Crystallography Open Database

Result : There are 22 entries in the selection

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Searching space group like 'P 4/n n c'

COD ID: 1544898
CIF file Formula: - Al8.9 Ca18.6 Fe1.4 H2 Mg2.1 Mn0.3 O73 Si18.2 -
Comments: Yoshiasa, A.; Matsumoto, T. The crystal structure of vesuvianite from Nakatatsu mine: reinvestigation of the cation site-populations and of the hydroxyl groups Mineralogical Journal 13 (1986) 1-12
Space group: P 4/n n c
Cell volume: 2852
Cell parameters: 15.561; 15.561; 11.777; 90; 90; 90;  

COD ID: 1544899
CIF file Formula: - Al8.9 Ca18.6 Fe1.4 H2 Mg2.1 Mn0.3 O73 Si18.2 -
Comments: Yoshiasa, A.; Matsumoto, T. The crystal structure of vesuvianite from Nakatatsu mine: reinvestigation of the cation site-populations and of the hydroxyl groups Sample: reanalyzed data of Coda et al. (1970) Mineralogical Journal 13 (1986) 1-12
Space group: P 4/n n c
Cell volume: 2862.65
Cell parameters: 15.565; 15.565; 11.816; 90; 90; 90;  

COD ID: 4345568
CIF file Formula: - C80 H64 N22 O17 Zn6 -
Comments: Ma, Hui-Fang; Liu, Qing-Yan; Wang, Yu-Ling; Yin, Shun-Gao A Water-Stable Anionic Metal-Organic Framework Constructed from Columnar Zinc-Adeninate Units for Highly Selective Light Hydrocarbon Separation and Efficient Separation of Organic Dyes. Inorganic chemistry 56(5) (2017) 2919-2925
Space group: P 4/n n c
Cell volume: 14380.4
Cell parameters: 25.8389; 25.8389; 21.5389; 90; 90; 90;  

COD ID: 7029531
CIF file Formula: - C64 H54 B1.75 Cl0.25 F7 N6 O4 Pd S2 -
Comments: Frank, Marina; Krause, Lennard; Herbst-Irmer, Regine; Stalke, Dietmar; Clever, Guido H. Narcissistic self-sorting vs. statistic ligand shuffling within a series of phenothiazine-based coordination cages. Dalton transactions (Cambridge, England : 2003) 43(11) (2014) 4587-4592
Space group: P 4/n n c
Cell volume: 15379
Cell parameters: 21.991; 21.991; 31.8; 90; 90; 90;  

COD ID: 7033901
CIF file Formula: - C72 H84 Co4 N12 O16 P4 -
Comments: Gupta, Sandeep K.; Kuppuswamy, Subramaniam; Walsh, James P. S.; McInnes, Eric J. L.; Murugavel, Ramaswamy Discrete and polymeric cobalt organophosphates: isolation of a 3-D cobalt phosphate framework exhibiting selective CO2 capture. Dalton transactions (Cambridge, England : 2003) 44(12) (2015) 5587-5601
Space group: P 4/n n c
Cell volume: 10057
Cell parameters: 18.037; 18.037; 30.914; 90; 90; 90;  

COD ID: 7037055
CIF file Formula: - C21 H30 N O6 Zn -
Comments: Schwedler, Inke; Henke, Sebastian; Wharmby, Michael T.; Bajpe, Sneha R.; Cheetham, Anthony K.; Fischer, Roland A. Mixed-linker solid solutions of functionalized pillared-layer MOFs - adjusting structural flexibility, gas sorption, and thermal responsiveness. Dalton transactions (Cambridge, England : 2003) 45(10) (2016) 4230-4241
Space group: P 4/n n c
Cell volume: 4589.79
Cell parameters: 15.43134; 15.43134; 19.2746; 90; 90; 90;  

COD ID: 7038916
CIF file Formula: - C80 H48 B2 Ca F48 N8 -
Comments: Levason, William; Pugh, David; Purkis, Jamie M.; Reid, Gillian Complexes of Group 2 dications with soft thioether- and selenoether-containing macrocycles. Dalton transactions (Cambridge, England : 2003) 45(18) (2016) 7900-7911
Space group: P 4/n n c
Cell volume: 4526.8
Cell parameters: 15.691; 15.691; 18.386; 90; 90; 90;  

COD ID: 7038921
CIF file Formula: - C80 H48 B2 F48 N8 Sr -
Comments: Levason, William; Pugh, David; Purkis, Jamie M.; Reid, Gillian Complexes of Group 2 dications with soft thioether- and selenoether-containing macrocycles. Dalton transactions (Cambridge, England : 2003) 45(18) (2016) 7900-7911
Space group: P 4/n n c
Cell volume: 4619.2
Cell parameters: 15.892; 15.892; 18.29; 90; 90; 90;  

COD ID: 7044174
CIF file Formula: - C77.33 H85.6 Fe2.98 N16.67 Ni6.02 O26.8 -
Comments: Georgopoulou, Anastasia N.; Al-Ameed, Karrar; Boudalis, Athanassios; Anagnostopoulos, Dimitrios F.; Psycharis, Vassilis; McGrady, John E.; Sanakis, Yiannis; Raptopoulou, Catherine P. Site preferences in hetero-metallic [Fe9-xNix] clusters: a combined crystallographic, spectroscopic and theoretical analysis Dalton Trans. (2017)
Space group: P 4/n n c
Cell volume: 16277.1
Cell parameters: 25.3484; 25.3484; 25.3324; 90; 90; 90;  

COD ID: 7044175
CIF file Formula: - C77.33 H85.6 Fe1.54 N16.67 Ni7.46 O26.8 -
Comments: Georgopoulou, Anastasia N.; Al-Ameed, Karrar; Boudalis, Athanassios; Anagnostopoulos, Dimitrios F.; Psycharis, Vassilis; McGrady, John E.; Sanakis, Yiannis; Raptopoulou, Catherine P. Site preferences in hetero-metallic [Fe9-xNix] clusters: a combined crystallographic, spectroscopic and theoretical analysis Dalton Trans. (2017)
Space group: P 4/n n c
Cell volume: 16609.2
Cell parameters: 25.4547; 25.4547; 25.6338; 90; 90; 90;  

COD ID: 7044176
CIF file Formula: - C77.33 H85.6 Fe1.19 N16.67 Ni7.81 O26.8 -
Comments: Georgopoulou, Anastasia N.; Al-Ameed, Karrar; Boudalis, Athanassios; Anagnostopoulos, Dimitrios F.; Psycharis, Vassilis; McGrady, John E.; Sanakis, Yiannis; Raptopoulou, Catherine P. Site preferences in hetero-metallic [Fe9-xNix] clusters: a combined crystallographic, spectroscopic and theoretical analysis Dalton Trans. (2017)
Space group: P 4/n n c
Cell volume: 16496.6
Cell parameters: 25.4102; 25.4102; 25.5493; 90; 90; 90;  

COD ID: 7044177
CIF file Formula: - C77.33 H85.6 Fe9 N16.67 Ni0 O26.8 -
Comments: Georgopoulou, Anastasia N.; Al-Ameed, Karrar; Boudalis, Athanassios; Anagnostopoulos, Dimitrios F.; Psycharis, Vassilis; McGrady, John E.; Sanakis, Yiannis; Raptopoulou, Catherine P. Site preferences in hetero-metallic [Fe9-xNix] clusters: a combined crystallographic, spectroscopic and theoretical analysis Dalton Trans. (2017)
Space group: P 4/n n c
Cell volume: 16615
Cell parameters: 25.6264; 25.6264; 25.3002; 90; 90; 90;  

COD ID: 7044718
CIF file Formula: - C52 H40 Cl8 N12 Nb4 O8 -
Comments: pappuru, sreenath; Chakraborty, Debashis; V, Ramkumar Synthesis and Characterization of Benzotriazole or Benzoxazole Phenoxide Ligands Supported Nb and Ta Metal Complexes and their Application for the Synthesis of Hyperbranched Polyglycerols by Ring-Opening Polymerisation of Glycidol Dalton Transactions (2017)
Space group: P 4/n n c
Cell volume: 8410
Cell parameters: 20.028; 20.028; 20.966; 90; 90; 90;  

COD ID: 7115386
CIF file Formula: - C16 H40 K2 O Zn4 -
Comments: L. Zane Miller; Michael Shatruka; D. Tyler McQuade Alkali metal oxides trapped by diethylzinc Chem.Commun. 50 (2014) 8937
Space group: P 4/n n c
Cell volume: 1152.7
Cell parameters: 9.0272; 9.0272; 14.145; 90; 90; 90;  

COD ID: 7115387
CIF file Formula: - C16 H40 O Rb2 Zn4 -
Comments: L. Zane Miller; Michael Shatruka; D. Tyler McQuade Alkali metal oxides trapped by diethylzinc Chem.Commun. 50 (2014) 8937
Space group: P 4/n n c
Cell volume: 1266.9
Cell parameters: 9.446; 9.446; 14.199; 90; 90; 90;  

COD ID: 7118952
CIF file Formula: - C32 H24 Co N6 O4.25 -
Comments: Zhang, Hai-Rong; Huang, Ke-Bin; Chen, Zhen-Feng; Liu, Yan-Cheng; Liu, You-Nian; Meng, Ting; Qin, Qi-Pin; Zou, Bi-Qun; Liang, Hong Cobalt(ii) 8-hydroxyquinoline complexes: structure, cytotoxicity and action mechanism Med. Chem. Commun. 7(5) (2016) 806
Space group: P 4/n n c
Cell volume: 5514.7
Cell parameters: 17.9171; 17.9171; 17.1784; 90; 90; 90;  

COD ID: 7122980
CIF file Formula: - C148 H78 Cl28 -
Comments: Yang, Yu-Dong; Gong, Han-Yuan Heating Activated Isomeric All-hydrocarbon Molecular Receptors for Fullerene Separation Chemical Communications (2019)
Space group: P 4/n n c
Cell volume: 6848
Cell parameters: 23.643; 23.643; 12.25; 90; 90; 90;  

COD ID: 7155591
CIF file Formula: - C200 H152 N16 O40 Pd4 -
Comments: Sekiya, Ryo; Fukuda, Morihiko; Kuroda, Reiko Site-selective anion recognition of an interlocked dimer Org. Biomol. Chem. (2017)
Space group: P 4/n n c
Cell volume: 13680
Cell parameters: 18.9341; 18.9341; 38.159; 90; 90; 90;  

COD ID: 7155592
CIF file Formula: - C200 H160 N16 O40 Pd4 -
Comments: Sekiya, Ryo; Fukuda, Morihiko; Kuroda, Reiko Site-selective anion recognition of an interlocked dimer Org. Biomol. Chem. (2017)
Space group: P 4/n n c
Cell volume: 13754.4
Cell parameters: 18.9525; 18.9525; 38.292; 90; 90; 90;  

COD ID: 7224021
CIF file Formula: - C28 H26 K O15 Tb -
Comments: Li, Yun; Wang, Ning; Huang, Jie-Yi; Zhang, Fei-Hua; Xiong, Yan-Ju; Cheng, Qian; Fang, Jie-Fang; Zhu, Fei-Fei; Long, Yi; Yue, Shan-Tang KI-induced synthesis of highly connected 3D KI‒LnIIIheterobimetallic MOFs: temperature-dependent structure and physical properties CrystEngComm 18(9) (2016) 1570
Space group: P 4/n n c
Cell volume: 6364.1
Cell parameters: 15.513; 15.513; 26.445; 90; 90; 90;  

COD ID: 7224022
CIF file Formula: - C28 H26 Dy K O15 -
Comments: Li, Yun; Wang, Ning; Huang, Jie-Yi; Zhang, Fei-Hua; Xiong, Yan-Ju; Cheng, Qian; Fang, Jie-Fang; Zhu, Fei-Fei; Long, Yi; Yue, Shan-Tang KI-induced synthesis of highly connected 3D KI‒LnIIIheterobimetallic MOFs: temperature-dependent structure and physical properties CrystEngComm 18(9) (2016) 1570
Space group: P 4/n n c
Cell volume: 6180.6
Cell parameters: 15.322; 15.322; 26.327; 90; 90; 90;  

COD ID: 7225584
CIF file Formula: - C88 H128 Br7 I5 N8 O24 -
Comments: Pan, Fangfang; Beyeh, Ngong Kodiah; Ras, Robin H. A.; Rissanen, Kari N-Alkyl ammonium resorcinarene polyiodides CrystEngComm 18(30) (2016) 5724
Space group: P 4/n n c
Cell volume: 5663.1
Cell parameters: 12.3868; 12.3868; 36.9094; 90; 90; 90;  


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