Crystallography Open Database

Result: there are 3679 entries in the selection

Switch to the old layout of the page

Download all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)

Searching space group like 'P b c n'

Blue left arrow Blue left arrow First | Blue left arrow Previous 100 | of 37 | Next 100 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

COD ID Blue up arrow Links Formula Up arrow Space group Up arrow Cell parameters Cell volume Up arrow Bibliography
7713760 CIFAl4 B14 Cs4 H4 K2 O32P b c n12.0255; 14.8843; 9.927
90; 90; 90		1776.8Chen, Juan; Chen, Chong-An; Zhang, Peng-Yun; Yang, Guo-Yu
Three new aluminoborates: From 1D tube to 3D framework
Dalton Transactions, 2023
7714003 CIFC23 H16 N2 O10P b c n13.1733; 21.389; 16.5014
90; 90; 90		4649.5Chen, Ying-Jun; Dou, Chang-Xun; Yin, Pei-Pei; Chen, Jun-Ting; Yang, Xiao-Gang; Li, Bo; Ma, Lufang; Wang, Liya
U-type π-conjugated phosphorescent ligand sensitized lanthanide metal–organic frameworks for efficient white-light-emitting diode
Dalton Transactions, 2023
7714045 CIFC5 H6 Bi I4 N2P b c n12.2049; 14.8651; 7.6069
90; 90; 90		1380.1Abdi, Gisya; Gryl, Marlena; Sławek, Andrzej; Kowalewska, Ewelina; Mazur, Tomasz; Podborska, Agnieszka; Mech, Krzysztof; Zawal, Piotr; Pritam, Anurag; Kmita, Angelika; Alluhaibi, Lulu; Maximenko, Alexey; Chakkooth, Vijayakumar; Szacilowski, Konrad
Influence of Crystal Structure and Composition on Optical and Electronic Properties of Pyridinium-based Bismuth Iodide Complexes
Dalton Transactions, 2023
7714140 CIFC57 H39 Cl2 Ir N4 O6P b c n13.7388; 12.7766; 28.3069
90; 90; 90		4968.9Tatarin, Sergei V.; Meshcheriakova, Elizaveta A.; Kozyukhin, Sergey; Emets, Victor; Bezzubov, Stanislav
Rational design of efficient photosensitizers based on cyclometalated iridium(III) complexes with 2-arylbenzimidazole and aromatic 1,3-diketone ligands
Dalton Transactions, 2023
7714205 CIFC8 H22 Co F6 N4 O2 PP b c n10.0855; 18.6517; 7.944
90; 90; 90		1494.36Kariyawasam, Rasika Janadari; Zibaseresht, Ramin; Polson, Matthew Ian James; Houlihan, Joanna C.C.; Wikaira, Jan L.; Hartshorn, Richard M.
Synthesis of Nitrogen Mustards on Cobalt(III)
Dalton Transactions, 2023
7714214 CIFC12 H34 Cl5 Co N4 O2P b c n19.2961; 8.0694; 27.6193
90; 90; 90		4300.54Kariyawasam, Rasika Janadari; Zibaseresht, Ramin; Polson, Matthew Ian James; Houlihan, Joanna C.C.; Wikaira, Jan L.; Hartshorn, Richard M.
Synthesis of Nitrogen Mustards on Cobalt(III)
Dalton Transactions, 2023
7714243 CIFC16 H22 Co N6 O4P b c n13.35; 8.745; 15.324
90; 90; 90		1789C S, Akshaya Keerthi; Das, Sandip; kulbir, Kulbir; Bhardwaj, Prabhakar; Sk, Md Palashuddin; Kumar, Pankaj
Mechanistic Insights of Nitric Oxide Oxygenation (NOO) Reactions of {CrNO}5 & {CoNO}8
Dalton Transactions, 2023
7714267 CIFC15 H23 B F2 N2P b c n10.929; 10.2818; 13.9166
90; 90; 90		1563.81Kannan, Ramkumar; Nayak, Prakash; Arumugam, Ramar; Krishna Rao, D.; Mote, Kaustubh R.; Murali, Anna Chandrasekar; Venkatasubbaiah, Krishnan; Chandrasekhar, Vadapalli
Blue Emissive Amidinate Based Tetra coordinate Boron Compounds
Dalton Transactions, 2023
7714462 CIFC14 H3 F24 Ge N O4P b c n23.5238; 8.6067; 21.8982
90; 90; 90		4433.6Tschernuth, Florian S.; Kostenko, Arseni; Stigler, Sebastian; Gradenegger, Anna; Inoue, Shigeyoshi
A neutral germanium-centred hard and soft lewis superacid and its unique reactivity towards hydrosilanes.
Dalton transactions (Cambridge, England : 2003), 2023, 53, 74-81
7714762 CIFC54 H46 Co2 F24 Fe2 N4 O11P b c n13.6953; 21.185; 21.563
90; 90; 90		6256.2Maryunina, Kseniya; Nigomedyanova, Daria; Morozov, Vitaly; Smirnova, Kristina; Letyagin, Gleb; Romanenko, Galina; Efimov, Nikolay; Bogomyakov, Artem; Ovcharenko, Victor
Ferrocenyl-substituted nitronyl nitroxide in the design of one-dimensional magnets.
Dalton transactions (Cambridge, England : 2003), 2024, 53, 1714-1721
7714933 CIFGe0.67 Nb1.11 O4.56 Rb0.89P b c n7.2567; 12.446; 22.2
90; 90; 90		2005Chai, Jing; She, Yuheng; Jiao, Jinmiao; Li, Lili; Ye, Ning; Hu, Zhanggui; Wu, Yicheng; Li, Conggang
Rb<sub>8</sub>Nb<sub>10</sub>Ge<sub>6</sub>O<sub>41</sub>: a new niobium-germanate crystal featuring unique one-dimensional [Nb<sub>7</sub>O<sub>30</sub>]<sub>∞</sub> chains and wide mid-IR transparency.
Dalton transactions (Cambridge, England : 2003), 2024, 53, 2696-2702
7715023 CIFC16 H40 Cr Mo6 N16 O38 Zn2P b c n18.9926; 19.3476; 15.4933
90; 90; 90		5693.2Liang, Ju-Ju; Lin, Yu-Chun; Chang, Zhi-Han; Wang, Xiuli
Improved capacitive performances and electrocatalytic reduction activity by regulating the bonding interaction between Zn-bistriazole-pyrazine/pyridine units and diverse Anderson-type polyoxometalates.
Dalton transactions (Cambridge, England : 2003), 2024, 53, 3020-3026
7715220 CIFC56 H76 B2 N16 NiP b c n18.2256; 15.8811; 20.8977
90; 90; 90		6048.68Luff, Martin S.; Walther, Luis; Finze, Maik; Radius, Udo
NHC-ligated nickel(II) cyanoborate complexes and salts.
Dalton transactions (Cambridge, England : 2003), 2024, 53, 5391-5400
7715434 CIFC13 B F13 O3 SP b c n33.0522; 11.2332; 8.4733
90; 90; 90		3146Nguyen, Tony; Dutton, Jason L.; Chang, Chia Yun; Zhou, Wen; Piers, Warren E.
Direct C-H electrophilic borylation with (C<sub>6</sub>F<sub>5</sub>)<sub>2</sub>B-NTf<sub>2</sub> to generate B-N dibenzo[<i>a</i>,<i>h</i>]pyrenes.
Dalton transactions (Cambridge, England : 2003), 2024, 53, 7273-7281
7715785 CIFC34 H28 F2 Fe N12 O2P b c n12.7752; 10.7048; 24.3576
90; 90; 90		3331Seredyuk, Maksym; Znovjyak, Kateryna O.; Valverde-Muñoz, Francisco Javier; Muñoz, M. Carmen; Fritsky, Igor O.; Real Cabezos, José Antonio A
Rotational order-disorder and spin crossover behaviour in a neutral iron(II) complex based on asymmetrically substituted large planar ionogenic ligand
Dalton Transactions, 2024
7715786 CIFC34 H28 F2 Fe N12 O2P b c n13.05; 10.401; 25.06
90; 90; 90		3401Seredyuk, Maksym; Znovjyak, Kateryna O.; Valverde-Muñoz, Francisco Javier; Muñoz, M. Carmen; Fritsky, Igor O.; Real Cabezos, José Antonio A
Rotational order-disorder and spin crossover behaviour in a neutral iron(II) complex based on asymmetrically substituted large planar ionogenic ligand
Dalton Transactions, 2024
7715923 CIFC38 H22 Cl6 F6 N2 O6 Pd2 S2P b c n24.4713; 11.0368; 15.9675
90; 90; 90		4312.6Dumitraș, Darius; Dalmau, David; García-Orduña, Pilar; Pop, Alexandra; Silvestru, Anca; Urriolabeitia, Esteban Pablo
Orthopalladated imidazolones and thiazolones: synthesis, photophysical properties and photochemical reactivity
Dalton Transactions, 2024
7715925 CIFC38 H20 Cl6 F8 N2 O6 Pd2 S2P b c n22.7038; 11.4463; 16.6779
90; 90; 90		4334.2Dumitraș, Darius; Dalmau, David; García-Orduña, Pilar; Pop, Alexandra; Silvestru, Anca; Urriolabeitia, Esteban Pablo
Orthopalladated imidazolones and thiazolones: synthesis, photophysical properties and photochemical reactivity
Dalton Transactions, 2024
7715941 CIFC26 H16 N6 Ni O2 S2P b c n18.7879; 8.8858; 13.675
90; 90; 90		2282.98Plyuta, Nataliya; Barra, Anne-Laure; Novitchi, Ghénadie; Avarvari, Narcis
Six-coordinated nickel (II) complexes with benzothiadiazole Schiff-base ligands: synthesis, crystal structure, magnetic and HFEPR study
Dalton Transactions, 2024
7716041 CIFC14 H10 Br2P b c n13.8322; 11.7938; 15.1516
90; 90; 90		2471.7Romero, Nuria; Chavagnan, Thierry; Roisnel, Thierry; Welle, Alexandre; Kirillov, Evgueni; Carpentier, Jean-Francois
Dinuclear Group IV Metal Complexes based on a Bis(indenyl)-(E/Z)-Stilbene Platform: A Potential Prototype of “Photoswitchable” Catalysts for Olefin Polymerization
Dalton Transactions, 2024
7716168 CIFC17 H13 Cl N2 O Pd SP b c n19.0594; 10.4533; 16.3019
90; 90; 90		3247.89Tanwar, Deepika; Kaur, Tashmeen; Sudheendranath, Athul; Kumar, Umesh; Sharma, Deepika
Pd(II) complexes bearing NNS pincer ligands: unveiling potent cytotoxicity against breast and pancreatic cancer.
Dalton transactions (Cambridge, England : 2003), 2024
7716184 CIFC264 H312 N16 Zn4P b c n20.6268; 16.0836; 18.5709
90; 90; 90		6161Parra-Cadenas, Blanca; Ginés, Carlos; García-Vivó, Daniel; Elorriaga, David; Carrillo-Hermosilla, Fernando
Zinc amidinate-catalysed cyclization reaction of carbodiimide and alkynes. An insight into the mechanism.
Dalton Transactions, 2024
7716208 CIFC30 H25 Cl2 Fe N15 O8 S5P b c n14.9806; 15.561; 17.7708
90; 90; 90		4142.6Jo, Minyoung; Amanyazova, Botagoz; Yergeshbayeva, Sandugash; Gakiya-Teruya, Miguel; Üngör, Ökten; Lopez Rivera, Paola; Jen, Natalie; Lukyanenko, Evgeny; Kurkin, Alexander V.; Erkasov, Rakhmetulla; Meisel, Mark W.; Hauser, Andreas; Chakraborty, Pradip; Shatruk, Michael
Light-Induced Spin-State Switching in Fe(II) Spin-Crossover Complexes with Thiazole-Based Chelating Ligands
Dalton Transactions, 2024
7716210 CIFC30 H25 Cl2 Fe N15 O8 S5P b c n15.02; 15.627; 17.7918
90; 90; 90		4176Jo, Minyoung; Amanyazova, Botagoz; Yergeshbayeva, Sandugash; Gakiya-Teruya, Miguel; Üngör, Ökten; Lopez Rivera, Paola; Jen, Natalie; Lukyanenko, Evgeny; Kurkin, Alexander V.; Erkasov, Rakhmetulla; Meisel, Mark W.; Hauser, Andreas; Chakraborty, Pradip; Shatruk, Michael
Light-Induced Spin-State Switching in Fe(II) Spin-Crossover Complexes with Thiazole-Based Chelating Ligands
Dalton Transactions, 2024
8000066 CIFC19.5 H25.5 N7.5 O11.5 PrP b c n34.053; 9.5678; 17.046
90; 90; 90		5553.8Miki Hasegawa; Ayumi Ishii; Tomoko Yamazaki; Shinobu Kishi; Iwao Yamazaki
Intramolecular Excited Energy Transfer from Phenanthroline Fluorophore to Pr(III) in a Metal Complex
Chemistry Letters, 2005, 34, 1418
8000528 CIFC44 H38 Br4 Mn P2P b c n11.90232; 18.92658; 18.74628
90; 90; 90		4222.98Fu, Pengfei; Sun, Yuling; Xia, Zhiguo; Xiao, Zewen
Photoluminescence Behavior of Zero-Dimensional Manganese Halide Tetrahedra Embedded in Conjugated Organic Matrices
The Journal of Physical Chemistry Letters, 2021, 7394-7399
8100177 CIFC8 H16 Au Cl N4 S2P b c n11.9055; 11.7507; 10.0615
90; 90; 90		1407.6Fettouhi, Mohammed; Isab, Anvarhusein A.; Wazeer, Mohamed I. M.
Crystal structure of bis(3,4,5,6-tetrahydropyrimidine-2(1H)-thione- S)gold(I) chloride, [Au(C~4~H~8~N~2~S)~2~]Cl
Zeitschrift für Kristallographie - New Crystal Structures, 2004, 219, 391-392
8100701 CIFC17 H10 F6 O2 S2P b c n12.182; 8.7063; 16.622
90; 90; 90		1763Pu, Shou-Zhi; Sun, Fan; Yuan, Peng; Zhou, Xin-Hong; Zhang, Fu-Shi; Wang, Ru-Ji; Chan, Shek-Kiu
Crystal structure of 1,2-bis(2-methyl-5-formyl-thien-3-yl) perfluorocyclopentene, C~5~F~6~(C~4~HSCH~3~)~2~(CHO)~2~, a photochromic diarylethene
Zeitschrift für Kristallographie - New Crystal Structures, 2002, 217, 415-416
8100703 CIFC4 H8 Br4 O2 SnP b c n8.7678; 11.2927; 11.1746
90; 90; 90		1106.42Bauer, Matthew; Kouvetakis, John; Groy, Thomas L.
Crystal structure of tin tetrabromodioxane, SnBr~4~ · (C~4~H~8~O~2~), a one dimensional polymer of Sn(IV)
Zeitschrift für Kristallographie - New Crystal Structures, 2002, 217, 421-422
8100751 CIFC10 H12 N2 O4P b c n16.006; 5.308; 12.766
90; 90; 90		1084.6Ye, Ming-De; Hu, Mao-Lin; Yuan, Ji-Xin; Wang, Shun
Crystal structure of 2,2'-bipyridine-1,1'-dioxide dihydrate, C~10~H~8~N~2~O~2~ · 2H~2~O
Zeitschrift für Kristallographie - New Crystal Structures, 2002, 217, 497-498
8100823 CIFH36 O42 P8 Zn4P b c n14.566; 14.844; 16.311
90; 90; 90		3526.7Mrad, Mohamed L'ahbib; Ben Slimane, Amel; Rzaigui, Mohamed
Crystal structure of hydrated tetrazinc cyclo-octaphosphate, Zn~4~ [P~8~O~24~] ·~ ~18H~2~O
Zeitschrift für Kristallographie - New Crystal Structures, 2002, 217, 481-482
8101024 CIFC13 H23 Cu N7 O11P b c n21.006; 14.558; 6.9119
90; 90; 90		2113.7Diouf, Ousmane; Gaye, Mohamed; Sall, Abdou S.; Tamboura, Farba; Barry, Aliou H.; Jouini, Tahar
Crystal structure of diaqua-2,6-diacetylpyridine-bis(acetylhydrazone) copper(II) complex dinitrate hydrate, [Cu(C~13~H~17~N~5~O~2~)(H~2~O) ~2~](NO~3~)~2~ · H~2~O
Zeitschrift für Kristallographie - New Crystal Structures, 2001, 216, 421-422
8101079 CIFC8 H8 O2 SeP b c n9.865; 10.491; 15.775
90; 90; 90		1633Ward, A. D.; Ward, V. A.; Tiekink, E. R. T.
Crystal structure of 1-(vinylselenonyl)benzene, C~6~H~5~SeO~2~CH=CH~2~
Zeitschrift für Kristallographie - New Crystal Structures, 2001, 216, 553-554
8101189 CIFC19 H24 Br4 Te2P b c n14.315; 8.107; 19.888
90; 90; 90		2308Dakternieks, D.; O'Connell, J.; Tiekink, E. R. T.
Crystal structure of dibromo[(1,1-dibromo-1-mesityl-l4-telluranyl) methyl]-mesityl-l4-tellurane, [MesTeBr~2~]~2~CH~2~
Zeitschrift für Kristallographie - New Crystal Structures, 2000, 215, 87-88
8101295 CIFC18 H15 Cl N2 O SP b c n8.36; 15.794; 23.949
90; 90; 90		3162.2Hanoun, J.-P.; Boyer, G.; Galy, J.-P.
Crystal structure of 6-butyl-2-chlorothiazolo[5,4-a]acridin-11(6H)- one, C~18~H~15~ClN~2~OS
Zeitschrift für Kristallographie - New Crystal Structures, 2000, 215, 455-456
8101324 CIFC18 H12 S3P b c n16.0515; 11.5227; 8.2362
90; 90; 90		1523.3Choi, Moon-Gun; Chang, Hong-Young; Guzei, Ilia A.
Crystal structure of 1,3,5-tris(thien-2-yl)benzene, C~18~H~12~S~3~
Zeitschrift für Kristallographie - New Crystal Structures, 2000, 215, 491-492
8101495 CIFC15 H18 Cl2 N2 SnP b c n12.305; 15.55; 18.066
90; 90; 90		3456.7Basu Baul, S. S.; Basu Baul, T. S.; Tiekink, E. R. T.
Crystal structure of dichlorodimethyl[N-(2-pyridylmethylene)-3-toluidine]tin, C15H18Cl2N2Sn
Zeitschrift für Kristallographie - New Crystal Structures, 1999, 214, 207-208
8101502 CIFC6 H9 K N O4.5 SP b c n23.001; 7.763; 10.424
90; 90; 90		1861.3Schreuer, Jürgen
Crystal structure of potassium sulfanilate sesquihydrate, KH2NC6H4SO3 · 1.5H2O
Zeitschrift für Kristallographie - New Crystal Structures, 1999, 214, 287-288
8101503 CIFC6 H9 N O4.5 Rb SP b c n23.271; 7.844; 10.635
90; 90; 90		1941.3Schreuer, Jürgen
Crystal structure of rubidium sulfanilate sesquihydrate, RbH2NC6H4SO3 · 1.5H2O
Zeitschrift für Kristallographie - New Crystal Structures, 1999, 214, 289-290
8101696 CIFC8 H11 N2 O5 PP b c n24.714; 7.3303; 11.98
90; 90; 90		2170.3K. Gholivand; Z. Shariatinia; M. Pourayoubi
Refinement of the crystal structure of N-4-nitrophenylphosphoramidic acid dimethyl ester, (CH~3~O)~2~PONHC~6~H~4~NO~2~, at 120 K
Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 65-66
8101706 CIFC7 H11 Cl N O4 PP b c n7.246; 9.134; 30.518
90; 90; 90		2019.8H. Dhaouadi; H. Marouani; M. Rzaigui
Crystal structure of 4-chlorobenzylammonium dihydrogenmonophosphate, (ClC~7~H~6~NH~3~)~H2~PO~4~
Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 135-136
8101832 CIFC32 H32 Cd N4 O2 S4P b c n7.2663; 18.6061; 24.01
90; 90; 90		3246.1M. Saravanan; R. Ramalingam; B. Arulprakasam; G. Bocelli; A. Cantoni; E. R. T. Tiekink
Crystal structure of bis[(N-benzyl,N-hydroxyethyl)dithiocarbamato] (1,10-phenanthroline)cadmium(II), Cd[S~2~CN(C~7~H~7~)(C~2~H~2~OH)] ~2~(C~12~H~8~N~2~)
Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 477-478
8101880 CIFC35 H45 Ba N3P b c n15.7141; 12.8573; 15.7388
90; 90; 90		3179.88Fichtel, K.; Behrens, U.
Crystal structure of bis(pentamethylcyclopentadienyl)tri(pyridine) barium, Ba(C~5~H~5~N)~3~(C~10~H~15~)~2~
Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 609-610
8101997 CIFC15 H12 OP b c n10.9322; 11.86; 17.996
90; 90; 90		2333.3Wu, M.-H.; Yang, X.-H.; Zou, W.-D.; Liu, W.-J.; Li, C.
Refinement of the crystal structure of (E)-1,3-diphenyl-2-propen-1- one, C~15~H~12~O
Zeitschrift für Kristallographie - New Crystal Structures, 2006, 221, 323-324
8102097 CIFC36 H44 N4 Ni3 O20P b c n9.553; 12.26; 36.798
90; 90; 90		4309.8Li, L.-Z.; Wang, L.-H.
Crystal structure of hexaaquanickel(II) bis(bis(N-salicylideneglycinato- O,O')nickelate(II)) dihydrate, [Ni(H~2~O)~6~][Ni(C~9~H~7~NO~3~)~2~] · H~2~O
Zeitschrift für Kristallographie - New Crystal Structures, 2007, 222, 119-121
8102207 CIFC13 H13 N O2P b c n12.4741; 11.1481; 16.3617
90; 90; 90		2275.3Manuela Ramos Silva; Joana A. Silva; Ana M. Urbano; Ana C. Santos; Abilío J. F. N. Sobral; Ana Matos Beja; José A. Paixão
Crystal structure of 2,5-dimethyl-1-(4-carboxy-phenyl)pyrrole, C13H13NO2
Zeitschrift für Kristallographie - New Crystal Structures, 2008, 223, 33
8102319 CIFC32 H30 N2 O10 S4P b c n14.7427; 18.8971; 11.8151
90; 90; 90		3291.6Xiao-Jun Hu; Xiao Liu; Pin Zhang; Tie-Heng Sun
Crystal structure of 5,17-dinitro-25,26,27,28-tetrahydroxy-2,8,14,20-tetrathiacalix[4]arene - tetrahydrofuran (1:2), C24H14N2O8S4 · 2C4H8O
Zeitschrift für Kristallographie - New Crystal Structures, 2008, 223, 393
8102463 CIFC21 H17 N5P b c n18.1415; 9.1274; 20.0652
90; 90; 90		3322.5Huilu Wu; Xingcai Huang; Jingkun Yuan; Jian Ding; Ruirui Yun
Refinement of crystal structure of 2,6-bis(N-methylbenzimidazol-2-yl)pyridine at 153 K, C21H17N5
Zeitschrift für Kristallographie - New Crystal Structures, 2009, 224, 419
8102575 CIFC38 H28 Ba F2 N4 O6P b c n23.483; 10.522; 13.767
90; 90; 90		3401.7Bi-Song Zhang
Crystal structure of diaquabis(2-fluorobenzoato-kO)-bis(1,10-phenanthroline-k2N,N')barium(II), Ba(H2O)2(C7H4FO2)2(C12H8N2)2
Zeitschrift für Kristallographie - New Crystal Structures, 2010, 225, 87
8102839 CIFC15 H15 I2 N O Pt SP b c n24.4566; 9.1868; 15.8353
90; 90; 90		3557.8Kwang Ha
Crystal structure of acridine(dimethyl sulfoxide-kS)diiodoplatinum(II), PtI2(C13H9N)(C2H6OS)
Zeitschrift für Kristallographie - New Crystal Structures, 2010, 225, 657
8102874 CIFC12 H8 Cl N3 O2 PdP b c n11.9623; 14.1791; 6.9203
90; 90; 90		1173.8Kwang Ha
Crystal structure of (bis(2-pyridyl)imido)chloropalladium(II), PdCl(C12H8N3O2)
Zeitschrift für Kristallographie - New Crystal Structures, 2010, 225, 789
8102978 CIFAl Cl4 Hg2 SbP b c n11.9771; 8.7826; 17.5237
90; 90; 90		1843.32Schlirf, Jens; Deiseroth, Hans-Jörg
Crystal structures of α-and β-antimony dimercury tetrachloroaluminate, SbHg~2~AlCl~4~
Zeitschrift für Kristallographie - New Crystal Structures, 2007, 222, 367-368
8103351 CIFC22 H28 Cl4 Mn N4 O3P b c n12.3759; 9.249; 22.827
90; 90; 90		2612.9Limei Wang; Xifeng Zhang; Wanyong Zeng; Zhiguo Liu; Lieju Liu
Crystal structure of bis(3,5-dichloro-N-2-(dimethylamino)ethylsalicylaldiminato-k3N,N',O)manganese(II) monohydrate, Mn(C11H13Cl2N2O)2 · H2O
Zeitschrift für Kristallographie - New Crystal Structures, 2012, 227, 261
8103679 CIFNb2 Ni O6P b c n14.0217; 5.6752; 5.015
90; 90; 90		399.073Weitzel, H.
Kristallstrukturverfeinerung von Wolframiten und Columbiten
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1976, 144, 238-258
8103680 CIFCo Nb2 O6P b c n14.1475; 5.712; 5.0446
90; 90; 90		407.657Weitzel, H.
Kristallstrukturverfeinerung von Wolframiten und Columbiten
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1976, 144, 238-258
8103681 CIFFe Nb2 O6P b c n14.2448; 5.7276; 5.0421
90; 90; 90		411.377Weitzel, H.
Kristallstrukturverfeinerung von Wolframiten und Columbiten
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1976, 144, 238-258
8103682 CIFMn Nb2 O6P b c n14.4236; 5.7609; 5.0839
90; 90; 90		422.436Weitzel, H.
Kristallstrukturverfeinerung von Wolframiten und Columbiten
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1976, 144, 238-258
8103683 CIFMn O6 Ta2P b c n14.4219; 5.7513; 5.0816
90; 90; 90		421.492Weitzel, H.
Kristallstrukturverfeinerung von Wolframiten und Columbiten
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1976, 144, 238-258
8103938 CIFB3 H3 Li O9 PP b c n11.484; 8.719; 13.871
90; 90; 90		1388.89Hauf, C.; Kniep, R.
Crystal Structure of lithium catena-(monoboro-mono-dihydrogendiboratemonohydrogenphosph te), Li (B3 P O6 (O H)3)
Zeitschrift fuer Kristallographie - New Crystal Structures, 1997, 212, 313-314
8103977 CIFCl4 Na ScP b c n6.188; 15.543; 6.367
90; 90; 90		612.379Bohnsack, A.; Meyer, G.; Wickleder, M.S.
Crystal structure of sodium tetrachloroscandate, Na Sc Cl4
Zeitschrift fuer Kristallographie (149,1979-), 1996, 211, 394-394
8104166 CIFCl4 H7 O3.5 PtP b c n6.1317; 11.968; 24.231
90; 90; 90		1778.17Rau, F.; Klement, U.; Range, K.J.
Crystal structure of fac-triaquatrichloroplatinum(IV)chloride hemihydrate, (Pt (H2 O)3 Cl3) Cl (H2 O)0.5
Zeitschrift fuer Kristallographie (149,1979-), 1995, 210, 605-605
8104440 CIFCr F3 H10 O5P b c n10.396; 8.06; 7.965
90; 90; 90		667.401Herbstein, F.H.; Kapon, M.; Reisner, G.M.
Crystal structures of chromium(III) fluoride trihydrate and chromium(III) fluoride pentahydrate. Structural chemistry of hydrated transition metal fluorides. Thermal decomposition of chromium(III) fluoride nonahydrate
Zeitschrift fuer Kristallographie (149,1979-), 1985, 171, 209-224
8104486 CIFMg1.04 O3 SiP b c n9.304; 8.902; 5.351
90; 90; 90		443.192Smyth, J.R.
Protoenstatite. A crystal-structure refinement at 1100 C
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1971, 134, 262-274
8104506 CIFMg O3 SiP b c n9.349; 8.929; 5.361
90; 90; 90		447.521Murakami, T.; Takeuchi, Y.; Yamanaka, T.
X-ray studies on protoenstatite II. Effect of temperature on the structure up to near the incongruent melting point
Zeitschrift fuer Kristallographie (149,1979-), 1984, 166, 263-275
8104654 CIFC22 H14 Cu N2 O4 S2P b c n20.171; 9.684; 10.372
90; 90; 90		2026Zhang, Zhongyu; Men, Xiaoxia; Han, Bing; Sun, Chunyan
Crystal structure of (1,10-phenanthroline-κ2 N,N′)-bis(3-thiophenecarboxylato-κ2 O,O′)copper(II), C22H14N2O4S2Cu
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 1019-1020
8104680 CIFC56 H42 N8 OP b c n17.885; 15.647; 16.189
90; 90; 90		4530.4Li, Yi-Da; Song, Zhi-Qiang; Yue, Zhi-Wei; Zhong, Qi-Di; Qi, Ya-Juan
Crystal structure of 1-(2-cyanobenzyl)-3-cyano-4-phenyl-4-(2-cyanobenzyl)-1,4-dihydropyridine monohydrate, C56H42N8O
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 1113-1114
8104821 CIFC14 H14 F6 N2 OP b c n17.7552; 10.7574; 8.0207
90; 90; 90		1532Hosten, Eric C.; Betz, Richard
The crystal structure of para-trifluoromethyl-aniline hemihydrate, C14H14F6N2O
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 329-331
8104880 CIFC9 H13 N OP b c n29.554; 7.493; 8.28
90; 90; 90		1833.6Manana, Pholani; Hosten, Eric C.; Betz, Richard
Crystal structure of DL-α-(methylaminomethyl)benzyl alcohol, C9H13NO
Zeitschrift für Kristallographie - New Crystal Structures, 2021, 236, 51-53
8105033 CIFC26 H14 Br8 Co N2 O10P b c n24.3935; 11.4505; 11.7004
90; 90; 90		3268.13Li, Yong-Shuang; Luo, Jia-Yang; He, Man-Qiu; Han, Min-Le
Crystal structure of catena-poly[diaqua-bis(3,4,5,6-tetrabromo-carboxybenzoato-κ1O)-(μ2-4,4′-bipyridine-κ2N:N′)cobalt(II)], C26H14Br8CoN2O10
Zeitschrift für Kristallographie - New Crystal Structures, 2019, 235, 113-115
8105145 CIFC26 H20 Cl2 N8 Ni O2P b c n11.737; 9.309; 23.72
90; 90; 90		2592Hao, Zhen-Li; Huang, Cun-Han
Crystal structure of bis(3-chloro-N-(1-(pyrazin-2-yl)ethylidene)benzohydrazonato-k3 N,N′,O)nickel(II), C26H20N8O2Cl2Ni
Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 477-478
8105164 CIFC26 H14 Br8 N2 Ni O10P b c n24.174; 11.3727; 11.7918
90; 90; 90		3241.84Li, Yong-Shuang; Han, Min-Le
Crystal structure of catena-poly[diaqua-(μ2-4,4′-bipyridine-κ2 N:N′)-bis(2,3,4,5-tetrabromo-6-carboxybenzoato-κ1 O)-nickel(II)], C26H14Br8NiN2O10
Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 539-540
8105237 CIFC6 H12 N10 O6 ZnP b c n19.6175; 7.2887; 9.3499
90; 90; 90		1336.91Wang, Hui; Xiao, Zi-Jing
The crystal structure of bis(N-oxy-2-(1H-tetrazol-1-yl) acetamide κ2 O,O′)-diaqua-zinc(II), C6H12ZnN10O6
Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 617-619
8105306 CIFC24 H16 Cr2 N4 Ni O7P b c n13.7804; 10.311; 16.4118
90; 90; 90		2331.95Wu-Hua, Chen; Gui-Xiang, Xie; Qin, Chen; Yan-Ming, Ruan
The crystal structure of (dichromato-κ2 O,O′)bis(1,10-phenanthroline-κ2 N,N′)nickel(II), C12H16N4O7Cr2Ni
Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 849-850
8105378 CIFC28 H26 N8 Ni O4P b c n11.675; 9.884; 23.225
90; 90; 90		2680Li, Li
Crystal structure of bis[3-methoxy-N-(1-(pyrazin-2-yl)ethylidene)benzohydrazonato-κ3 O,N,N′]nickel(II), C28H26N8O4Ni
Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 1063-1064
8105463 CIFC31 H26 Cl2 O6P b c n11.6965; 13.8078; 16.3257
90; 90; 90		2636.6Wu, Chong; Liu, Xiao-Long; An, Rui; Yang, Ye
Crystal structure of 5,17-diformyl-25,26,27,28-tetrahydroxycalix[4]arene- dichloromethane, C31H26Cl2O6
Zeitschrift für Kristallographie - New Crystal Structures, 2020, 235, 1349-1350
8105937 CIFC18 H10 Br N O2P b c n20.745; 6.7956; 20.47
90; 90; 90		2885.8Maluleka, Marole M.; Mphahlele, Malose J.; Onwu, Eugene E.
Crystal structure of 8-bromo-6-oxo-2-phenyl-6H-pyrrolo[3,2,1-ij]quinoline-5-carbaldehyde, C18H11BrNO2
Zeitschrift für Kristallographie - New Crystal Structures, 2019, 234, 1063-1065
8106309 CIFC23 H29 N O3P b c n18.781; 15.749; 14.081
90; 90; 90		4165Chen, Xuanhuang; Wu, Feng; Huang, Manwei; Zheng, Jinqing; Yu, Zhengxi; Chen, Jinhui
Crystal structure of ethyl 4-(3,4-dimethylphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, C23H29NO3
Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 821-822
8106343 CIFC21 H24 Cl N O3P b c n17.215; 15.749; 14.136
90; 90; 90		3833Gou, Wei; Zhou, Yan; Zhong, Wei; Wang, Yang; Yang, Bai-Yuan; Zhao, An-Rong
Crystal structure of ethyl 4-(3-chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, C21H24ClNO3
Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 911-912
8106402 CIFC17 H21 Br N2 O2P b c n20.179; 10.902; 15.026
90; 90; 90		3306Bo, Zhao; Shilu, Zhang
The crystal structure of 9-butoxy-2-(hydroxymethyl)-2H-imidazo[1,5-a]quinolin-10-ium bromide, C17H21O2N2Br
Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 1069-1070
8106482 CIFC19 H18 O4P b c n21.1472; 9.7978; 14.5181
90; 90; 90		3008.1El-Sayed, Nahed N.E.; Almaneai, Norah M.; Ghabbour, Hazem A.; Alafeefy, Ahmed M.
Crystal structure of (E)-2-(4-hydroxy-3-methoxybenzylidene)-6-methoxy-3,4-dihydronaphthalen-1(2H)-one, C19H18O4
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 203-205
8106569 CIFC12 H14 Cl4 N2 ZnP b c n12.7029; 16.0791; 7.7171
90; 90; 90		1576.23Song, Qingmei; Song, Lijun
Crystal Structure of 1,1′-dimethyl-[4,4′-bipyridine]-1,1′-diium tetrachloridozincate(II), C12H14Cl4N2Zn
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 461-462
8106804 CIFC14 H11 N3 SP b c n19.813; 8.1643; 14.9521
90; 90; 90		2418.6Hijazi, Ahmed K.; Abu-Salem, Qutaiba; Ajlouni, Abdulaziz; Taha, Ziyad A.
Crystal structure of 2-(9H-fluoren-9-ylidene)hydrazine-1-carbothioamide, C14H11N3S
Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 129-131
8106831 CIFC82 H64 Co2 N12 O11P b c n22.286; 22.725; 14.056
90; 90; 90		7119Zi, Wang; Guo-Wang, Xu; Hai-Bin, Wang; Zhi-Hang, Zhou; Dong-Sheng, Li
Crystal structure of poly[diaquabis(μ2-biphenyl-2,4′-dicarboxylato-κ2 O:O′)tris(μ2-1,1′-biphenyl-4,4′-diylbis(1H-imidazole)-κ2 N:N′)dicobalt(II)] monohydrat, C82H64N12O11Co2
Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 219-221
8106857 CIFC2 H12 Mg N8 O8P b c n9.856; 6.582; 18.276
90; 90; 90		1185.6Xiaojun, Wang; Jin, Shaohua; Li, Lijie; Chen, Shusen; Shu, Qinghai
Crystal structure of hexaaquamagnesium(II) 5,5′-bitetrazole-1,1′-diolate, C2H12N8O8Mg
Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 305-306
8107489 CIFC61 H50 Cl2 Fe2 I12 N12P b c n13.0247; 17.0204; 34.1475
90; 90; 90		7570Cui, Chuanguo; Zhang, Jinxiao; Xiao, Zhiyin
Crystal structure of tris(2,2′-bipyridine-κ2 N,N′)iron(II) triiodide – dichloromethane (2/1), C61H50Cl2Fe2I12N12
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 541-543
9000191 CIFCa Nb2 O6P b c n14.926; 5.752; 5.204
90; 90; 90		446.786Cummings, J. P.; Simonsen, S. H.
The crystal structure of calcium niobate (CaNb2O6)
American Mineralogist, 1970, 55, 90-97
9000597 CIFLi0.3 Mg1.4 O6 Sc0.3 Si2P b c n9.251; 8.773; 5.377
90; 90; 90		436.392Smyth, J. R.; Ito, J.
The synthesis and crystal structure of a magnesium-lithium-scandium protopyroxene
American Mineralogist, 1977, 62, 1252-1257
9001042 CIFNa2 O9 Si2 Ti2P b c n8.7128; 5.2327; 14.487
90; 90; 90		660.484Sundberg, M. R.; Lehtinen, M.; Kivekas, R.
Refinement of the crystal structure of ramsayite (lorenzenite)
American Mineralogist, 1987, 72, 173-177
9001361 CIFFe0.32 Mn1.68 O9 Pb2 Si2P b c n6.961; 11.018; 9.964
90; 90; 90		764.202Moore, P. B.; Sen Gupta, P. K.; Shen, J.; Schlemper, E. O.
The kentrolite-melanotekite series, 4Pb2(Mn,Fe)2O2[Si2O7]: Chemical crystallographic relations, lone-pair splitting, and cation relation to 8URe2
American Mineralogist, 1991, 76, 1389-1399
9001397 CIFFe0.333 Nb0.501 O2 Ta0.166P b c n14.189; 5.727; 5.12
90; 90; 90		416.053Wenger, M.; Armbruster, T.; Geiger, C. A.
Cation distribution in partially ordered columbite from the Kings Mountain pegmatite, North Carolina sample NCP5, T = 100 K
American Mineralogist, 1991, 76, 1897-1904
9001398 CIFFe0.333 Nb0.5 O2 Ta0.167P b c n14.221; 5.727; 5.102
90; 90; 90		415.526Wenger, M.; Armbruster, T.; Geiger, C. A.
Cation distribution in partially ordered columbite from the Kings Mountain pegmatite, North Carolina SAMPLE ncp1, T = 293 K
American Mineralogist, 1991, 76, 1897-1904
9002030 CIFLi0.23 Mg1.54 O6 Sc0.23 Si2P b c n9.2554; 8.765; 5.3333
90; 90; 90		432.656Yang, H.; Finger, L. W.; Conrad, P. G.; Prewitt, C. T.; Hazen, R. M.
A new pyroxene structure at high pressure: Single-crystal X-ray and Raman study of the Pbcn - P2_1cn phase transition in protopyroxene Sample at P = 0.00 GPa, (Mg1.54Li.23Sc.23)Si2O6
American Mineralogist, 1999, 84, 245-256
9002031 CIFLi0.23 Mg1.54 O6 Sc0.23 Si2P b c n9.2351; 8.731; 5.3216
90; 90; 90		429.089Yang, H.; Finger, L. W.; Conrad, P. G.; Prewitt, C. T.; Hazen, R. M.
A new pyroxene structure at high pressure: Single-crystal X-ray and Raman study of the Pbcn - P2_1cn phase transition in protopyroxene Sample at P = 1.11 GPa, (Mg1.54Li.23Sc.23)Si2O6
American Mineralogist, 1999, 84, 245-256
9002032 CIFLi0.23 Mg1.54 O6 Sc0.23 Si2P b c n9.2178; 8.7039; 5.3119
90; 90; 90		426.178Yang, H.; Finger, L. W.; Conrad, P. G.; Prewitt, C. T.; Hazen, R. M.
A new pyroxene structure at high pressure: Single-crystal X-ray and Raman study of the Pbcn - P2_1cn phase transition in protopyroxene Sample at P = 2.03 GPa, (Mg1.54Li.23Sc.23)Si2O6
American Mineralogist, 1999, 84, 245-256
9002206 CIFH8 Na O8 Si2P b c n4.946; 20.502; 7.275
90; 90; 90		737.706Garvie, L. A. J.; Devouard, B.; Groy, T. L.; Camara, F.; Buseck, P. R.
Crystal structure of kanemite, NaHSi2O5.3H2O, from the Aris phonolite, Namibia
American Mineralogist, 1999, 84, 1170-1175
9002782 CIFO2 SiP b c n4.097; 5.0462; 4.4946
90; 90; 90		92.923Dera, P.; Prewitt, C. T.; Boctor, N. Z.; Hemley, R. J.
Characterization of a high-pressure phase of silica from the Martian meteorite Shergotty alpha-PbO2-like
American Mineralogist, 2002, 87, 1018-1023
9003431 CIFMg O3 SiP b c n7.037; 6.928; 4
90; 90; 90		195.009Thompson, R. M.; Downs, R. T.
Model pyroxenes II: Structural variation as a function of tetrahedral rotation model protopyroxene with O3-O3-O3 angle = 180 and model oxygen radius = 1 Note: Atoms Mg, Si, and O are assigned to atomic positions for convenience
American Mineralogist, 2004, 89, 614-628
9003432 CIFMg O3 SiP b c n9.268; 9.102; 5.255
90; 90; 90		443.298Thompson, R. M.; Downs, R. T.
Model pyroxenes II: Structural variation as a function of tetrahedral rotation model protoenstatite at 1360 K after Yang and Ghose (1995) with O3-O3-O3 angle = 168.4 and model oxygen radius = 1.321 Note: Atoms Mg, Si, and O are assigned to atomic positions for convenience
American Mineralogist, 2004, 89, 614-628
9003433 CIFMg O3 SiP b c n9.199; 9.026; 5.211
90; 90; 90		432.67Thompson, R. M.; Downs, R. T.
Model pyroxenes II: Structural variation as a function of tetrahedral rotation model protopyroxene after Yang et al. (1999) with O3-O3-O3 angle = 166.2 and model oxygen radius = 1.312 Note: Atoms Mg, Si, and O are assigned to atomic positions for convenience
American Mineralogist, 2004, 89, 614-628
9003434 CIFMg O3 SiP b c n9.154; 8.981; 5.185
90; 90; 90		426.27Thompson, R. M.; Downs, R. T.
Model pyroxenes II: Structural variation as a function of tetrahedral rotation model protopyroxene after Yang et al. (1999) with O3-O3-O3 angle = 165.9 and model oxygen radius = 1.306 Note: Atoms Mg, Si, and O are assigned to atomic positions for convenience
American Mineralogist, 2004, 89, 614-628

Blue left arrow Blue left arrow First | Blue left arrow Previous 100 | of 37 | Next 100 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

Back to the search form
Your own data is not in the COD? Deposit it, thanks!
Top of the page
All data in the COD and the database itself are dedicated to the public domain and licensed under the CC0 License . Users of the data should acknowledge the original authors of the structural data.