Crystallography Open Database
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Searching space group like 'P m n 21'
COD ID | Links | Formula | Space group | Cell parameters | Cell volume | Bibliography |
---|---|---|---|---|---|---|
7062764 | CIF | C71 H60 Cl2 N4 O5 P2 Ru S2 | P m n 21 | 16.9228; 10.5794; 18.136 90; 90; 90 | 3246.94 | Singh, Aditi; Seikh, Liton; Dey, Sanchaita; Lahiri, Goutam Kumar Ruthenium-hydride-mediated stabilisation of the azo anion radical of azobis(benzothiazole) and its reversible electron-reservoir feature New Journal of Chemistry, 2023, 47, 19428-19438 |
7063232 | CIF | C40 H32 Cu N O P2 | P m n 21 | 17.3563; 11.8638; 8.1509 90; 90; 90 | 1678.37 | Moussa, J.; Gontard, G. Novel heteroleptic copper(i) complexes merging the chelating 1,2-bis-diphenyldiphosphine and various L^X type coligands New Journal of Chemistry, 2024, 48, 12162-12165 |
7100560 | CIF | C28 H26 Ag Cl3 N8 O5.74 | P m n 21 | 43.826; 5.2608; 14.096 90; 90; 90 | 3250 | Jonathan Steed; Lucas Applegarth; Nigel Clark; Andres E. Goeta; Judith A.K. Howard; Andrew D.M. Parker; Ivana Radosavljevic-Evans; Christine Richardson Modular Nanometer-Scale Structuring of Gel Fibres by Sequential Self-Organization Chemical Communications, 2005 |
7103420 | CIF | C30 H45 Cl2 N20 O17.5 | P m n 21 | 14.28; 11.56; 13.183 90; 90; 90 | 2176.2 | Bardelang, David; Udachin, Konstantin A; Anedda, Roberto; Moudrakovski, Igor; Leek, Donald M; Ripmeester, John A; Ratcliffe, Christopher I Single-crystal to single-crystal phase transition of cucurbit[5]uril hydrochloride hydrates: large water-filled channels transforming to layers of unusual stability. Chemical communications (Cambridge, England), 2008, 4927-4929 |
7104530 | CIF | C14 H31 B2 O Sc | P m n 21 | 13.8226; 8.066; 7.6377 90; 90; 90 | 851.55 | Bonnet, Fanny; Da Costa Violante, Cristina; Roussel, Pascal; Mortreux, André; Visseaux, Marc Unprecedented dual behaviour of a half-sandwich scandium-based initiator for both highly selective isoprene and styrene polymerisation. Chemical communications (Cambridge, England), 2009, 34, 3380-3382 |
7108012 | CIF | C5 H15 Cl P2 | P m n 21 | 9.4581; 6.5601; 7.306 90; 90; 90 | 453.31 | Saurabh S. Chitnis; Elizabeth MacDonald; Neil Burford; Ulrike Werner-Zwanziger; Robert McDonald P-P Menschutkin preparation of prototypical phosphinophosphonium salts Chem.Commun., 2012, 48, 7359 |
7110363 | CIF | C14 H23 Cl2 Ga N2 | P m n 21 | 10.2217; 12.2916; 6.462 90; 90; 90 | 811.89 | Luo, Bing; Young Jr., Victor G.; Gladfelter, Wayne L. Syntheses and structures of quinuclidine-stabilized four- and five-coordinate mono- and di-chlorogallane Chemical Communications, 1999, 123 |
7111784 | CIF | C31 H43 Eu I N2 O4 | P m n 21 | 17.7513; 8.7645; 10.3139 90; 90; 90 | 1604.65 | Wiecko, Michal; Deacon, Glen B.; Junk, Peter C. Organolanthanoid-halide synthons—a new general route to monofunctionalized lanthanoid(ii) compounds? Chemical Communications, 2010, 46, 5076-5078 |
7111785 | CIF | C31 H43 I N2 O4 Yb | P m n 21 | 17.6761; 8.7327; 10.1877 90; 90; 90 | 1572.57 | Wiecko, Michal; Deacon, Glen B.; Junk, Peter C. Organolanthanoid-halide synthons—a new general route to monofunctionalized lanthanoid(ii) compounds? Chemical Communications, 2010, 46, 5076-5078 |
7120459 | CIF | C14 H31 B2 Co F8 N5 | P m n 21 | 8.794; 14.351; 16.856 90; 90; 90 | 2127 | Cui, Hui-Hui; Wang, Jing; Chen, Xue-tai; Xue, Zi-Ling Slow magnetic relaxation in five-coordinate spin-crossover cobalt(II) complexes Chem. Commun., 2017 |
7122466 | CIF | C16 H16 Au2 N10 | P m n 21 | 6.2753; 8.0957; 18.757 90; 90; 90 | 952.91 | Liu, Qi; Xie, Mo; Chang, Xiaoyong; Gao, Qin; Chen, Yong; Lu, Wei Correlating thermochromic and mechanochromic phosphorescence with polymorphs of a complex gold(i) double salt with infinite aurophilicity. Chemical communications (Cambridge, England), 2018, 54, 12844-12847 |
7122468 | CIF | C16 H16 Au2 N10 | P m n 21 | 6.3306; 8.141; 18.7077 90; 90; 90 | 964.15 | Liu, Qi; Xie, Mo; Chang, Xiaoyong; Gao, Qin; Chen, Yong; Lu, Wei Correlating thermochromic and mechanochromic phosphorescence with polymorphs of a complex gold(i) double salt with infinite aurophilicity. Chemical communications (Cambridge, England), 2018, 54, 12844-12847 |
7122469 | CIF | C16 H16 Au2 N10 | P m n 21 | 6.2961; 8.1146; 18.7357 90; 90; 90 | 957.21 | Liu, Qi; Xie, Mo; Chang, Xiaoyong; Gao, Qin; Chen, Yong; Lu, Wei Correlating thermochromic and mechanochromic phosphorescence with polymorphs of a complex gold(i) double salt with infinite aurophilicity. Chemical communications (Cambridge, England), 2018, 54, 12844-12847 |
7130350 | CIF | C35 H80 Br15 N10 Rb5 | P m n 21 | 48.9591; 6.8436; 9.8667 90; 90; 90 | 3305.9 | Han, Keke; Zhang, Mengxia; Wei, Zhenhong; Ye, Xing; Rao, Wenjun; Zhang, Haina; Cai, Hu Precise design and preparation of two 3D organic−inorganic perovskite ferroelectrics (1,5-diazabicyclo[3.2.2]nonane)RbX3 (X = Br, I) Chemical Communications, 2022 |
7130869 | CIF | B2 Be2 O6 Pb | P m n 21 | 10.737; 4.7501; 4.5368 90; 90; 90 | 231.39 | Chen, Yi-Gang; Jiang, Xingxing; Yang, Yuanyu; Dai, Zhe; Lin, Zheshuai; Zhang, Xian-Ming PbBe2B2O6: An Excellent Ultraviolet Nonlinear-Optical Crystal with Unprecedented π-π Interacting BeBO5 Group Chemical Communications, 2022 |
7132367 | CIF | C19 H23 Co F6 N2 O3 S | P m n 21 | 10.9754; 9.2478; 11.0627 90; 90; 90 | 1122.85 | Zou, Minzhu; Waldie, Kate MacKenzie Redox-Active Ligand Promoted Electrophile Addition at Cobalt Chemical Communications, 2023 |
7151433 | CIF | ? | P m n 21 | 18.713; 9.553; 4.831 90; 90; 90 | 863.6 | Levy, Amalia; Cohen, Shmuel; Agranat, Israel Overcrowded 1,8-diazafluorenylidene-chalcoxanthenes. Introducing nitrogens at the fjord regions of bistricyclic aromatic enes Organic & Biomolecular Chemistry, 2003, 1, 2755 |
7151434 | CIF | ? | P m n 21 | 18.811; 9.702; 4.639 90; 90; 90 | 846.6 | Levy, Amalia; Cohen, Shmuel; Agranat, Israel Overcrowded 1,8-diazafluorenylidene-chalcoxanthenes. Introducing nitrogens at the fjord regions of bistricyclic aromatic enes Organic & Biomolecular Chemistry, 2003, 1, 2755 |
7154304 | CIF | C66 H70 N2 O4 S4 | P m n 21 | 15.1668; 14.7772; 12.7612 90; 90; 90 | 2860.1 | Zhao, Jiang-Lin; Tomiyasu, Hirotsugu; Ni, Xin-Long; Zeng, Xi; Elsegood, Mark R. J.; Redshaw, Carl; Rahman, Shofiur; Georghiou, Paris E.; Teat, Simon J.; Yamato, Takehiko The first study about the relationship between the extractability of thiacalix[4]arene derivatives and the position of the coordination binding sites. Organic & biomolecular chemistry, 2015, 13, 3476-3483 |
7158229 | CIF | C21 H19 B N2 O5 | P m n 21 | 14.507; 9.3436; 14.134 90; 90; 90 | 1915.8 | Maeda, Hiromitsu; Haketa, Yohei; Murata, Tomoki; Ohta, Eriko; Murata, Tai; Yasuda, Nobuhiro Self-assemblies of anionic-unit-introduced anion-responsive π-electronic molecules Organic & Biomolecular Chemistry, 2021, 19, 7369-7373 |
7200985 | CIF | C6 H12 Ag2 Cl N3 O0 S2 | P m n 21 | 14.9; 6.4724; 6.4724 90; 90; 90 | 624.2 | Liu, Xi; Huang, Kun-Lin; Liang, Guo-Ming; Wang, Ming-Sheng; Guo, Guo-Cong Molecular design of luminescent halogeno-thiocyano-d10 metal complexes with in situ formation of the thiocyanate ligand CrystEngComm, 2009, 11, 1615 |
7202687 | CIF | C13 H6 F4 I N | P m n 21 | 12.0266; 10.2443; 4.9988 90; 90; 90 | 615.87 | Christer B. Aakeröy; Nate Schultheiss; John Desper; Curtis Moore Attempted assembly of discrete coordination complexes into 1-D chains using halogen bonding or halogen?halogen interactions CrystEngComm, 2007, 9, 421 |
7206425 | CIF | C17 H33 N5 O4 | P m n 21 | 51.63; 4.7775; 4.129 90; 90; 90 | 1018.47 | Duong, Adam; Maris, Thierry; Wuest, James D. Engineering homologous molecular organization in 2D and 3D. Cocrystallization of aminoazines and alkanecarboxylic acids CrystEngComm, 2011, 13, 5571 |
7209486 | CIF | B4 Ca O7 | P m n 21 | 10.584; 4.3694; 4.1935 90; 90; 90 | 193.931 | Huppertz, H. beta-(Ca B4 O7): a new polymorph synthesized under high-pressure/high-temperature conditions Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 2003, 58, 257-265 |
7209503 | CIF | B4 Hg O7 | P m n 21 | 10.656; 4.381; 4.1872 90; 90; 90 | 195.475 | Huppertz, H.; Weil, M.; Emme, H. High-Pressure Synthesis and Crystal Structure of the New Orthorhombic Polymorph beta-Hg B4 O7 Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 2005, 60, 815-820 |
7214711 | CIF | C31 H106 N Na5 O55 P4 | P m n 21 | 16.2938; 16.3581; 16.329 90; 90; 90 | 4352.26 | Ling, Irene; Iyer, K. Swaminathan; Bond, Charles S.; Sobolev, Alexandre N.; Alias, Yatimah; Raston, Colin L. Sodium ion association via bridging water molecules for different charged p-phosphonated calix[4]arene bilayers CrystEngComm, 2012, 14, 8541 |
7215319 | CIF | C4 H5 N3 O2 Zn | P m n 21 | 9.303; 8.413; 8.161 90; 90; 90 | 638.7 | Yin, Pei-Xiu; Zhang, Jian; Qin, Ye-Yan; Cheng, Jian-Kai; Li, Zhao-Ji; Yao, Yuan-Gen Role of molar-ratio, temperature and solvent on the Zn/Cd 1,2,4-triazolate system with novel topological architectures CrystEngComm, 2011, 13, 3536 |
7216545 | CIF | C11 H18 N8 O3 | P m n 21 | 9.5289; 9.1191; 8.667 90; 90; 90 | 753.12 | Gryl, M.; Seidler, T.; Stadnicka, K.; Matulková, I.; Němec, I.; Tesařová, N.; Němec, P. The crystal structure and optical properties of a pharmaceutical co-crystal ‒ the case of the melamine‒barbital addition compound CrystEngComm, 2014, 16, 5765 |
7222682 | CIF | Hg O4 Se | P m n 21 | 6.7311; 4.9308; 4.989 90; 90; 90 | 165.583 | Weil, M. Hydrothermal single crystal growth and crystal structures of the mercury(II) selenates(VI) Hg Se O4, Hg Se O4 * (Hg O) and Hg Se O4 * 2(Hg O) Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 2002, 57, 1043-1050 |
7233118 | CIF | Cu3 P S0.71 Se3.29 | P m n 21 | 7.6164; 6.5945; 6.3107 90; 90; 90 | 316.96 | Vorranutch Itthibenchapong; Robert S. Kokenyesi; Andrew J. Ritenour; Lev N. Zakharov; Shannon W. Boettcher; John F. Wagerd; Douglas A. Keszler Earth-abundant Cu-based chalcogenide semiconductors as photovoltaic absorbers Journal of Materials Chemistry C, 2013, 1, 657-652 |
7233119 | CIF | Cu3 P S1.89 Se2.11 | P m n 21 | 7.5034; 6.4951; 6.2174 90; 90; 90 | 303.01 | Vorranutch Itthibenchapong; Robert S. Kokenyesi; Andrew J. Ritenour; Lev N. Zakharov; Shannon W. Boettcher; John F. Wagerd; Douglas A. Keszler Earth-abundant Cu-based chalcogenide semiconductors as photovoltaic absorbers Journal of Materials Chemistry C, 2013, 1, 657-652 |
7233222 | CIF | B3 Be La O7 | P m n 21 | 10.669; 4.4434; 4.2996 90; 90; 90 | 203.83 | Xue Yan; Siyang Luo; Zheshuai Lin; Yinchao Yue; Xiaoyang Wang; Lijuan Liuab; Chuangtian Chenab LaBeB3O7: a new phase-matchable nonlinear optical crystal exclusively containing the tetrahedral XO4 (X = B and Be) anionic groups Journal of Materials Chemistry C, 2013, 1, 3616-3622 |
7233480 | CIF | B Ba Cl F4 | P m n 21 | 5.228; 9.351; 4.734 90; 90; 90 | 231.4 | Min Zhang; Shilie Pan; Zhihua Yang; Ying Wang; Xin Su; Yun Yang; Zhenjun Huang; Shujuan Han; Kenneth R. Poeppelmeier BaClBF4: a new noncentrosymmetric pseudo-Aurivillius type material with transparency range from deep UV to middle IR and a high laser damage threshold Journal of Materials Chemistry C, 2013, 1, 4740-4745 |
7233612 | CIF | Cl O8 P Pr4 | P m n 21 | 13.1523; 5.8211; 5.8211 90; 90; 90 | 445.67 | Hamdi Ben Yahia; Ute Ch. Rodewald; Claus Feldmann; Marcus Roming; Francois Weill; Rainer Pottgen X-Ray diffraction and SAED characterisations of RE4O4[PO4]Cl (RE = La, Pr, and Nd) and photoluminescence properties of Eu3±doped La4O4[PO4]Cl Journal of Materials Chemistry C, 2014, 2, 1131-1140 |
7233864 | CIF | Cl Cu H3 O3 Sr | P m n 21 | 16.131; 6.4733; 6.5363 90; 90; 90 | 682.5 | Teng-Teng Zhu; Wei Sun; Ya-Xi Huang; Zhi-Mei Sun; Yuanming Pan; Leon Balents; Jin-Xiao Mi Strong spin frustration from isolated triangular Cu(ii) trimers in SrCu(OH)3Cl with a novel cuprate layer Journal of Materials Chemistry C, 2014, 2, 8170-8178 |
7234558 | CIF | C38 H25 F N4 | P m n 21 | 33.005; 3.7442; 10.782 90; 90; 90 | 1332.4 | Takahiro Kamata; Hisahiro Sasabe; Yuichirio Watanabe; Daisuke Yokoyama; Hiroshi Katagiri; Junji Kido A series of fluorinated phenylpyridine-based electron-transporters for blue phosphorescent OLEDs Journal of Materials Chemistry C, 2016, 4, 1104-1110 |
7235038 | CIF | H12 Mg O10 P Rb | P m n 21 | 6.896; 6.191; 11.341 90; 90; 90 | 484.2 | Yuqiao Zhou; Liling Cao; Chensheng Lin; Min Luo; Tao Yan; Ning Ye; Wendan Cheng AMgPO4.6H2O (A = Rb, Cs): strong SHG responses originated from orderly PO4 groups Journal of Materials Chemistry C, 2016, 4, 9219-9226 |
7237909 | CIF | C8 H20 Cl5 N2 Sb | P m n 21 | 8.5385; 11.0894; 17.9031 90; 90; 90 | 1695.19 | Ksiądzyna, Martyna; Gągor, Anna; Piecha-Bisiorek, Anna; Ciżman, Agnieszka; Medycki, Wojciech; Jakubas, Ryszard Exploring a hybrid ferroelectric with a 1-D perovskite-like structure: bis(pyrrolidinium) pentachloroantimonate(iii) Journal of Materials Chemistry C, 2019, 7, 10360 |
7239728 | CIF | C112 H106 Co5 N28 O28 | P m n 21 | 52.46; 7.211; 19.47 90; 90; 90 | 7365.3 | Wang, Jun; Chen, Ning-Ning; Zhang, Chen; Jia, Li-Yong; Fan, Liming Functional group induced structural diversities and photocatalytic, magnetic and luminescence sensing properties of four cobalt(ii) coordination polymers based on 1,3,5-tris(2-methylimidazol-1-yl)benzene CrystEngComm, 2020, 22, 811-820 |
7241190 | CIF | C23 H18 O17 Zn3 | P m n 21 | 17.6198; 11.9264; 14.1457 90; 90; 90 | 2972.59 | Chen, Junling; Li, Bo; Shi, Zhen-Zhen; He, Cheng; Duan, Chunying; Zhang, Tiexin; Wang, Liya Crystal engineering of coordination-polymer-based iodine absorbents using π-electron-rich polycarboxylate aryl ether ligand CrystEngComm, 2020 |
7241870 | CIF | H10 Ni O15 S1.38 Se0.62 U | P m n 21 | 12.8182; 8.2926; 11.3803 90; 90; 90 | 1209.68 | Kornyakov, Ilya V.; Tyumentseva, Olga S.; Krivovichev, Sergey V.; Tananaev, Ivan G.; Gurzhiy, Vladislav V. Crystal chemistry of the M2+[(UO2)(T6+O4)2(H2O)](H2O)4 (M2+ = Mg, Mn, Fe, Co, Ni and Zn; T6+ = S, Se) compounds: the interplay between chemical composition, pH and structural architecture CrystEngComm, 2021, 23, 1140-1148 |
7241874 | CIF | H10 Ni O15 S2 U | P m n 21 | 12.7506; 8.3095; 11.2929 90; 90; 90 | 1196.5 | Kornyakov, Ilya V.; Tyumentseva, Olga S.; Krivovichev, Sergey V.; Tananaev, Ivan G.; Gurzhiy, Vladislav V. Crystal chemistry of the M2+[(UO2)(T6+O4)2(H2O)](H2O)4 (M2+ = Mg, Mn, Fe, Co, Ni and Zn; T6+ = S, Se) compounds: the interplay between chemical composition, pH and structural architecture CrystEngComm, 2021, 23, 1140-1148 |
7241875 | CIF | H10 Ni O15 S1.2 Se0.8 U | P m n 21 | 12.8291; 8.2825; 11.3826 90; 90; 90 | 1209.48 | Kornyakov, Ilya V.; Tyumentseva, Olga S.; Krivovichev, Sergey V.; Tananaev, Ivan G.; Gurzhiy, Vladislav V. Crystal chemistry of the M2+[(UO2)(T6+O4)2(H2O)](H2O)4 (M2+ = Mg, Mn, Fe, Co, Ni and Zn; T6+ = S, Se) compounds: the interplay between chemical composition, pH and structural architecture CrystEngComm, 2021, 23, 1140-1148 |
7241879 | CIF | H10 Ni O15 S1.85 Se0.15 U | P m n 21 | 12.7808; 8.2806; 11.3074 90; 90; 90 | 1196.69 | Kornyakov, Ilya V.; Tyumentseva, Olga S.; Krivovichev, Sergey V.; Tananaev, Ivan G.; Gurzhiy, Vladislav V. Crystal chemistry of the M2+[(UO2)(T6+O4)2(H2O)](H2O)4 (M2+ = Mg, Mn, Fe, Co, Ni and Zn; T6+ = S, Se) compounds: the interplay between chemical composition, pH and structural architecture CrystEngComm, 2021, 23, 1140-1148 |
7241881 | CIF | Co H10 O15 S2 U | P m n 21 | 12.916; 8.296; 11.2937 90; 90; 90 | 1210.13 | Kornyakov, Ilya V.; Tyumentseva, Olga S.; Krivovichev, Sergey V.; Tananaev, Ivan G.; Gurzhiy, Vladislav V. Crystal chemistry of the M2+[(UO2)(T6+O4)2(H2O)](H2O)4 (M2+ = Mg, Mn, Fe, Co, Ni and Zn; T6+ = S, Se) compounds: the interplay between chemical composition, pH and structural architecture CrystEngComm, 2021, 23, 1140-1148 |
7241882 | CIF | H10 Ni O15 S1.64 Se0.35 U | P m n 21 | 12.783; 8.2863; 11.3033 90; 90; 90 | 1197.29 | Kornyakov, Ilya V.; Tyumentseva, Olga S.; Krivovichev, Sergey V.; Tananaev, Ivan G.; Gurzhiy, Vladislav V. Crystal chemistry of the M2+[(UO2)(T6+O4)2(H2O)](H2O)4 (M2+ = Mg, Mn, Fe, Co, Ni and Zn; T6+ = S, Se) compounds: the interplay between chemical composition, pH and structural architecture CrystEngComm, 2021, 23, 1140-1148 |
7241883 | CIF | H10 O15 S2 U Zn | P m n 21 | 12.8695; 8.28206; 11.292 90; 90; 90 | 1203.57 | Kornyakov, Ilya V.; Tyumentseva, Olga S.; Krivovichev, Sergey V.; Tananaev, Ivan G.; Gurzhiy, Vladislav V. Crystal chemistry of the M2+[(UO2)(T6+O4)2(H2O)](H2O)4 (M2+ = Mg, Mn, Fe, Co, Ni and Zn; T6+ = S, Se) compounds: the interplay between chemical composition, pH and structural architecture CrystEngComm, 2021, 23, 1140-1148 |
7247218 | CIF | C13 H18 N4 O5 S | P m n 21 | 20.0136; 8.2017; 9.831 90; 90; 90 | 1613.71 | Pagliari, Anderson B.; Rosa, Jéssica M. L.; de Lima, Priscila S. V.; Zimmer, Geórgia C.; da Silva, Maria E. C.; de Oliveira, Érica G.; Bonacorso, Helio G.; Zanatta, Nilo; Martins, Marcos A. P. Polymorphism in N-(5-methylisoxazol-3-yl)malonamide: understanding the supramolecular structure and the crystallization mechanism CrystEngComm, 2023, 25, 5118-5132 |
7706792 | CIF | Ag1.5 Cu1.5 P S4 | P m n 21 | 7.718; 6.562; 6.318 90; 90; 90 | 320 | Yang, Ya; Zhang, Bingbing; Wu, Xiaowen; Wu, Kui A series of M<sub>3</sub>PS<sub>4</sub> (M = Ag, Cu and Ag/Cu) thiophosphates with diamond-like structures exhibiting large second harmonic generation responses and moderate ion conductivities. Dalton transactions (Cambridge, England : 2003), 2021, 50, 4129-4132 |
7706793 | CIF | Ag3 P S4 | P m n 21 | 7.6383; 6.8528; 6.4976 90; 90; 90 | 340.11 | Yang, Ya; Zhang, Bingbing; Wu, Xiaowen; Wu, Kui A series of M<sub>3</sub>PS<sub>4</sub> (M = Ag, Cu and Ag/Cu) thiophosphates with diamond-like structures exhibiting large second harmonic generation responses and moderate ion conductivities. Dalton transactions (Cambridge, England : 2003), 2021, 50, 4129-4132 |
7706794 | CIF | Cu3 P S4 | P m n 21 | 7.2789; 6.3341; 6.0828 90; 90; 90 | 280.45 | Yang, Ya; Zhang, Bingbing; Wu, Xiaowen; Wu, Kui A series of M<sub>3</sub>PS<sub>4</sub> (M = Ag, Cu and Ag/Cu) thiophosphates with diamond-like structures exhibiting large second harmonic generation responses and moderate ion conductivities. Dalton transactions (Cambridge, England : 2003), 2021, 50, 4129-4132 |
7707104 | CIF | N5 Na | P m n 21 | 5.455; 2.836; 5.662 90; 90; 90 | 87.6 | Bykov, Maxim; Bykova, Elena; Chariton, Stella; Prakapenka, Vitali B.; Batyrev, Iskander G.; Mahmood, Mohammad F.; Goncharov, Alexander F. Stabilization of pentazolate anions in the high-pressure compounds Na<sub>2</sub>N<sub>5</sub> and NaN<sub>5</sub> and in the sodium pentazolate framework NaN<sub>5</sub>·N<sub>2</sub>. Dalton transactions (Cambridge, England : 2003), 2021, 50, 7229-7237 |
7709490 | CIF | C124 H102 N20 O70 Ti19 | P m n 21 | 22.0234; 15.8771; 28.8999 90; 90; 90 | 10105.4 | Gao, Chang; Liu, Caiyun; Said, Amir; Niu, Huihui; Wang, Dexin; Wang, Guo; Tung, Chen-Ho; Wang, Yifeng Syntheses, structures and ligand binding modes of titanium-oxide complexes of 2-picolinate Dalton Transactions, 2022 |
7710538 | CIF | C18 H31 Ga I3 O P | P m n 21 | 14.875; 7.1776; 11.9265 90; 90; 90 | 1273.35 | Dankert, Fabian; Fischer, Malte; Hering-Junghans, Christian Modulating the reactivity of phosphanylidenephosphoranes towards water with Lewis acids Dalton Transactions, 2022 |
7712599 | CIF | B6.5 Co0.5 H3 K3.5 O14 | P m n 21 | 12.3437; 9.1086; 12.9438 90; 90; 90 | 1455.32 | Deng, Yan-Ling; Chen, An-Na; Li, Wei; Xin, Shu-Sheng; Pan, Chun-Yang Exploration of the oxygen reduction reaction activity of four transition metal borates: synthesis, structure and characterization. Dalton transactions (Cambridge, England : 2003), 2023 |
7716360 | CIF | H8 N3 O14 U3 | P m n 21 | 12.387; 7.441; 7.002 90; 90; 90 | 645.4 | Zhang, Yingjie; Ablott, Timothy A.; Nicholas, Maria K.; Karatchevtseva, Inna; Plášil, Jakub Capturing ammonium nitrate in a synthetic uranium oxide hydrate phase: revealing the role of ammonium ions and anion inclusions. Dalton transactions (Cambridge, England : 2003), 2024, 53, 11112-11119 |
8100168 | CIF | C9 H11 Cl Cu N6 | P m n 21 | 13.733; 6.102; 7.252 90; 90; 90 | 607.7 | Lin, Jian-Li; Zheng, Yue-Qing Crystal structure of catena-chlorobis(imidazole)(μ-imidazolato- N,N')copper(II), [Cu(Cl)(C~3~H~4~N~2~)~2~(C~3~H~3~N~2~)] Zeitschrift für Kristallographie - New Crystal Structures, 2004, 219, 431-432 |
8100650 | CIF | Ce2 Ni7 P4 | P m n 21 | 3.7769; 9.2225; 10.4129 90; 90; 90 | 362.71 | Budnyk, Sergii; Prots, Yurii; Kuz'ma, Yurii; Grin, Yuri Refinement of the crystal structure of dicerium heptanickel tetraphosphide, Ce~2~Ni~7~P~4~ Zeitschrift für Kristallographie - New Crystal Structures, 2002, 217, 159-160 |
8101567 | CIF | C44 H58 O10 P2 | P m n 21 | 23.7325; 7.9631; 12.3151 90; 90; 90 | 2327.4 | Reck, Guenter; Schneider, Matthias; Gloede, Joerg; Vollhardt, Dieter Crystal structure of 11,23-bis(diisopropylphosphono)-25,26,27,28- tetramethoxycalix[4]arene, C~44~H~58~O~10~P~2~ Zeitschrift für Kristallographie - New Crystal Structures, 1999, 214, 501-502 |
8102913 | CIF | H7.5 Ni0.5 O5.5 P0.5 | P m n 21 | 6.916; 6.1032; 11.1679 90; 90; 90 | 471.39 | X.-W. Wang; P. Wang; Y.-Q. Zheng Crystal structure of hexaaquanickel(II) hydrogenphosphate monohydrate, [Ni(H~2~O)~6~][HPO~4~] · H~2~O Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 321-322 |
8104004 | CIF | K | P m n 21 | 11.048; 8.367; 7.402 90; 90; 90 | 684.231 | Davis, B.L.; Adams, L.H. Reexamination of K N O3 IV and transition rate of K N O3 II - K N O3 IV Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1962, 117, 399-410 |
8104123 | CIF | Cu3 P S4 | P m n 21 | 7.2817; 6.3387; 6.0746 90; 90; 90 | 280.382 | Pfitzner, A.; Reiser, S. Refinement of the crystal structures of Cu3 P S4 and Cu3 Sb S4 and a comment on normal tetrahedral structures Zeitschrift fuer Kristallographie (149,1979-), 2002, 217, 51-54 |
8107693 | CIF | C6 H18 Br6 In Na O2 S2 | P m n 21 | 10.5451; 7.1169; 13.7034 90; 90; 90 | 1028.42 | Jin, Shifeng; Lu, Jiali The crystal structure of bis(trimethylsulfoxonium) catena-poly[µ2-hexabromido-indium(III)sodium(I)] C6H18O2S2NaInBr6 Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1171-1173 |
9004650 | CIF | H10 O10 S V | P m n 21 | 7.242; 9.319; 6.192 90; 90; 90 | 417.887 | Hawthorne, F. C.; Schindler, M.; Grice, J. D.; Haynes, P. Orthominasragrite, VO(SO4)(H2O)5, a new mineral species from Temple Mountain, Emery county, Utah, U.S.A. The Canadian Mineralogist, 2001, 39, 1325-1331 |
9007517 | CIF | As Cu3 S4 | P m n 21 | 7.407; 6.436; 6.154 90; 90; 90 | 293.37 | Adiwidjaja, G.; Lohn, J. Strukturverfeinerung von enargit, Cu3AsS4 Acta Crystallographica, Section B, 1970, 26, 1878-1879 |
9007573 | CIF | As H16 Mg N O10 | P m n 21 | 7.054; 6.205; 11.368 90; 90; 90 | 497.578 | Ferraris, G.; Franchini-Angela M Hydrogen bonding in the crystalline state. Refinement of the crystal structure of MgNH4AsO4*6(H2O), arsenstruvite Acta Crystallographica, Section B, 1973, 29, 859-863 |
9007575 | CIF | C H6 Cu2 O21 Pb5 S3 | P m n 21 | 20.089; 7.146; 6.56 90; 90; 90 | 941.727 | Giacovazzo, C.; Menchetti, S.; Scordari, F. The crystal structure of caledonite, Cu2Pb5(SO4)3CO3(OH)6 Acta Crystallographica, Section B, 1973, 29, 1986-1990 |
9007674 | CIF | H16 Mg N O10 P | P m n 21 | 6.955; 6.142; 11.218 90; 90; 90 | 479.206 | Ferraris, G.; Fuess, H.; Joswig, W. Neutron diffraction study of MgNH4PO4*6H2O (struvite) and survey of water molecules donating short hydrogen bonds Acta Crystallographica, Section B, 1986, 42, 253-258 |
9008365 | CIF | Al3 Ca0.3 H12 K1.125 Na1.3 O21.325 Si5 | P m n 21 | 10.108; 9.766; 10.171 90; 90; 90 | 1004.03 | McCusker, L. B.; Baerlocher, C. Rietveld refinement of the crystal structure of the new zeolite mineral gobbinsite Locality: County Antrim, Northern Ireland Zeitschrift fur Kristallographie, 1985, 171, 281-289 |
9009429 | CIF | Ba Be2 O7 Si2 | P m n 21 | 11.65; 4.922; 4.674 90; 90; 90 | 268.013 | Krivovichev, S. V.; Yakovenchuk, V. N.; Armbruster, T.; Mikhailova, Y.; Pakhomovsky, Y. A. Clinobarylite, BaBe2Si2O7: Structure refinement, and revision of symmetry and physical properties Locality: Khibina alkaline massif, Kola Peninsula, Russia Neues Jahrbuch fur Mineralogie, Monatshefte, 2004, 2004, 373-384 |
9009490 | CIF | Al2.8 Ca0.47 H12 Na2 O22 Si5.2 | P m n 21 | 10.1027; 9.8016; 10.1682 90; 90; 90 | 1006.88 | Artioli, G.; Foy, H. Gobbinsite from Magheramorne quarry, Northern Ireland Mineralogical Magazine, 1994, 58, 615-620 |
9010013 | CIF | Ga H3 O3 | P m n 21 | 7.4865; 7.4379; 7.4963 90; 90; 90 | 417.423 | Scott, J. D. Crystal structure of a new mineral, sohngeite American Mineralogist, 1971, 56, 355-355 |
9010847 | CIF | H12 K Mg O10 P | P m n 21 | 6.892; 6.166; 11.139 90; 90; 90 | 473.364 | Graeser, S.; Postl, W.; Bojar, H. P.; Berlepsch, P.; Armbruster, T.; Raber, T.; Ettinger, K.; Walter, F. Struvite-(K), KMgPO4*6H2O, the potassium equivalent of struvite - a new mineral Locality: Lengenbach, Switzerland European Journal of Mineralogy, 2008, 20, 629-633 |
9011134 | CIF | Cu3 P Se4 | P m n 21 | 7.697; 6.661; 6.381 90; 90; 90 | 327.152 | Garin, J.; Parthe, E. The crystal structure of Cu3PSe4 and other ternary normal tetrahedral structure compounds with composition 1_356_4 Acta Crystallographica, Section B, 1972, 28, 3672-3674 |
9011199 | CIF | H12 K Mg O10 P | P m n 21 | 6.873; 6.16; 11.087 90; 90; 90 | 469.398 | Mathew, M.; Schroeder, L. W. Crystal structure of a struvite analogue, MgKPO4*6H2O Acta Crystallographica, Section B, 1979, 35, 11-13 |
9012219 | CIF | Mg0.01 O5 V2 | P m n 21 | 11.544; 4.383; 3.574 90; 90; 90 | 180.835 | Shklover, V.; Haibach, T.; Ried, F.; Nesper, R.; Novak, P. Crystal structure of the product of Mg2+ insertion into V2O5 single crystals Sample: I Journal of Solid State Chemistry, 1996, 123, 317-323 |
9012220 | CIF | O5 V2 | P m n 21 | 11.544; 4.383; 3.571 90; 90; 90 | 180.683 | Shklover, V.; Haibach, T.; Ried, F.; Nesper, R.; Novak, P. Crystal structure of the product of Mg2+ insertion into V2O5 single crystals Sample: IIa Journal of Solid State Chemistry, 1996, 123, 317-323 |
9012500 | CIF | Li3 O4 P | P m n 21 | 6.115; 5.2394; 4.8554 90; 90; 90 | 155.562 | Keffer, C.; Mighell, A. D.; Mauer, F.; Swanson, H.; Block, S. The crystal structure of twinned low-temperature lithium phosphate Note: dimorphic with lithiophosphate Inorganic Chemistry, 1967, 6, 119-125 |
9012524 | CIF | D6 Mn N O5 P | P m n 21 | 5.7173; 8.8312; 4.8774 90; 90; 90 | 246.263 | Carling, S. G.; Day, P.; Visser, D. Crystal and magnetic structures of layer transition metal phosphate hydrates Locality: synthetic Sample: T = 1.6 K Note: atomic positions from ICSD Inorganic Chemistry, 1995, 34, 3917-3927 |
9012525 | CIF | D6 Mn N O5 P | P m n 21 | 5.7142; 8.8255; 4.8762 90; 90; 90 | 245.91 | Carling, S. G.; Day, P.; Visser, D. Crystal and magnetic structures of layer transition metal phosphate hydrates Locality: synthetic Sample: T = 21.4 K Note: atomic positions from ICSD Inorganic Chemistry, 1995, 34, 3917-3927 |
9012526 | CIF | D6 Mn N O5 P | P m n 21 | 5.7302; 8.8191; 4.9087 90; 90; 90 | 248.062 | Carling, S. G.; Day, P.; Visser, D. Crystal and magnetic structures of layer transition metal phosphate hydrates Locality: synthetic Sample: T = 295 K Note: atomic positions from ICSD Inorganic Chemistry, 1995, 34, 3917-3927 |
9013793 | CIF | C H6 Cu2 O21 Pb5 S3 | P m n 21 | 20.085; 7.141; 6.563 90; 90; 90 | 941.311 | Schofield, P. F.; Wilson, C. C.; Knight, K. S.; Kirk, C. A. Proton location and hydrogen bonding in the hydrous lead copper sulfates linarite, PbCu(SO4)(OH)2, and caledonite, Pb5Cu2(SO4)3CO3(OH)6 The Canadian Mineralogist, 2009, 47, 649-662 |
9014090 | CIF | As Cu3 S4 | P m n 21 | 7.426; 6.4521; 6.1631 90; 90; 90 | 295.294 | Henao, J. A.; Diaz de Delgado, G.; Delgado, J. M.; Castrillo, F. J.; Odreman, O. Single-crystal structure refinement of enargite [Cu3AsS4] Note z-coordinate of S1 changed from .4592 to match reported bond lengths Materials Research Bulletin, 1994, 29, 1121-1127 |
9014599 | CIF | As Cu3 S4 | P m n 21 | 7.399; 6.428; 6.145 90; 90; 90 | 292.261 | Pfitzner, A.; Bernert, T. The system Cu3AsS4 - Cu3SbS4 and investigations on normal tetrahedral structures Sample: Cu3AsS4 Zeitschrift fur Kristallographie, 2004, 219, 20-26 |
9015642 | CIF | As Cu3 S4 | P m n 21 | 7.4127; 6.4404; 6.1577 90; 90; 90 | 293.973 | Karanovic, L.; Cvetkovic, L.; Poleti, D.; Balic-Zunic T; Makovicky, E. Crystal and absolute structure of enargite from Bor (Serbia) Neues Jahrbuch fur Mineralogie, Monatshefte, 2002, 2002, 241-253 |
9017225 | CIF | As Cu5 H8 O15 | P m n 21 | 3.0113; 14.259; 14.932 90; 90; 90 | 641.152 | Mills, S. J.; Kampf, A. R.; McDonald, A. M.; Bindi, L.; Christy, A. G.; Kolitsch, U.; Favreau, G. The crystal structure of parnauite: a copper arsenate-sulphate with translational disorder of structural rods European Journal of Mineralogy, 2013, 25, 693-704 |
9017226 | CIF | As0.5 Cu2.5 H2.15 O6.575 | P m n 21 | 3.0088; 14.212; 14.89 90; 90; 90 | 636.712 | Mills, S. J.; Kampf, A. R.; McDonald, A. M.; Bindi, L.; Christy, A. G.; Kolitsch, U.; Favreau, G. The crystal structure of parnauite: a copper arsenate-sulphate with translational disorder of structural rods European Journal of Mineralogy, 2013, 25, 693-704 |
9017294 | CIF | H16 Mg N O10 P | P m n 21 | 6.941; 6.137; 11.199 90; 90; 90 | 477.043 | Whitaker, A.; Jeffery, J. W. The crystal structure of struvite, MgNH4PO4*6H2O Acta Crystallographica, Section B, 1970, 26, 1429-1440 |
9017315 | CIF | H16 Mg N O10 P | P m n 21 | 6.955; 6.142; 11.218 90; 90; 90 | 479.206 | Abbona, F.; Calleri, M.; Ivaldi, G. Synthetic struvite MgNH4PO4*6H2O: Correct polarity and surface features of some complementary forms Acta Crystallographica, Section B, 1984, 40, 223-227 |
9017721 | CIF | Cu6 H20 O19 S | P m n 21 | 6.807; 5.897; 20.653 90; 90; 90 | 829.03 | Biagioni, C.; Belmonte, D.; Carbone, C.; Cabella, R.; Demitri, N.; Perchiazzi, N.; Kampf, A. R.; Bosi, F. Isselite, Cu6(SO4)(OH)10(H2O)4*H2O, a new mineral species from Eastern Liguria, Italy Mineralogical Magazine, 2020, 84, 653-661 |
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