Crystallography Open Database

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Searching space group like 'I 41/a m d'

COD ID: 1544413
CIF file Formula: - O2 Sn0.15 Ti0.85 -
Comments: Yamane, H.; Young, B.-C.; Hirai, T. Crystal structure of anatase-type TiO2-SnO2 solid solution prepared by CVD Journal of the Ceramic Society of Japan 100 (1992) 1473-1474
Space group: I 41/a m d
Cell volume: 140.161
Cell parameters: 3.8065; 3.8065; 9.6733; 90; 90; 90;  

COD ID: 1549839
CIF file Formula: - C52 H56 F6 Fe4 O4 -
Comments: Carpenter, Stephanie H.; Baker, Tessa M.; Munoz, Salvador; Brennessel, William W.; Neidig, Michael L. Multinuclear Iron-Phenyl Species in Reactions of Simple Iron Salts and PhMgBr: Identification of Fe4(μ-Ph)6(THF)4 as a Key Reactive Species for Cross-Coupling Chemical Science (2018)
Space group: I 41/a m d
Cell volume: 11012.5
Cell parameters: 15.5897; 15.5897; 45.3118; 90; 90; 90;  

COD ID: 1550668
CIF file Formula: - C24 H13 B3 Hf3 O20 -
Comments: Kong, Xiang-Jing; He, Tao; Zhang, Yongzheng; Wu, Xue-Qian; Wang, Si-Nan; Xu, Ming-Ming; Si, Guang-Rui; Li, Jian-Rong Jeff Constructing New Metal-Organic Frameworks with Complicated Ligands Generated from “One-Pot” In Situ Reactions Chemical Science (2019)
Space group: I 41/a m d
Cell volume: 27807.4
Cell parameters: 40.4997; 40.4997; 16.9534; 90; 90; 90;  

COD ID: 1550671
CIF file Formula: - C24 H13 B3 O20 Zr3 -
Comments: Kong, Xiang-Jing; He, Tao; Zhang, Yongzheng; Wu, Xue-Qian; Wang, Si-Nan; Xu, Ming-Ming; Si, Guang-Rui; Li, Jian-Rong Jeff Constructing New Metal-Organic Frameworks with Complicated Ligands Generated from “One-Pot” In Situ Reactions Chemical Science (2019)
Space group: I 41/a m d
Cell volume: 28019.7
Cell parameters: 40.5746; 40.5746; 17.0198; 90; 90; 90;  

COD ID: 2003934
CIF file

Original IUCr paper

 Formula: - Sc Sn2 -
Comments: Pani, M.; Manfrinetti, P.; Fornasini, M. L. Two New Scandium Phases: ScSn~2~ and Sc~6~Pb~5~ Acta Crystallographica Section C 51(9) (1995) 1725-1728
Space group: I 41/a m d
Cell volume: 556.2
Cell parameters: 4.233; 4.233; 31.039; 90; 90; 90;  

COD ID: 4345844
CIF file Formula: - Au2 Ba S2 -
Comments: Zhou, Molin; Jiang, Xin; Jiang, Xingxing; Xiao, Ke; Guo, Yangwu; Huang, Hongwei; Lin, Zheshuai; Yao, Jiyong; Tung, Chen-Ho; Wu, Li-Zhu; Wu, Yicheng BaAu2S2: A Au-Based Intrinsic Photocatalyst for High-Performance Visible-Light Photocatalysis. Inorganic chemistry 56(9) (2017) 5173-5181
Space group: I 41/a m d
Cell volume: 522.08
Cell parameters: 6.38972; 6.38972; 12.7872; 90; 90; 90;  

COD ID: 6000002
CIF file Formula: - Eu O4 V -
Comments: Christensen, A. N.; Hazell, R. G.; Hewat, A. W. Synthesis, crystal growth and structure investigations of rare-earth disilicates and rare-earth oxyapatites Acta Chemica Scandinavica 51(1) (1997) 37-43
Space group: I 41/a m d
Cell volume: 335.05
Cell parameters: 7.248; 7.248; 6.3778; 90; 90; 90;  

COD ID: 6000227
CIF file Formula: - O7 Sm2 Ti2 -
Comments: Rabanal, M. E.; Varez, A.; Amador, U.; Dompablo, E. A. Y.; Garcia-Alvarado, F. Structure and reaction with lithium of tetragonal pyrochlore-like compound Sm~2~Ti~2~O~7~ Journal of Materials Processing Technology 92-93 (1999) 529-533
Space group: I 41/a m d
Cell volume: 529.84
Cell parameters: 7.208; 7.208; 10.198; 90; 90; 90;  

COD ID: 6000279
CIF file Formula: - Bi2 Cd O4 -
Comments: Kirik, S. D.; Shimanskiy, A. F.; Koryagina, T. I. Crystal structure investigation and conductivity of binary bismuth-cadmium oxide Bi2CdO4 Solid State Ionics 122 (1999) 249-254
Space group: I 41/a m d
Cell volume: 1957.56
Cell parameters: 14.4948; 14.4948; 9.3173; 90; 90; 90;  

COD ID: 6000302
CIF file Formula: - Ga0.88 Ge1.12 Tb -
Comments: Fedorchuk, A. A.; Dol'nikova, T. V. Crystal structure of TbGe1.12-1.48Ga0.88-0.52 Inorganic Materials 35 (1999) 468-470
Space group: I 41/a m d
Cell volume: 235.23
Cell parameters: 4.1129; 4.1129; 13.906; 90; 90; 90;  

COD ID: 6000312
CIF file Formula: - Cu O4 Rh2 -
Comments: Ismunandar; Kennedy, B. J.; Hunter, B. A. Phase transformation in CuRh2O4: a powder neutron diffraction study Materials Research Bulletin 34 (1999) 135-143
Space group: I 41/a m d
Cell volume: 301.51
Cell parameters: 6.1707; 6.1707; 7.9183; 90; 90; 90;  

COD ID: 6000397
CIF file Formula: - H5 Ho O10 S2 -
Comments: Wickleder, M. S. Synthesis, crystal structure, and thermal behavior of the rare earth sulfates (H5O2)M(SO4)(2) (M = Ho, Er, Y) Chemistry of Materials 10 (1998) 3212-3216
Space group: I 41/a m d
Cell volume: 824.42
Cell parameters: 6.914; 6.914; 17.246; 90; 90; 90;  

COD ID: 6000398
CIF file Formula: - Er H5 O10 S2 -
Comments: Wickleder, M. S. Synthesis, crystal structure, and thermal behavior of the rare earth sulfates (H5O2)M(SO4)(2) (M = Ho, Er, Y) Chemistry of Materials 10 (1998) 3212-3216
Space group: I 41/a m d
Cell volume: 816.49
Cell parameters: 6.8967; 6.8967; 17.166; 90; 90; 90;  

COD ID: 6000399
CIF file Formula: - H5 O10 S2 Y -
Comments: Wickleder, M. S. Synthesis, crystal structure, and thermal behavior of the rare earth sulfates (H5O2)M(SO4)(2) (M = Ho, Er, Y) Chemistry of Materials 10 (1998) 3212-3216
Space group: I 41/a m d
Cell volume: 813.98
Cell parameters: 6.8875; 6.8875; 17.159; 90; 90; 90;  

COD ID: 6000716
CIF file Formula: - Bi2 Cd O4 -
Comments: Champarnaudmesjard, J. C.; Frit, B.; Aftati, A.; Elfarissi, M. Crystal-structure of Bi2CdO4 European Journal of Solid State and Inorganic Chemistry 31 (1994) 473-486
Space group: I 41/a m d
Cell volume: 1957.01
Cell parameters: 14.493; 14.493; 9.317; 90; 90; 90;  

COD ID: 7041020
CIF file Formula: - C56 H56 Fe2 N16 O8 W -
Comments: Wei, Rong-Min; Kong, Ming; Cao, Fan; Li, Jing; Pu, Tian-Cheng; Yang, Li; Zhang, Xiu-Ling; Song, You Water induced spin-crossover behaviour and magneto-structural correlation in octacyanotungstate(iv)-based iron(ii) complexes. Dalton transactions (Cambridge, England : 2003) 45(46) (2016) 18643-18652
Space group: I 41/a m d
Cell volume: 5658.8
Cell parameters: 20.2282; 20.2282; 13.8297; 90; 90; 90;  

COD ID: 7041023
CIF file Formula: - C56 H56 Fe2 N16 O8 W -
Comments: Wei, Rong-Min; Kong, Ming; Cao, Fan; Li, Jing; Pu, Tian-Cheng; Yang, Li; Zhang, Xiu-Ling; Song, You Water induced spin-crossover behaviour and magneto-structural correlation in octacyanotungstate(iv)-based iron(ii) complexes. Dalton transactions (Cambridge, England : 2003) 45(46) (2016) 18643-18652
Space group: I 41/a m d
Cell volume: 5922.7
Cell parameters: 20.173; 20.173; 14.554; 90; 90; 90;  

COD ID: 7043892
CIF file Formula: - C85 H119 Cu3 N15 O26 -
Comments: Wang, Peng; Chen, Kai; Liu, Qing; Wang, Huai-Wei; Azam, Mohammad; Al-Resayes, Saud I; Lu, Yi; Sun, Wei-Yin Fine tuning catalytic and sorption properties of metal-organic frameworks via in situ ligand exchange Dalton Trans. (2017)
Space group: I 41/a m d
Cell volume: 22864
Cell parameters: 19.387; 19.387; 60.831; 90; 90; 90;  

COD ID: 7043893
CIF file Formula: - C152 H184 Cu6 N20 O50 -
Comments: Wang, Peng; Chen, Kai; Liu, Qing; Wang, Huai-Wei; Azam, Mohammad; Al-Resayes, Saud I; Lu, Yi; Sun, Wei-Yin Fine tuning catalytic and sorption properties of metal-organic frameworks via in situ ligand exchange Dalton Trans. (2017)
Space group: I 41/a m d
Cell volume: 23181
Cell parameters: 19.627; 19.627; 60.175; 90; 90; 90;  

COD ID: 7043894
CIF file Formula: - C78 H112 Cu3 N12 O27 -
Comments: Wang, Peng; Chen, Kai; Liu, Qing; Wang, Huai-Wei; Azam, Mohammad; Al-Resayes, Saud I; Lu, Yi; Sun, Wei-Yin Fine tuning catalytic and sorption properties of metal-organic frameworks via in situ ligand exchange Dalton Trans. (2017)
Space group: I 41/a m d
Cell volume: 23633
Cell parameters: 20.009; 20.009; 59.029; 90; 90; 90;  

COD ID: 7043895
CIF file Formula: - C86 H114 Cu3 N14 O25 -
Comments: Wang, Peng; Chen, Kai; Liu, Qing; Wang, Huai-Wei; Azam, Mohammad; Al-Resayes, Saud I; Lu, Yi; Sun, Wei-Yin Fine tuning catalytic and sorption properties of metal-organic frameworks via in situ ligand exchange Dalton Trans. (2017)
Space group: I 41/a m d
Cell volume: 23380
Cell parameters: 19.73; 19.73; 60.06; 90; 90; 90;  

COD ID: 7043896
CIF file Formula: - C168 H232 Cu6 N28 O50 -
Comments: Wang, Peng; Chen, Kai; Liu, Qing; Wang, Huai-Wei; Azam, Mohammad; Al-Resayes, Saud I; Lu, Yi; Sun, Wei-Yin Fine tuning catalytic and sorption properties of metal-organic frameworks via in situ ligand exchange Dalton Trans. (2017)
Space group: I 41/a m d
Cell volume: 22970
Cell parameters: 19.511; 19.511; 60.34; 90; 90; 90;  

COD ID: 7043897
CIF file Formula: - C164 H226 Cu6 N30 O50 -
Comments: Wang, Peng; Chen, Kai; Liu, Qing; Wang, Huai-Wei; Azam, Mohammad; Al-Resayes, Saud I; Lu, Yi; Sun, Wei-Yin Fine tuning catalytic and sorption properties of metal-organic frameworks via in situ ligand exchange Dalton Trans. (2017)
Space group: I 41/a m d
Cell volume: 23018
Cell parameters: 19.525; 19.525; 60.38; 90; 90; 90;  

COD ID: 7045445
CIF file Formula: - C36 H40 Cl8 N4 O18 Ti4 -
Comments: Tong, Jing; Xu, Tingting; Liu, Shengjun; Zhang, Junxiang; Hou, Xudong; Liu, Bo Cascade Covalent and Coordination Bonds Formation for Ti-Based Cage Assembly: Catalysis and Coordination Bi-functions of TiCl4 Dalton Transactions (2018)
Space group: I 41/a m d
Cell volume: 5758.2
Cell parameters: 18.092; 18.092; 17.592; 90; 90; 90;  

COD ID: 7047327
CIF file Formula: - C4 H12 F5 N O4 U2 -
Comments: Yue, Zenghui; Lin, Jian; Silver, Mark Andrew; Han, Ling; Li, Xiaoyun; Zhou, Jing; Guo, Xiaojing; Bao, Hong-liang; Huang, Yuying; Wang, Jian-Qiang Anionic Uranyl Oxyfluorides as a Bifunctional Platform for Highly Selective Ion-Exchange and Photocatalytic Degradation of Organic Dyes Dalton Transactions (2018)
Space group: I 41/a m d
Cell volume: 1251.6
Cell parameters: 7.2721; 7.2721; 23.668; 90; 90; 90;  

COD ID: 7117613
CIF file Formula: - C8 H25 Ag6 Cl N16 O7 -
Comments: Zhou, Dong-Dong; Liu, Zhi-Juan; He, Chun-Ting; Liao, Pei-Qin; Zhou, Hao-Long; Zhong, Zhen-Song; Lin, Rui-Biao; Zhang, Wei-Xiong; Zhang, Jie-Peng; Chen, Xiao-Ming Controlling the flexibility and single-crystal to single-crystal interpenetration reconstitution of metal-organic frameworks. Chemical communications (Cambridge, England) 51(63) (2015) 12665-12668
Space group: I 41/a m d
Cell volume: 3025.4
Cell parameters: 29.5862; 29.5862; 3.4563; 90; 90; 90;  

COD ID: 7117615
CIF file Formula: - C12 H29 Ag6 Cl N12 O7 -
Comments: Zhou, Dong-Dong; Liu, Zhi-Juan; He, Chun-Ting; Liao, Pei-Qin; Zhou, Hao-Long; Zhong, Zhen-Song; Lin, Rui-Biao; Zhang, Wei-Xiong; Zhang, Jie-Peng; Chen, Xiao-Ming Controlling the flexibility and single-crystal to single-crystal interpenetration reconstitution of metal-organic frameworks. Chemical communications (Cambridge, England) 51(63) (2015) 12665-12668
Space group: I 41/a m d
Cell volume: 3050
Cell parameters: 29.415; 29.415; 3.525; 90; 90; 90;  

COD ID: 7117617
CIF file Formula: - C8 H25 Ag6 Br N16 O7 -
Comments: Zhou, Dong-Dong; Liu, Zhi-Juan; He, Chun-Ting; Liao, Pei-Qin; Zhou, Hao-Long; Zhong, Zhen-Song; Lin, Rui-Biao; Zhang, Wei-Xiong; Zhang, Jie-Peng; Chen, Xiao-Ming Controlling the flexibility and single-crystal to single-crystal interpenetration reconstitution of metal-organic frameworks. Chemical communications (Cambridge, England) 51(63) (2015) 12665-12668
Space group: I 41/a m d
Cell volume: 3065.9
Cell parameters: 29.6337; 29.6337; 3.4913; 90; 90; 90;  

COD ID: 7117619
CIF file Formula: - C12 H29 Ag6 Br N12 O7 -
Comments: Zhou, Dong-Dong; Liu, Zhi-Juan; He, Chun-Ting; Liao, Pei-Qin; Zhou, Hao-Long; Zhong, Zhen-Song; Lin, Rui-Biao; Zhang, Wei-Xiong; Zhang, Jie-Peng; Chen, Xiao-Ming Controlling the flexibility and single-crystal to single-crystal interpenetration reconstitution of metal-organic frameworks. Chemical communications (Cambridge, England) 51(63) (2015) 12665-12668
Space group: I 41/a m d
Cell volume: 3078
Cell parameters: 29.419; 29.419; 3.5564; 90; 90; 90;  

COD ID: 7118122
CIF file Formula: - C80 H76 Dy4 F12 N28 O44 S4 -
Comments: Jianfeng Wu; Lang Zhao; Mei Guo; Jinkui Tang Constructing supramolecular grids: from 4f square to 3d-4f grid Chem.Commun. 51 (2015) 17317
Space group: I 41/a m d
Cell volume: 17608
Cell parameters: 21.384; 21.384; 38.507; 90; 90; 90;  

COD ID: 7123375
CIF file Formula: - Cu12 Ga24 S70 Sn8 -
Comments: Zhang, Jiaxu; Wang, Xiang; Lv, Jing; Li, Dong-Sheng; Wu, Tao A multivalent mixed-metal strategy for single-Cu±ion-bridged cluster-based chalcogenide open frameworks for sensitive nonenzymatic detection on glucose Chemical Communications (2019)
Space group: I 41/a m d
Cell volume: 12008.3
Cell parameters: 25.2441; 25.2441; 18.8435; 90; 90; 90;  

COD ID: 7223867
CIF file Formula: - C24 H54 Co6 F12 N8 O43 -
Comments: Cai, Song-Liang; Zheng, Sheng-Run; Fan, Jun; Zeng, Rong-Hua; Zhang, Wei-Guang Two new three-dimensional metal‒organic frameworks with 4-connected diamondoid and unusual (6,16)-connected net topologies based on planar tetranuclear squares as secondary building units CrystEngComm 18(7) (2016) 1174
Space group: I 41/a m d
Cell volume: 12094
Cell parameters: 17.726; 17.726; 38.491; 90; 90; 90;  

COD ID: 7227517
CIF file Formula: - C6 H4 Co N6 O4 -
Comments: Orsi, Angelica; Price, David J.; Kahr, Jürgen; Pillai, Renjith S.; Sneddon, Scott; Cao, Shuai; Benoit, Virginie; Łozińska, Magdalena M.; Cordes, David B.; Slawin, Alexandra M. Z.; Llewellyn, Philip L.; Casely, Ian; Ashbrook, Sharon E.; Maurin, Guillaume; Wright, Paul A. Porous zinc and cobalt 2-nitroimidazolate frameworks with six-membered ring windows and a layered cobalt 2-nitroimidazolate polymorph CrystEngComm 19(10) (2017) 1377
Space group: I 41/a m d
Cell volume: 978
Cell parameters: 6.025; 6.025; 26.95; 90; 90; 90;  

COD ID: 7228086
CIF file Formula: - Ge13 Ir4 Lu3 -
Comments: Oswald, Iain W.H.; Rai, Binod K.; McCandless, Gregory T.; Morosan, Emilia; Chan, Julia The Proof is in the Powder: Revealing Structural Peculiarities in the Yb3Rh4Sn13 Structure Type CrystEngComm (2017)
Space group: I 41/a m d
Cell volume: 5623.9
Cell parameters: 17.764; 17.764; 17.822; 90; 90; 90;  

COD ID: 7228930
CIF file Formula: - C6 H7 N O -
Comments: Topić, Filip; Puttreddy, Rakesh; Rautiainen, J. Mikko; Tuononen, Heikki M.; Rissanen, Kari Tridentate C‒I⋯O−‒N+ halogen bonds CrystEngComm (2017)
Space group: I 41/a m d
Cell volume: 1228.7
Cell parameters: 7.92; 7.92; 19.588; 90; 90; 90;  

COD ID: 7231362
CIF file Formula: - C48 H40 Mo24 N16 O80 P2 Zn8 -
Comments: Peng, Hai-Yue; Yang, Xiao-Jian; Ma, Yuan-Yuan; Liu, Jia-Ning; Wang, Yong-Hui; Tan, Huaqiao; Li, Yang-Guang Polyoxometalate-based metal-organic framework loading with ultra-low amount of Pt as efficient electrocatalyst for hydrogen production CrystEngComm (2018)
Space group: I 41/a m d
Cell volume: 9124
Cell parameters: 27.56; 27.56; 12.012; 90; 90; 90;  

COD ID: 7231985
CIF file Formula: - C8 H4 Cu3 N16 Na O4 -
Comments: Lu, Jack; Zhang, Sheng; Wu, Shuo; Zhang, Wendou; Yang, Qi; Wei, Qing; Xie, Gang; Chen, Sanping; Gao, Sheng-li A 3D solvent-free energetic metal-organic framework (EMOF) achieved by removing inclusion molecules from a new coordination polymer CrystEngComm (2018)
Space group: I 41/a m d
Cell volume: 2125.6
Cell parameters: 13.638; 13.638; 11.428; 90; 90; 90;  


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