Crystallography Open Database

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Searching space group like 'P n a b'

COD ID: 1511986
CIF file Formula: - C3 H4 N2 -
Comments: Sikora, Magdalena; Katrusiak, Andrzej Pressure-Controlled Neutral‒Ionic Transition and Disordering of NH···N Hydrogen Bonds in Pyrazole The Journal of Physical Chemistry C 117(20) (2013) 10661
Space group: P n a b
Cell volume: 696.5
Cell parameters: 6.749; 12.599; 8.191; 90; 90; 90;  

COD ID: 1511987
CIF file Formula: - C3 H4 N2 -
Comments: Sikora, Magdalena; Katrusiak, Andrzej Pressure-Controlled Neutral‒Ionic Transition and Disordering of NH···N Hydrogen Bonds in Pyrazole The Journal of Physical Chemistry C 117(20) (2013) 10661
Space group: P n a b
Cell volume: 680.3
Cell parameters: 6.6851; 12.492; 8.146; 90; 90; 90;  

COD ID: 1511988
CIF file Formula: - C3 H4 N2 -
Comments: Sikora, Magdalena; Katrusiak, Andrzej Pressure-Controlled Neutral‒Ionic Transition and Disordering of NH···N Hydrogen Bonds in Pyrazole The Journal of Physical Chemistry C 117(20) (2013) 10661
Space group: P n a b
Cell volume: 663.2
Cell parameters: 6.612; 12.385; 8.099; 90; 90; 90;  

COD ID: 1511989
CIF file Formula: - C3 H4 N2 -
Comments: Sikora, Magdalena; Katrusiak, Andrzej Pressure-Controlled Neutral‒Ionic Transition and Disordering of NH···N Hydrogen Bonds in Pyrazole The Journal of Physical Chemistry C 117(20) (2013) 10661
Space group: P n a b
Cell volume: 635.9
Cell parameters: 6.45; 12.224; 8.0651; 90; 90; 90;  

COD ID: 1511990
CIF file Formula: - C3 H4 N2 -
Comments: Sikora, Magdalena; Katrusiak, Andrzej Pressure-Controlled Neutral‒Ionic Transition and Disordering of NH···N Hydrogen Bonds in Pyrazole The Journal of Physical Chemistry C 117(20) (2013) 10661
Space group: P n a b
Cell volume: 619.7
Cell parameters: 6.392; 12.04; 8.052; 90; 90; 90;  

COD ID: 1511991
CIF file Formula: - C3 H4 N2 -
Comments: Sikora, Magdalena; Katrusiak, Andrzej Pressure-Controlled Neutral‒Ionic Transition and Disordering of NH···N Hydrogen Bonds in Pyrazole The Journal of Physical Chemistry C 117(20) (2013) 10661
Space group: P n a b
Cell volume: 610.6
Cell parameters: 6.3573; 12.03; 7.984; 90; 90; 90;  

COD ID: 1511992
CIF file Formula: - C3 H4 N2 -
Comments: Sikora, Magdalena; Katrusiak, Andrzej Pressure-Controlled Neutral‒Ionic Transition and Disordering of NH···N Hydrogen Bonds in Pyrazole The Journal of Physical Chemistry C 117(20) (2013) 10661
Space group: P n a b
Cell volume: 563.9
Cell parameters: 6.147; 11.648; 7.876; 90; 90; 90;  

COD ID: 1511993
CIF file Formula: - C3 H4 N2 -
Comments: Sikora, Magdalena; Katrusiak, Andrzej Pressure-Controlled Neutral‒Ionic Transition and Disordering of NH···N Hydrogen Bonds in Pyrazole The Journal of Physical Chemistry C 117(20) (2013) 10661
Space group: P n a b
Cell volume: 547.7
Cell parameters: 6.0669; 11.554; 7.814; 90; 90; 90;  

COD ID: 1521873
CIF file Formula: - O9 P2 V2 -
Comments: Saito, T.; Terashima, T.; Utsumi, W.; Takano, M.; Azuma, M.; Goto, T.; Ohta, H.; Johnston, D.C.; Bordet, P. Single crystal growth of the high pressure phase of (V O)2 P2 O7 at 3 GPa Journal of Solid State Chemistry 153 (2000) 124-131
Space group: P n a b
Cell volume: 603.712
Cell parameters: 7.571; 9.536; 8.362; 90; 90; 90;  

COD ID: 1527329
CIF file Formula: - F3 K2 Mn O4 S -
Comments: Edwards, A.J. Fluoride crystal structures. Part XVIII. Dipotassium catena-mue-fluorodifluoro-mue-sulfatomanganate(III) Journal of the Chemical Society A: Inorganic, Physical, Theoretical (1966-1971) 1971 (1971) 3074-3076
Space group: P n a b
Cell volume: 660.707
Cell parameters: 7.26; 8.45; 10.77; 90; 90; 90;  

COD ID: 1537255
CIF file Formula: - K3 P11 -
Comments: von Schnering, H.G.; Kliche, G.; Somer, M.; Ohse, L.; Kempa, P.B.; Wolf, J.; Meyer, T.; Hoenle, W. Darstellung, Eigenschaften und Schwingungsspektren der Kaefiganionen P11(3-) und As11(3-) Zeitschrift fuer Anorganische und Allgemeine Chemie 601 (1991) 13-30
Space group: P n a b
Cell volume: 1502.62
Cell parameters: 10.315; 13.94; 10.45; 90; 90; 90;  

COD ID: 1537259
CIF file Formula: - As11 K3 -
Comments: von Schnering, H.G.; Somer, M.; Kliche, G.; Hoenle, W.; Meyer, T.; Kempa, P.B.; Wolf, J.; Ohse, L. Darstellung, Eigenschaften und Schwingungsspektren der Kaefiganionen P11(3-) und As11(3-) Zeitschrift fuer Anorganische und Allgemeine Chemie 601 (1991) 13-30
Space group: P n a b
Cell volume: 1679.74
Cell parameters: 10.596; 14.525; 10.914; 90; 90; 90;  

COD ID: 1537263
CIF file Formula: - As11 Rb3 -
Comments: von Schnering, H.G.; Somer, M.; Ohse, L.; Kliche, G.; Hoenle, W.; Meyer, T.; Wolf, J.; Kempa, P.B. Darstellung, Eigenschaften und Schwingungsspektren der Kaefiganionen P11(3-) und As11(3-) Zeitschrift fuer Anorganische und Allgemeine Chemie 601 (1991) 13-30
Space group: P n a b
Cell volume: 1820.07
Cell parameters: 10.628; 15.381; 11.134; 90; 90; 90;  

COD ID: 2003121
CIF file

Original IUCr paper

 Formula: - As F5 H K O -
Comments: Peterková, J.; Dusek, M.; Petrícek, V.; Loub, J. Structures of Fluoroarsenates KAsF~6<i>n~</i>(OH)~<i>n~</i>, <i>n</i> = 0, 1, 2: Application of the Heavy-Atom Method for Modulated Structures Acta Crystallographica Section B 54(6) (1998) 809-818
Space group: P n a b
Cell volume: 2999.2
Cell parameters: 9.391; 11.336; 28.173; 90; 90; 90;  

COD ID: 2015194
CIF file

HKL data

Original IUCr paper

 Formula: - C8 H6 Cs N4 O7.5 -
Comments: Nichol, Gary S.; Clegg, William Polymorphism in an unexpected caesium complex of 5-hydroxyhydurilic acid Acta Crystallographica Section C 61(10) (2005) m459-m462
Space group: P n a b
Cell volume: 2278.1
Cell parameters: 13.6671; 7.0632; 23.5991; 90; 90; 90;  

COD ID: 2016016
CIF file

HKL data

Original IUCr paper

 Formula: - Cd O6 V2 -
Comments: Belik, Alexei A.; Mironov, Andrei V.; Shpanchenko, Roman V.; Takayama-Muromachi, Eiji The high-pressure form of cadmium vanadate, CdV~2~O~6~ Acta Crystallographica Section C 63(7) (2007) i37-i39
Space group: P n a b
Cell volume: 399.39
Cell parameters: 4.9495; 5.6949; 14.1692; 90; 90; 90;  

COD ID: 2101862
CIF file

Original IUCr paper

 Formula: - C5 H8 N4 O5 -
Comments: Artioli, G.; Masciocchi, N.; Galli, E. The Elusive Crystal Structure of Uric Acid Dihydrate: Implication for Epitaxial Growth During Biomineralization Acta Crystallographica Section B 53(3) (1997) 498-503
Space group: P n a b
Cell volume: 823.3
Cell parameters: 7.409; 17.549; 6.332; 90; 90; 90;  

COD ID: 2227733
CIF file

HKL data

Original IUCr paper

 Formula: - C14 H18 Co N4 O8 -
Comments: Esmhosseini, Majid; Rezazadeh, Mahdokt Bis[(2-aminophenyl)methanol-κ^2^<i>N</i>,<i>O</i>]bis(nitrato-κ<i>O</i>)cobalt(II) Acta Crystallographica Section E 66(9) (2010) m1126
Space group: P n a b
Cell volume: 1715.3
Cell parameters: 7.2554; 10.1685; 23.25; 90; 90; 90;  

COD ID: 4331245
CIF file Formula: - C9 H8 Br N O -
Comments: Tommy Kenny; Simon Lamare; Shawkat M. Aly; Daniel Fortin; Gessie Brisard; Pierre D. Harvey Reduced and Oxidized Forms of the Pt-Organometallic Version of Polyaniline Inorganic Chemistry 51 (2012) 13081-13095
Space group: P n a b
Cell volume: 1866.9
Cell parameters: 7.174; 10.884; 23.91; 90; 90; 90;  

COD ID: 4346698
CIF file Formula: - C12 H10 Cl4 Cu N2 O7 -
Comments: Mei, Lei; Wu, Qun-yan; An, Shu-wen; Gao, Zeng-qiang; Chai, Zhi-fang; Shi, Wei-qun Silver Ion-Mediated Heterometallic Three-Fold Interpenetrating Uranyl-Organic Framework. Inorganic chemistry 54(22) (2015) 10934-10945
Space group: P n a b
Cell volume: 1989.9
Cell parameters: 6.923; 14.227; 20.203; 90; 90; 90;  

COD ID: 7011708
CIF file Formula: - C8 H16 Al K N2 O11 -
Comments: M. Kilyén; A. Lakatos; R. Latajka; I. Labádi; A. Salifoglou; C. P. Raptopoulou; H. Kozlowski; T. Kiss Al(III)-binding properties of iminodiacetic acid, nitrilotriacetic acid and their mixed carboxylic‒phosphonic derivatives J. Chem. Soc., Dalton Trans. (issue 18) (2002) 3578-3586
Space group: P n a b
Cell volume: 2958
Cell parameters: 15.352; 10.392; 18.54; 90; 90; 90;  

COD ID: 7117751
CIF file Formula: - C6 H6 S0.75 Se0.25 -
Comments: Sajesh P. Thomas; R. Sathishkumar; T. N. Guru Row Organic alloys of room temperature liquids thiophenol and selenophenol Chem.Commun. 51 (2015) 14255
Space group: P n a b
Cell volume: 1147.4
Cell parameters: 7.2109; 11.3897; 13.9705; 90; 90; 90;  

COD ID: 7117752
CIF file Formula: - C6 H6 Se -
Comments: Sajesh P. Thomas; R. Sathishkumar; T. N. Guru Row Organic alloys of room temperature liquids thiophenol and selenophenol Chem.Commun. 51 (2015) 14255
Space group: P n a b
Cell volume: 1186.6
Cell parameters: 7.329; 11.226; 14.422; 90; 90; 90;  

COD ID: 7117753
CIF file Formula: - C6 H6 S -
Comments: Sajesh P. Thomas; R. Sathishkumar; T. N. Guru Row Organic alloys of room temperature liquids thiophenol and selenophenol Chem.Commun. 51 (2015) 14255
Space group: P n a b
Cell volume: 1138.8
Cell parameters: 7.1905; 11.4643; 13.815; 90; 90; 90;  

COD ID: 7117754
CIF file Formula: - C6 H6 S0.57 Se0.43 -
Comments: Sajesh P. Thomas; R. Sathishkumar; T. N. Guru Row Organic alloys of room temperature liquids thiophenol and selenophenol Chem.Commun. 51 (2015) 14255
Space group: P n a b
Cell volume: 1168.9
Cell parameters: 7.2621; 11.371; 14.155; 90; 90; 90;  

COD ID: 7151886
CIF file Formula: - C12 H8 I2 N4 -
Comments: Chevallier, Floris; Halauko, Yury S.; Pecceu, Christelle; Nassar, Ibrahim F.; Dam, To Uyen; Roisnel, Thierry; Matulis, Vadim E.; Ivashkevich, Oleg A.; Mongin, Florence N-aryl pyrazoles: DFT calculations of CH acidity and deprotonative metallation using a combination of lithium and zinc amides Organic & Biomolecular Chemistry 9(12) (2011) 4671
Space group: P n a b
Cell volume: 1375.18
Cell parameters: 8.3852; 10.209; 16.0643; 90; 90; 90;  

COD ID: 7201909
CIF file Formula: - C8 H18 Cl N -
Comments: Laus, Gerhard; Bentivoglio, Gino; Kahlenberg, Volker; Griesser, Ulrich J.; Schottenberger, Herwig; Nauer, Gerhard Syntheses, crystal structures, and polymorphism of quaternary pyrrolidinium chlorides CrystEngComm 10(6) (2008) 748
Space group: P n a b
Cell volume: 1945
Cell parameters: 10.0354; 13.254; 14.6231; 90; 90; 90;  

COD ID: 7216040
CIF file Formula: - C42 H34 Cl2 N12 Ni O2 -
Comments: Mendiratta, Shruti; Usman, Muhammad; Luo, Tzuoo-Tsair; Lee, Shang-Fan; Lin, Ying-Chih; Lu, Kuang-Lieh Guest dependent dielectric properties of nickel(ii)-based supramolecular networks CrystEngComm 16(28) (2014) 6309
Space group: P n a b
Cell volume: 4003.25
Cell parameters: 12.2568; 15.712; 20.7876; 90; 90; 90;  

COD ID: 9005263
CIF file Formula: - Be2 Ca H6 Mn O17 Si5 -
Comments: Tazzoli, V.; Domeneghetti, M. C.; Mazzi, F.; Cannillo, E. The crystal structure of chiavennite European Journal of Mineralogy 7 (1995) 1339-1334
Space group: P n a b
Cell volume: 1340.7
Cell parameters: 8.729; 31.326; 4.903; 90; 90; 90;  


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