cheng, Ye; Gong, Yu; Lai, Xiaofang; Chong, Zheng; Lin, Jianhua; Huang, Fu Qiang Synthesis, Structure, Magnetic and Photoelectric Properties of Ln3M0.5M’Se7 (Ln= La, Ce, Sm; M= Fe, Mn; M’= Si, Ge) and La3MnGaSe7 RSC Adv., 2015 |
| 7220710 | CIF | Ga La3 Mn Se7 | P 63 | 10.5894; 10.5894; 6.3458 90; 90; 120 | 616.25 | He, Jianqiao; Wang, Zhe; Zhang, Xian; Cheng, Ye; Gong, Yu; Lai, Xiaofang; Chong, Zheng; Lin, Jianhua; Huang, Fu Qiang Synthesis, Structure, Magnetic and Photoelectric Properties of Ln3M0.5M’Se7 (Ln= La, Ce, Sm; M= Fe, Mn; M’= Si, Ge) and La3MnGaSe7 RSC Adv., 2015 |
| 7220711 | CIF | Ce3 Fe0.5 Se7 Si | P 63 | 10.638; 10.638; 6.0079 90; 90; 120 | 588.81 | He, Jianqiao; Wang, Zhe; Zhang, Xian; Cheng, Ye; Gong, Yu; Lai, Xiaofang; Chong, Zheng; Lin, Jianhua; Huang, Fu Qiang Synthesis, Structure, Magnetic and Photoelectric Properties of Ln3M0.5M’Se7 (Ln= La, Ce, Sm; M= Fe, Mn; M’= Si, Ge) and La3MnGaSe7 RSC Adv., 2015 |
| 7220712 | CIF | Ce3 Mn0.5 Se7 Si | P 63 | 10.6684; 10.6684; 6.0127 90; 90; 120 | 592.65 | He, Jianqiao; Wang, Zhe; Zhang, Xian; Cheng, Ye; Gong, Yu; Lai, Xiaofang; Chong, Zheng; Lin, Jianhua; Huang, Fu Qiang Synthesis, Structure, Magnetic and Photoelectric Properties of Ln3M0.5M’Se7 (Ln= La, Ce, Sm; M= Fe, Mn; M’= Si, Ge) and La3MnGaSe7 RSC Adv., 2015 |
| 7220713 | CIF | Fe0.5 Se7 Si Sm3 | P 63 | 10.4075; 10.4075; 5.9566 90; 90; 120 | 558.76 | He, Jianqiao; Wang, Zhe; Zhang, Xian; Cheng, Ye; Gong, Yu; Lai, Xiaofang; Chong, Zheng; Lin, Jianhua; Huang, Fu Qiang Synthesis, Structure, Magnetic and Photoelectric Properties of Ln3M0.5M’Se7 (Ln= La, Ce, Sm; M= Fe, Mn; M’= Si, Ge) and La3MnGaSe7 RSC Adv., 2015 |
| 7220714 | CIF | Ge Mn0.5 Se7 Sm3 | P 63 | 10.3958; 10.3958; 6.0175 90; 90; 120 | 563.2 | He, Jianqiao; Wang, Zhe; Zhang, Xian; Cheng, Ye; Gong, Yu; Lai, Xiaofang; Chong, Zheng; Lin, Jianhua; Huang, Fu Qiang Synthesis, Structure, Magnetic and Photoelectric Properties of Ln3M0.5M’Se7 (Ln= La, Ce, Sm; M= Fe, Mn; M’= Si, Ge) and La3MnGaSe7 RSC Adv., 2015 |
| 7223475 | CIF | C21 H33 B2 Cu F8 N9 | P 63 | 11.0381; 11.0381; 13.102 90; 90; 120 | 1382.47 | Gotzmann, Carla; Braun, Friederike; Bartholomä, Mark D Synthesis,64Cu-labeling and PET imaging of 1,4,7-triazacyclononane derived chelators with pendant azaheterocyclic arms RSC Adv., 2015 |
| 7224613 | CIF | C36 H176 N9 Na9 O223 Se6 Sn6 W54 | P 63 | 27.5538; 27.5538; 22.0582 90; 90; 120 | 14503.2 | Chen, Wei-Chao; Qin, Chao; Wang, Xin-Long; Wu, Cai-Xia; Li, Yang-Guang; Zang, Hong-Ying; Shao, Kui-Zhan; Su, Zhong-Min; Wang, En-Bo Trimeric hexa-dimethyltin-functionalized selenotungstate [{Sn(CH3)2(CH3COO)}3{Sn(CH3)2}3{Se2W18O62(OH)(H2O)}3]18− CrystEngComm, 2016, 18, 2820 |
| 7226302 | CIF | Ag3 F O15 Se4 Ti3 | P 63 | 12.8975; 12.8975; 5.218 90; 90; 120 | 751.7 | Qian, Cheng; Kong, Fang; Mao, Jianggao A Series of New Silver Selenites with d0-TM Cations RSC Adv., 2016 |
| 7227107 | CIF | C3 H8 Fe N2 O6 | P 63 | 7.946; 7.946; 7.618 90; 90; 120 | 416.6 | Mączka, Mirosław; Pasińska, Katarzyna; Ptak, Maciej; Paraguassu, Waldeci; da Silva, Tercio Almeida; Sieradzki, Adam; Pikul, Adam Effect of solvent, temperature and pressure on the stability of chiral and perovskite metal formate frameworks of [NH2NH3][M(HCOO)3] (M = Mn, Fe, Zn). Physical chemistry chemical physics : PCCP, 2016, 18, 31653-31663 |
| 7227108 | CIF | C3 H8 Mn N2 O6 | P 63 | 7.988; 7.988; 7.807 90; 90; 120 | 431.4 | Mączka, Mirosław; Pasińska, Katarzyna; Ptak, Maciej; Paraguassu, Waldeci; da Silva, Tercio Almeida; Sieradzki, Adam; Pikul, Adam Effect of solvent, temperature and pressure on the stability of chiral and perovskite metal formate frameworks of [NH2NH3][M(HCOO)3] (M = Mn, Fe, Zn). Physical chemistry chemical physics : PCCP, 2016, 18, 31653-31663 |
| 7227711 | CIF | C24 H20.67 Br N O4.33 | P 63 | 26.744; 26.744; 4.997 90; 90; 120 | 3095.2 | Pizzi, A.; Lascialfari, L.; Demitri, N.; Bertolani, A.; Maiolo, D.; Carretti, E.; Metrangolo, P. Halogen bonding modulates hydrogel formation from Fmoc amino acids CrystEngComm, 2017, 19, 1870 |
| 7227714 | CIF | C24 H20.67 I N O4.33 | P 63 | 26.878; 26.878; 4.999 90; 90; 120 | 3127.6 | Pizzi, A.; Lascialfari, L.; Demitri, N.; Bertolani, A.; Maiolo, D.; Carretti, E.; Metrangolo, P. Halogen bonding modulates hydrogel formation from Fmoc amino acids CrystEngComm, 2017, 19, 1870 |
| 7229595 | CIF | B3.51 Ba7 F3.47 O10.53 | P 63 | 11.18241; 11.18241; 7.2372 90; 90; 120 | 783.74 | Bekker, T. B.; Rashchenko, S. V.; Bakakin, V. V.; Seryotkin, Yu. V.; Fedorov, P. P.; Kokh, A. E.; Stonoga, S. Yu. Phase formation in the BaB2O4‒BaF2‒BaO system and new non-centrosymmetric solid-solution series Ba7(BO3)4−xF2+3x CrystEngComm, 2012, 14, 6910 |
| 7233735 | CIF | Ba4 Cl Ge3 Na S10 | P 63 | 9.7653; 9.7653; 12.0581 90; 90; 120 | 995.82 | Kai Feng; Lei Kang; Zheshuai Lin; Jiyong Yao; Yicheng Wu Noncentrosymmetric chalcohalide NaBa4Ge3S10Cl with large band gap and IR NLO response Journal of Materials Chemistry C, 2014, 2, 4590-4596 |
| 7236547 | CIF | C36 H78 Ca Cu6 N6 O34 | P 63 | 17.783; 17.783; 12.889 90; 90; 120 | 3529.9 | Grancha, Thais; Mon, Marta; Ferrando-Soria, Jesús; Gascon, Jorge; Seoane, Beatriz; Ramos-Fernandez, Enrique V.; Armentano, Donatella; Pardo, Emilio Tuning the selectivity of light hydrocarbons in natural gas in a family of isoreticular MOFs Journal of Materials Chemistry A, 2017, 5, 11032 |
| 7236548 | CIF | C42 H86 Ca Cu6 N6 O32 | P 63 | 17.603; 17.603; 13.045 90; 90; 120 | 3501 | Grancha, Thais; Mon, Marta; Ferrando-Soria, Jesús; Gascon, Jorge; Seoane, Beatriz; Ramos-Fernandez, Enrique V.; Armentano, Donatella; Pardo, Emilio Tuning the selectivity of light hydrocarbons in natural gas in a family of isoreticular MOFs Journal of Materials Chemistry A, 2017, 5, 11032 |
| 7239516 | CIF | C54 H60 N18 O42 P10 Zn9 | P 63 | 15.6464; 15.6464; 19.7878 90; 90; 120 | 4195.2 | Zhang, Jie; Yao, Zhenguo; Liao, Shijun; Dai, Jingcao; Fu, Zhiyong A hybrid metal phosphate‒phosphite material grafted with electron deficient organic components showing interesting fluorescent and photosensitive properties Journal of Materials Chemistry A, 2013, 1, 4945 |
| 7242250 | CIF | Cd0.19 Cl0.61 Ga0.5 La1.5 S2.89 | P 63 | 10.1788; 10.1788; 6.0633 90; 90; 120 | 544.04 | Lin, Feng; Luo, Mengjia; Wang, Ruiqi; Che, Xiangli; Huang, Fuqiang La6Cd0.75Ga2Q11.5Cl2.5 (Q = S and Se): two new nonlinear optical chalcohalides with a large laser-induced damage threshold CrystEngComm, 2021, 23, 2133-2137 |
| 7245901 | CIF | C27 H15 Br3 Cl3 N3 O3 | P 63 | 15.25; 15.25; 6.8149 90; 90; 120 | 1372.6 | Popa, Marcel Mirel; Shova, Sergiu; Dascalu, Mihaela; Caira, Mino R.; Dumitrascu, Florea Crystal structures of 5-bromo-1-arylpyrazoles and their halogen bonding features CrystEngComm, 2023, 25, 86-94 |
| 7247568 | CIF | C45 H63 Cu3 N6 O16 P | P 63 | 19.794; 19.794; 9.0285 90; 90; 120 | 3063.47 | Zhou, Mi; Wang, Yujiang; Yuan, Guoyuan; Ju, Zhanfeng; Yuan, Daqiang Synthesis and characterization of two metallo-hydrogen-bonded organic frameworks with diverse structures and properties CrystEngComm, 2023, 25, 6132-6136 |
| 7248827 | CIF | C21 H39 Cd2 Cl10 N3 | P 63 | 16.7102; 16.7102; 6.8101 90; 90; 120 | 1646.82 | Xu, Zhe-Kun; Zhang, Jia-Mei; Wang, Zhong-Xia Homochiral hybrid hexagonal antiperovskite crystals [R- and S-3-chloroquinuclidinium]3(CdCl3)(CdCl4) CrystEngComm, 2024, 26, 3874-3879 |
| 7248829 | CIF | C21 H39 Cd2 Cl10 N3 | P 63 | 16.8561; 16.8561; 6.8554 90; 90; 120 | 1686.9 | Xu, Zhe-Kun; Zhang, Jia-Mei; Wang, Zhong-Xia Homochiral hybrid hexagonal antiperovskite crystals [R- and S-3-chloroquinuclidinium]3(CdCl3)(CdCl4) CrystEngComm, 2024, 26, 3874-3879 |
| 7701871 | CIF | C9 H20 Cl Fe N3 O10 P3 Zn2 | P 63 | 8.9323; 8.9323; 13.2617 90; 90; 120 | 916.34 | Liu, Sheng-Bo; Bao, Song-Song; Zheng, Li-Min Polar layered coordination polymers incorporating triazacyclononane-triphosphonate metalloligands. Dalton transactions (Cambridge, England : 2003), 2020, 49, 3758-3765 |
| 7702539 | CIF | C37 H55 N3 Si3 | P 63 | 18.392; 18.392; 19.655 90; 90; 120 | 5758 | Renner, Patrick; Galka, Christian H.; Gade, Lutz H.; Radojevic, Sanja; McPartlin, Mary Synthesis and structural characterization of a novel C3-chiral triamine and its trilithium triamide Journal of the Chemical Society, Dalton Transactions, 2001, 964 |
| 7704916 | CIF | C6 H5 Cl Cu N O2 S | P 63 | 15.8563; 15.8563; 6.565 90; 90; 120 | 1429.45 | Hassanein, Khaled; Cappuccino, Chiara; Amo-Ochoa, Pilar; López-Molina, Jesús; Maini, Lucia; Bandini, Elisa; Ventura, Barbara Multifunctional coordination polymers based on copper(i) and mercaptonicotinic ligands: synthesis, and structural, optical and electrical characterization. Dalton transactions (Cambridge, England : 2003), 2020, 49, 10545-10553 |
| 7704917 | CIF | C6 H5 Cl Cu N O2 S | P 63 | 15.8563; 15.8563; 6.565 90; 90; 120 | 1429.45 | Hassanein, Khaled; Cappuccino, Chiara; Amo-Ochoa, Pilar; López-Molina, Jesús; Maini, Lucia; Bandini, Elisa; Ventura, Barbara Multifunctional coordination polymers based on copper(i) and mercaptonicotinic ligands: synthesis, and structural, optical and electrical characterization. Dalton transactions (Cambridge, England : 2003), 2020, 49, 10545-10553 |
| 7708715 | CIF | C52 H48.75 Fe I3 P2.25 | P 63 | 15.8388; 15.8388; 46.513 90; 90; 120 | 10105.3 | Reiß, Andreas; Donsbach, Carsten; Feldmann, Claus Insights into the naphthalenide-driven synthesis and reactivity of zerovalent iron nanoparticles Dalton Transactions, 2021 |
| 7709027 | CIF | C26 H36 F6 Fe N18 O6 S2 | P 63 | 19.5869; 19.5869; 19.0349 90; 90; 120 | 6324.3 | Bronisz, Robert; Książek, Maria; Kusz, Joachim; Weselski, Marek Damian Single crystal-to-single crystal transformation – from two distinct to three distinct spin crossover centers in 2D coordination polymer [Fe(bbtr)3](CF3SO3)2 Dalton Transactions, 2021 |
| 7709029 | CIF | C26 H36 F6 Fe N18 O6 S2 | P 63 | 19.0423; 19.0423; 19.1734 90; 90; 120 | 6021 | Bronisz, Robert; Książek, Maria; Kusz, Joachim; Weselski, Marek Damian Single crystal-to-single crystal transformation – from two distinct to three distinct spin crossover centers in 2D coordination polymer [Fe(bbtr)3](CF3SO3)2 Dalton Transactions, 2021 |
| 7709030 | CIF | C26 H36 F6 Fe N18 O6 S2 | P 63 | 19.05; 19.05; 19.0504 90; 90; 120 | 5987.21 | Bronisz, Robert; Książek, Maria; Kusz, Joachim; Weselski, Marek Damian Single crystal-to-single crystal transformation – from two distinct to three distinct spin crossover centers in 2D coordination polymer [Fe(bbtr)3](CF3SO3)2 Dalton Transactions, 2021 |
| 7709031 | CIF | C26 H36 F6 Fe N18 O6 S2 | P 63 | 19.4504; 19.4504; 18.729 90; 90; 120 | 6136.24 | Bronisz, Robert; Książek, Maria; Kusz, Joachim; Weselski, Marek Damian Single crystal-to-single crystal transformation – from two distinct to three distinct spin crossover centers in 2D coordination polymer [Fe(bbtr)3](CF3SO3)2 Dalton Transactions, 2021 |
| 7709140 | CIF | Al2 Ba O4 | P 63 | 10.47; 10.47; 8.819 90; 90; 120 | 837.227 | Yin, Xiaomeng; Lin, Hui; Zhang, Dawei; Hong, Ruijin; Tao, Chunxian; Han, Zhaoxia; Zhou, Shengming; Zhang, Zhi-Jun; Zheng, Guanhaoije BaAl<sub>2</sub>O<sub>4</sub>:Eu<sup>2+</sup>-Al<sub>2</sub>O<sub>3</sub> ceramics for wide range optical temperature sensing. Dalton transactions (Cambridge, England : 2003), 2022, 51, 1784-1790 |
| 7711569 | CIF | Bi12.89 Br2.85 S17.15 | P 63 | 15.473; 15.473; 4.0041 90; 90; 120 | 830.2 | Amarasinghe, Dinesh K.; Yox, Philip; Viswanathan, Gayatri; Adeyemi, Adedoyin N.; Kovnir, Kirill Modulation of transport properties via S/Br substitution: solvothermal synthesis, crystal structure, and transport properties of Bi13S17Br3 Dalton Transactions, 2022 |
| 7711914 | CIF | C36 H130 Cl0.5 Fe3 N9 Na0.5 O88 P2 W15 | P 63 | 16.376; 16.376; 25.646 90; 90; 120 | 5956.2 | Izarova, Natalya V.; Faassen, Fabian; Kögerler, Paul Tris-decorated multi-iron polyoxotungstates. Dalton transactions (Cambridge, England : 2003), 2023, 52, 546-550 |
| 7713114 | CIF | C27 H22 Fe2 O6 P S6 | P 63 | 10.0805; 10.0805; 17.8516 90; 90; 120 | 1570.98 | Taniai, Ryosuke; Endo, Tsubasa; KANETOMO, Takuya; Okazawa, Atsushi; Kadobayashi, Hirokazu; Kawaguchi, Saori I.; Enomoto, Masaya 57Fe Mössbauer Spectroscopy and High-Pressure Structural Analysis for Mechanism of Pressure-Induced Unique Magnetic Behaviour in (cation)[FeIIFeIII(dto)3] (cation = Ph4P and nPrPh3P; dto = 1,2-dithiooxalato) Dalton Transactions, 2023 |
| 7713986 | CIF | C45 H60 N3 Ni3 P3 | P 63 | 15.101; 15.101; 12.0727 90; 90; 120 | 2384.2 | SCHILTZ, pauline; Casaretto, Nicolas; Bourcier, Sophie; Gosmini, Corinne; Auffrant, Audrey Phosphinoquinoline supported CoII, NiII, and FeII complexes: divergent behaviour upon reduction Dalton Transactions, 2023 |
| 7714454 | CIF | C30 H58 N6 O30 S6 Sr Zn6 | P 63 | 18.5594; 18.5594; 11.7771 90; 90; 120 | 3513.2 | Bilanin Artigado, Cristina; Escamilla, Paula; Ferrando-Soria, Jesús; Leyva-Perez, Antonio; Armentano, Donatella; Pardo, Emilio Selective cycloaddition of ethylene oxide to CO2 within the confined space of an amino acid-based metal-organic framework Dalton Transactions, 2023 |
| 7714978 | CIF | C33 H42 Cl Mo12 N9 O43 P | P 63 | 14.4362; 14.4362; 18.673 90; 90; 120 | 3370.16 | Chen, Yue-Chen; Di, Yi-Ming; Zhang, Shu-Quan; Lin, Mei-Jin Polyoxometalate/<i>s</i>-triazine hybrid heterostructures with ultrafast photochromic properties. Dalton transactions (Cambridge, England : 2003), 2024, 53, 3215-3223 |
| 7715512 | CIF | Cr I3 O9 | P 63 | 9.1319; 9.1319; 5.2815 90; 90; 120 | 381.43 | Chi, Yang; Xin, Mei-Ling Chromium iodate: the structure and origin of optical second harmonic generation. Dalton transactions (Cambridge, England : 2003), 2024, 53, 7093-7099 |
| 7717253 | CIF | Cs2 F6 Li3 Na3 O24 P6 Si Zn6 | P 63 | 12.4677; 12.4677; 4.9871 90; 90; 120 | 671.35 | Liu, Mingfeng; Mi, Jin-Xiao; Zhang, Yinggan; Wang, Shuaihua; Wu, Shaofan; Huang, Ya-Xi Approach for quality deep-ultraviolet nonlinear optical crystals <i>via</i> a substitution strategy of channel species in zeolite. Dalton transactions (Cambridge, England : 2003), 2024 |
| 7717267 | CIF | C20 H24 N6 | P 63 | 12.7968; 12.7968; 6.5617 90; 90; 120 | 930.57 | Kracht, Felix; Stuhl, Christoph; Maichle-Moessmer, Caecilia; Anwander, Reiner Reactivity of Mg(AlMe4)2 towards neutral tris(pyrazolyl)alkanes Dalton Transactions, 2024 |
| 7717290 | CIF | F6 Na6 O30 Se8 V7 | P 63 | 12.8701; 12.8701; 5.1654 90; 90; 120 | 740.97 | Zhu, Tianyu; Zhao, Zhiying; Cui, Meiyan; Zhang, Wenhao; He, Zhangzhen A new S = 1/2 stacked kagomé lattice compound showing two successive ferromagnetic transitions Dalton Transactions, 2024 |
| 8000112 | CIF | C20 H60 Cl4 Co2 N9 Na O22 Pt2 S5 | P 63 | 19.879; 19.879; 22.926 90; 90; 120 | 7846 | Igashira-Kamiyama, Asako; Fujioka, Junji; Kodama, Tomoki; Kawamoto, Tatsuya; Konno, Takumi Anion-controlled Preparation of Chiral S-Bridged CoIIIPtII2 and CoIII2PtII2 Complexes Consisting of [Co(D-penicillaminato-N,O,S)2]− and [Pt(CH3NH2)2]2+ Units Chemistry Letters, 2006, 35, 522 |
| 8102907 | CIF | Al La3 Mn Se7 | P 63 | 10.678; 10.678; 6.12 90; 90; 120 | 604.3 | L.-B. Wu; F.-Q. Huang Crystal structure of trilanthanum manganese aluminum heptaselenide, La~3~Mn~0.73~AlSe~7~ Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 305-306 |
| 8102914 | CIF | Ag La3 S7 Si | P 63 | 10.421; 10.421; 5.785 90; 90; 120 | 544.1 | L.-B. Wu; F.-Q. Huang Crystal structure of trilanthanum monosilver monosilicon heptasulfide, La~3~AgSiS~7~ Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 307-308 |
| 8103628 | CIF | C H4 Al6 Ca Na6 O29 Si6 | P 63 | 12.75; 12.75; 5.14 90; 90; 120 | 723.626 | Jarchow, O. Atomanordnung und Strukturverfeinerung von Cancrinit Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1965, 122, 407-422 |
| 8103755 | CIF | Ba Fe Ga O4 | P 63 | 10.8377; 10.8377; 8.6865 90; 90; 120 | 883.588 | Kahlenberg, V.; Parise, J.B.; Lee, Y.; Tripathi, A. Characterization of the stuffed framework structures Ba Al Ga O4 and Ba Fe Ga O4 Zeitschrift fuer Kristallographie (149,1979-), 2002, 217, 249-255 |
| 8103847 | CIF | C1.4 H5.76 Al6 Na7.6 O30.48 Si6 | P 63 | 12.725; 12.725; 5.177 90; 90; 120 | 725.98 | Gesing, T.M.; Buhl, J.C. Structure and spectroscopic properties of hydrogencarbonate containing alumosilicate sodalite and cancrinite Zeitschrift fuer Kristallographie (149,1979-), 2000, 215, 413-418 |
| 8104186 | CIF | Al3.52 K Na3 O16 Si4.48 | P 63 | 10.06; 10.06; 8.42 90; 90; 120 | 737.97 | Foreman, N.; Peacor, D.R. Refinement of the nepheline structure at several temperatures Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1970, 132, 45-70 |
| 8104308 | CIF | N4 Si3 | P 63 | 13.155; 13.155; 8.706 90; 90; 120 | 1304.76 | Hartmann, P. A uniform description of phenakite type structures as superstructures of beta-Si3N4 Zeitschrift fuer Kristallographie (149,1979-), 1989, 187, 139-143 |
| 8104311 | CIF | Al7.2 Na7.15 O32 Si8.8 | P 63 | 9.958; 9.958; 8.341 90; 90; 120 | 716.297 | Hippler, B.; Boehm, H. Structure investigation on sodium-nephelines Zeitschrift fuer Kristallographie (149,1979-), 1989, 187, 39-53 |
| 8104372 | CIF | Al22 Ba12.6666 O66 Si10 | P 63 | 9.955; 9.955; 18.59 90; 90; 120 | 1595.48 | Gebert, W. Die Kristallstruktur von Ba13 Al22 Si10 O66 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1972, 135, 437-452 |
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