Crystallography Open Database

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4106746 CIFC48 H74 F5 N Ni P2P m n 2113.9158; 16.9189; 9.782
90; 90; 90		2303.1Torsten Beweries; Lee Brammer; Naseralla A. Jasim; John E. McGrady; Robin N. Perutz; Adrian C. Whitwood
Energetics of Halogen Bonding of Group 10 Metal Fluoride Complexes
Journal of the American Chemical Society, 2011, 133, 14338-14348
4107402 CIFC102 H225 N9 O62 P2 W18P m n 2126.78; 15.516; 19.956
90; 90; 90		8292De-Liang Long; Carsten Streb; Yu-Fei Song; Scott Mitchell; Leroy Cronin
Unravelling the Complexities of Polyoxometalates in Solution Using Mass Spectrometry: Protonation versus Heteroatom Inclusion
Journal of the American Chemical Society, 2008, 130, 1830-1832
4112020 CIFC58 H50 N6 O Ti3P m n 2118.5416; 15.6225; 7.8136
90; 90; 90		2263.3Ingmar M. Piglosiewicz; Ruediger Beckhaus; Wolfgang Saak; Detlev Haase
Dehydroaromatization of Quinoxalines: One-Step Syntheses of Trinuclear 1,6,7,12,13,18-Hexaazatrinaphthylene Titanium Complexes
Journal of the American Chemical Society, 2005, 127, 14190-14191
4112247 CIFC1000 H1000 N500 O500P m n 2118.755; 32.165; 44.134
90; 90; 90		26624Young Ho Ko; Kyungpil Kim; Jin-Koo Kang; Hyungphil Chun; Jae Wook Lee; Shigeru Sakamoto; Kentaro Yamaguchi; James C. Fettinger; Kimoon Kim
Designed Self-Assembly of Molecular Necklaces Using Host-Stabilized Charge-Transfer Interactions
Journal of the American Chemical Society, 2004, 126, 1932-1933
4116439 CIFB H6 NP m n 215.395; 4.887; 4.986
90; 90; 90		131.46Wim T. Klooster; Thomas F. Koetzle; Per E. M. Siegbahn; Thomas B. Richardson; Robert H. Crabtree
Study of the N-H...H-B Dihydrogen Bond Including the Crystal Structure of BH3NH3 by Neutron Diffraction
Journal of the American Chemical Society, 1999, 121, 6337-6343
4118563 CIFGe16 K14 ZnP m n 2120.1357; 6.9934; 14.0398
90; 90; 90		1977.04Saskia Stegmaier; Markus Waibel; Alexander Henze; Laura-Alice Jantke; Antti J. Karttunen; Thomas F. Fässler
Soluble Zintl Phases A14ZnGe16 (A= K, Rb) Featuring [(η3-Ge4)Zn(η2-Ge4)]6- and [Ge4]4- Clusters and the Isolation of [(MesCu)2(η3,η3-Ge4)]4-: The Missing Link in the Solution Chemistry of Tetrahedral Group 14 Element Zintl Clusters
Journal of the American Chemical Society, 2012, 134, 14450-14460
4118564 CIFGe16 Rb14 ZnP m n 2120.8718; 7.2103; 14.4434
90; 90; 90		2173.62Saskia Stegmaier; Markus Waibel; Alexander Henze; Laura-Alice Jantke; Antti J. Karttunen; Thomas F. Fässler
Soluble Zintl Phases A14ZnGe16 (A= K, Rb) Featuring [(η3-Ge4)Zn(η2-Ge4)]6- and [Ge4]4- Clusters and the Isolation of [(MesCu)2(η3,η3-Ge4)]4-: The Missing Link in the Solution Chemistry of Tetrahedral Group 14 Element Zintl Clusters
Journal of the American Chemical Society, 2012, 134, 14450-14460
4124559 CIFC34 H44 F3 O P2 RhP m n 2115.142; 7.5379; 14.685
90; 90; 90		1676.1Esteruelas, Miguel A.; Oliván, Montserrat; Vélez, Andrea
Conclusive Evidence on the Mechanism of the Rhodium-Mediated Decyanative Borylation.
Journal of the American Chemical Society, 2015, 137, 12321-12329
4124739 CIFSb7 Zn8P m n 2115.0291; 7.731; 12.7431
90; 90; 90		1480.62Wang, Jian; Kovnir, Kirill
Elusive β-Zn8Sb7: A New Zinc Antimonide Thermoelectric.
Journal of the American Chemical Society, 2015, 137, 12474-12477
4125846 CIFC8 Cs9 F5 Mg6 O24P m n 2113.2888; 6.8258; 18.824
90; 90; 90		1707.5Tran, T. Thao; Young, Joshua; Rondinelli, James M.; Halasyamani, P. Shiv
Mixed-Metal Carbonate Fluorides as Deep-Ultraviolet Nonlinear Optical Materials.
Journal of the American Chemical Society, 2017, 139, 1285-1295
4126462 CIFC4 H11 N O2 SP m n 217.733; 6.629; 6.587
90; 90; 90		337.7Liniger, Marc; Liu, Yiyang; Stoltz, Brian M.
Sequential Ruthenium Catalysis for Olefin Isomerization and Oxidation: Application to the Synthesis of Unusual Amino Acids.
Journal of the American Chemical Society, 2017
4128249 CIFC43 H48 F6 Fe N7 O7 S2P m n 2113.5964; 9.6432; 17.6757
90; 90; 90		2317.5Drummond, Michael J.; Ford, Courtney L.; Gray, Danielle L.; Popescu, Codrina V.; Fout, Alison R.
Radical Rebound Hydroxylation Versus H-Atom Transfer in Non-Heme Iron(III)-Hydroxo Complexes: Reactivity and Structural Differentiation.
Journal of the American Chemical Society, 2019, 141, 6639-6650
4133096 CIFC37 H39 N3 O3P m n 2119.855; 5.3006; 15.6536
90; 90; 90		1647.4DeHaven, Baillie A.; Goodlett, Dustin W.; Sindt, Ammon J.; Noll, Niklas; De Vetta, Martina; Smith, Mark D.; Martin, Corey R.; González, Leticia; Shimizu, Linda S.
Enhancing the Stability of Photogenerated Benzophenone Triplet Radical Pairs through Supramolecular Assembly.
Journal of the American Chemical Society, 2018, 140, 13064-13070
4133232 CIFC34 H50 O4 YbP m n 2113.5501; 12.9804; 8.9048
90; 90; 90		1566.23Xémard, Mathieu; Zimmer, Sébastien; Cordier, Marie; Goudy, Violaine; Ricard, Louis; Clavaguéra, Carine; Nocton, Grégory
Lanthanidocenes: Synthesis, Structure, and Bonding of Linear Sandwich Complexes of Lanthanides.
Journal of the American Chemical Society, 2018, 140, 14433-14439
4134320 CIFBa0.5 F2 H O Te0.5P m n 217.5013; 8.6517; 4.2142
90; 90; 90		273.5Zhou, Jinjie; Wu, Hongping; Yu, Hongwei; Jiang, Shutong; Hu, Zhanggui; Wang, Jiyang; Wu, Yicheng; Halasyamani, P. Shiv
BaF<sub>2</sub>TeF<sub>2</sub>(OH)<sub>2</sub>: A UV Nonlinear Optical Fluorotellurite Material Designed by Band-Gap Engineering.
Journal of the American Chemical Society, 2020
4134465 CIFC4 H11 Cl4 N ZnP m n 217.1698; 14.6397; 10.3561
90; 90; 90		1087.01Chen, Lizhuang; Liao, Wei-Qiang; Ai, Yong; Li, Junyi; Deng, Siyu; Hou, Yunlong; Tang, Yuan-Yuan
Precise Molecular Design Toward Organic-Inorganic Zinc Chloride ABX<sub>3</sub> Ferroelectrics.
Journal of the American Chemical Society, 2020, 142, 6236-6243
4300701 CIFC18 H26 Hg2 I4 N2 S2P m n 2116.791; 10.85; 9.057
90; 90; 90		1650Inorganic Chemistry, 2006
4301763 CIFC44 H100 Cu2 N8 O8 S4P m n 2112.0698; 14.848; 8.2281
90; 90; 90		1474.6Kayla N. Green; Scott M. Brothers; Boram Lee; Marcetta Y. Darensbourg; David A. Rockcliffe
Chemical Issues Addressing the Construction of the Distal Ni[Cysteine-Glycine-Cysteine]2-Site of Acetyl CoA Synthase: Why Not Copper?
Inorganic Chemistry, 2009, 48, 2780-2792
4302973 CIFCd Ge Li2 S4P m n 217.7374; 6.8498; 6.3688
90; 90; 90		337.544Jonathan W. Lekse; Meghann A. Moreau; Katie L. McNerny; Jeongho Yeon; P. Shiv Halasyamani; Jennifer A. Aitken
Second-Harmonic Generation and Crystal Structure of the Diamond-like Semiconductors Li2CdGeS4 and Li2CdSnS4
Inorganic Chemistry, 2009, 48, 7516-7518
4302974 CIFCd Li2 S4 SnP m n 217.9555; 6.9684; 6.4886
90; 90; 90		359.71Jonathan W. Lekse; Meghann A. Moreau; Katie L. McNerny; Jeongho Yeon; P. Shiv Halasyamani; Jennifer A. Aitken
Second-Harmonic Generation and Crystal Structure of the Diamond-like Semiconductors Li2CdGeS4 and Li2CdSnS4
Inorganic Chemistry, 2009, 48, 7516-7518
4305380 CIFC3 H13 B10 IP m n 217.2615; 9.6534; 8.0861
90; 90; 90		566.82Gemma Barberà; Albert Vaca; Francesc Teixidor; Reijo Sillanpää; Raikko Kivekäs; Clara Viñas
Designed Synthesis of New ortho-Carborane Derivatives: from Mono- to Polysubstituted Frameworks
Inorganic Chemistry, 2008, 47, 7309-7316
4306282 CIFC6 H4 Ni O4 PP m n 215.54853; 14.3919; 4.79766
90; 90; 90		383.11Elvira M. Bauer; Carlo Bellitto; Guido Righini; Marcello Colapietro; Gustavo Portalone; Marc Drillon; Pierre Rabu
Comparison of the Structure and Magnetic Order in a Series of Layered Ni(II) Organophosphonates, Ni[(RPO3)(H2O)] (R = C6H5, CH3, C18H37)
Inorganic Chemistry, 2008, 47, 10945-10952
4308898 CIFC18 H18 B2 Cu F8 N4P m n 2111.4816; 13.517; 6.9302
90; 90; 90		1075.5Jason A. Aligo; Laura Smith; Judith L. Eglin; Laura E. Pence
Solution and Solid-State Variation of Cupric Phenanthroline Complexes
Inorganic Chemistry, 2005, 44, 4001-4007
4308900 CIFC16 H12 B2 Cl Cu F8 N4P m n 2111.3592; 13.2634; 6.9315
90; 90; 90		1044.3Jason A. Aligo; Laura Smith; Judith L. Eglin; Laura E. Pence
Solution and Solid-State Variation of Cupric Phenanthroline Complexes
Inorganic Chemistry, 2005, 44, 4001-4007
4309612 CIFAl Cl9 N3 P3P m n 2111.9974; 11.7111; 10.7768
90; 90; 90		1514.2Amy J. Heston; Matthew J. Panzner; Wiley J. Youngs; Claire A. Tessier
Lewis Acid Adducts of [PCl2N]3
Inorganic Chemistry, 2005, 44, 6518-6520
4309707 CIFCl12 Ga8 H2P m n 2114.193; 9.2745; 8.0839
90; 90; 90		1064.1Christina Y. Tang; Anthony J. Downs; Tim M. Greene; Sarah Marchant; Simon Parsons
Decomposition of Monochlorogallane, [H2GaCl]n, and Adducts with Amine and Phosphine Bases: Formation of Cationic Gallane Derivatives
Inorganic Chemistry, 2005, 44, 7143-7150
4310274 CIFC15 H6 Cu N7 SP m n 2122.993; 6.094; 5.3827
90; 90; 90		754.22Ping Lin; Richard A. Henderson; Ross W. Harrington; William Clegg; Chuan-De Wu; Xin-Tao Wu
New 1- and 2-Dimensional Polymeric Structures of Cyanopyridine Complexes of AgI and CuI
Inorganic Chemistry, 2004, 43, 181-188
4313341 CIFCs4 K O44 Si W11 YbP m n 2116.4189; 12.9208; 11.2991
90; 90; 90		2397.05Pierre Mialane; Laurent Lisnard; Alain Mallard; Jérôme Marrot; Elisabeth Antic-Fidancev; Patrick Aschehoug; Daniel Vivien; Francis Sécheresse
Solid-State and Solution Studies of {Lnn(SiW11O39)} Polyoxoanions: An Example of Building Block Condensation Dependent on the Nature of the Rare Earth
Inorganic Chemistry, 2003, 42, 2102-2108
4317253 CIFC40 H58 Co Cr O4P m n 2113.5754; 11.9152; 12.4276
90; 90; 90		2010.2Stanislav Groysman; Dino Villagrán; Daniel G. Nocera
Pseudotetrahedral d0, d1, and d2 Metal-Oxo Cores within a Tris(alkoxide) Platform
Inorganic Chemistry, 2010, 49, 10759-10761
4324147 CIFC7 H21 Ga N2P m n 219.2964; 9.0062; 6.5079
90; 90; 90		544.88Werner Uhl; Thomas Abel; Elke Hagemeier; Alexander Hepp; Marcus Layh; Babak Rezaeirad; Heinrich Luftmann
Oligonuclear Gallium Nitrogen Cage Compounds: Molecular Intermediates on the Way from Gallium Hydrazides to Gallium Nitride
Inorganic Chemistry, 2011, 50, 325-335
4324743 CIFC55.25 H50.5 F12 N10 O5 P2 Ru2P m n 2125.3428; 17.2004; 14.7026
90; 90; 90		6409Laia Francàs; Xavier Sala; Eduardo Escudero-Adán; Jordi Benet-Buchholz; Lluís Escriche; Antoni Llobet
Synthesis, Structure, and Reactivity of New Tetranuclear Ru-Hbpp-Based Water-Oxidation Catalysts
Inorganic Chemistry, 2011, 50, 2771-2781
4324789 CIFC6 N6 S3P m n 2114.2167; 3.681; 7.8017
90; 90; 90		408.28Alexander Yu. Makarov; Vladimir V. Zhivonitko; Arkady G. Makarov; Samat B. Zikirin; Irina Yu. Bagryanskaya; Victor A. Bagryansky; Yuri V. Gatilov; Irina G. Irtegova; Makhmut M. Shakirov; Andrey V. Zibarev
Interaction of 1,3,2,4-Benzodithiadiazines and Their 1-Se Congeners with Ph3P and Some Properties of the Iminophosphorane Products
Inorganic Chemistry, 2011, 50, 3017-3027
4326239 CIFAl Cl9 N3 P3P m n 2111.992; 11.713; 10.773
90; 90; 90		1513.2Zin-Min Tun; Amy J. Heston; Matthew J. Panzner; Doug A. Medvetz; Brian D. Wright; Deepa Savant; Venkat R. Dudipala; Debasish Banerjee; Peter L. Rinaldi; Wiley J. Youngs; Claire A. Tessier
Group 13 Lewis Acid Adducts of [PCl2N]3
Inorganic Chemistry, 2011, 50, 8937-8945
4326739 CIFC2 H5 Co O4 PP m n 215.66454; 9.82816; 4.79868
90; 90; 90		267.152Rosario M. P. Colodrero; Aurelio Cabeza; Pascual Olivera-Pastor; Duane Choquesillo-Lazarte; Juan M. Garcia-Ruiz; Adele Turner; Gheorghe Ilia; Bianca Maranescu; Konstantinos E. Papathanasiou; Gary B. Hix; Konstantinos D. Demadis; Miguel A. G. Aranda
Divalent Metal Vinylphosphonate Layered Materials: Compositional Variability, Structural Peculiarities, Dehydration Behavior, and Photoluminescent Properties
Inorganic Chemistry, 2011, 50, 11202-11211
4326740 CIFC2 H5 Ni O4 PP m n 215.59305; 9.80728; 4.74367
90; 90; 90		260.203Rosario M. P. Colodrero; Aurelio Cabeza; Pascual Olivera-Pastor; Duane Choquesillo-Lazarte; Juan M. Garcia-Ruiz; Adele Turner; Gheorghe Ilia; Bianca Maranescu; Konstantinos E. Papathanasiou; Gary B. Hix; Konstantinos D. Demadis; Miguel A. G. Aranda
Divalent Metal Vinylphosphonate Layered Materials: Compositional Variability, Structural Peculiarities, Dehydration Behavior, and Photoluminescent Properties
Inorganic Chemistry, 2011, 50, 11202-11211
4326741 CIFC2 H5 Cd O4 PP m n 215.92778; 9.94346; 5.0314
90; 90; 90		296.56Rosario M. P. Colodrero; Aurelio Cabeza; Pascual Olivera-Pastor; Duane Choquesillo-Lazarte; Juan M. Garcia-Ruiz; Adele Turner; Gheorghe Ilia; Bianca Maranescu; Konstantinos E. Papathanasiou; Gary B. Hix; Konstantinos D. Demadis; Miguel A. G. Aranda
Divalent Metal Vinylphosphonate Layered Materials: Compositional Variability, Structural Peculiarities, Dehydration Behavior, and Photoluminescent Properties
Inorganic Chemistry, 2011, 50, 11202-11211
4326745 CIFC2 H3 Fe O4 PP m n 215.7012; 9.778; 4.8049
90; 90; 90		267.86Rosario M. P. Colodrero; Aurelio Cabeza; Pascual Olivera-Pastor; Duane Choquesillo-Lazarte; Juan M. Garcia-Ruiz; Adele Turner; Gheorghe Ilia; Bianca Maranescu; Konstantinos E. Papathanasiou; Gary B. Hix; Konstantinos D. Demadis; Miguel A. G. Aranda
Divalent Metal Vinylphosphonate Layered Materials: Compositional Variability, Structural Peculiarities, Dehydration Behavior, and Photoluminescent Properties
Inorganic Chemistry, 2011, 50, 11202-11211
4326746 CIFC2 H5 O4 P ZnP m n 215.67; 9.708; 4.7747
90; 90; 90		262.82Rosario M. P. Colodrero; Aurelio Cabeza; Pascual Olivera-Pastor; Duane Choquesillo-Lazarte; Juan M. Garcia-Ruiz; Adele Turner; Gheorghe Ilia; Bianca Maranescu; Konstantinos E. Papathanasiou; Gary B. Hix; Konstantinos D. Demadis; Miguel A. G. Aranda
Divalent Metal Vinylphosphonate Layered Materials: Compositional Variability, Structural Peculiarities, Dehydration Behavior, and Photoluminescent Properties
Inorganic Chemistry, 2011, 50, 11202-11211
4330274 CIFLi6 Mo6 O33 Se6P m n 218.2687; 16.6546; 19.2321
90; 90; 90		2648.5Sau Doan Nguyen; P. Shiv Halasyamani
Synthesis, Structure, and Characterization of New Li± d0-Lone-Pair - Oxides: Noncentrosymmetric Polar Li6(Mo2O5)3(SeO3)6and Centrosymmetric Li2(MO3)(TeO3) (M = Mo6+or W6+)
Inorganic Chemistry, 2012, 51, 9529-9538
4332239 CIFC90.45 H83.9 Ag2 Cl0.7 F12 N4 O1.5 P6P m n 2118.7319; 18.51; 25.8368
90; 90; 90		8958.3Lin, Ronger; Yip, John H. K.
Self-Assembly, Structures, and Solution Dynamics of Emissive Silver Metallacycles and Helices
Inorganic Chemistry, 2006, 45, 4423-4430
4332630 CIFC16 H24 N6 O4 P2 WP m n 2121.2016; 7.05; 6.7642
90; 90; 90		1011.05Wong, Gene W.; Harkreader, Jennifer L.; Mebi, Charles A.; Frost, Brian J.
Synthesis and Coordination Chemistry of a Novel Bidentate Phosphine: 6-(Diphenylphosphino)-1,3,5-triaza-7-phosphaadamantane (PTA-PPh2)
Inorganic Chemistry, 2006, 45, 6748-6755
4332683 CIFC12 H32 K4 O46 Ru2 Si W10P m n 2113.6702; 16.2419; 12.1397
90; 90; 90		2695.38Bi, Li-Hua; Chubarova, Elena V.; Nsouli, Nadeen H.; Dickman, Michael H.; Kortz, Ulrich; Keita, Bineta; Nadjo, Louis
Dilacunary Decatungstates Functionalized by Organometallic Ruthenium(II), [{Ru(C6H6)(H2O)}{Ru(C6H6)}(γ-XW10O36)]4-(X = Si, Ge)
Inorganic Chemistry, 2006, 45, 8575-8583
4332684 CIFC12 H28 Ge K4 O44 Ru2 W10P m n 2113.6684; 16.297; 12.1607
90; 90; 90		2708.8Bi, Li-Hua; Chubarova, Elena V.; Nsouli, Nadeen H.; Dickman, Michael H.; Kortz, Ulrich; Keita, Bineta; Nadjo, Louis
Dilacunary Decatungstates Functionalized by Organometallic Ruthenium(II), [{Ru(C6H6)(H2O)}{Ru(C6H6)}(γ-XW10O36)]4-(X = Si, Ge)
Inorganic Chemistry, 2006, 45, 8575-8583
4335494 CIFC28 H44 FeP m n 2111.771; 10.0996; 9.7652
90; 90; 90		1160.91Richard A. Lewis; Danil E. Smiles; Jonathan M. Darmon; S. Chantal E. Stieber; Guang Wu; Trevor W. Hayton
Reactivity and Mössbauer Spectroscopic Characterization of an Fe(IV) Ketimide Complex and Reinvestigation of an Fe(IV) Norbornyl Complex
Inorganic Chemistry, 2013, 52, 8218-8227
4336644 CIFBr0.17 I1.67 O3.17 Pb3.83P m n 2111.0697; 15.5603; 16.1335
90; 90; 90		2779Oleg I. Siidra; Diana O. Zinyakhina; Anastasiya I. Zadoya; Sergey V. Krivovichev; Rick W. Turner
Synthesis and Modular Structural Architectures of Mineralogically Inspired Novel Complex Pb Oxyhalides
Inorganic Chemistry, 2013, 52, 12799-12805
4337059 CIFC73 H53 Cd Cl5 N16 Pd2P m n 2130.0402; 8.9013; 13.5698
90; 90; 90		3628.5Antoine Béziau; Stéphane A. Baudron; Audrey Fluck; Mir Wais Hosseini
From Sequential to One-Pot Synthesis of Dipyrrin Based Grid-Type Mixed Metal-Organic Frameworks
Inorganic Chemistry, 2013, 52, 14439-14448
4337144 CIFB3 H8 NaP m n 217.8497; 5.8106; 4.5754
90; 90; 90		208.691Dunbar, Andrew C.; Macor, Joseph A.; Girolami, Gregory S.
Synthesis and Single Crystal Structure of Sodium Octahydrotriborate, NaB3H8.
Inorganic chemistry, 2014, 53, 822-826
4337509 CIFBr2 F21 K10 Mo6 O12P m n 2120.079; 7.758; 11.4836
90; 90; 90		1788.83Holland, Michael; Donakowski, Martin D.; Pozzi, Eric A.; Rasmussen, Andrew M.; Tran, Thanh Thao; Pease-Dodson, Shannon E; Halasyamani, P. Shiv; Seideman, Tamar; Van Duyne, Richard P.; Poeppelmeier, Kenneth R.
Polar alignment of Λ-shaped basic building units within transition metal oxide fluoride materials.
Inorganic chemistry, 2014, 53, 221-228
4337510 CIFBr2 F27 K10 Nb6 O6P m n 2120.0779; 7.7588; 11.4828
90; 90; 90		1788.8Holland, Michael; Donakowski, Martin D.; Pozzi, Eric A.; Rasmussen, Andrew M.; Tran, Thanh Thao; Pease-Dodson, Shannon E; Halasyamani, P. Shiv; Seideman, Tamar; Van Duyne, Richard P.; Poeppelmeier, Kenneth R.
Polar alignment of Λ-shaped basic building units within transition metal oxide fluoride materials.
Inorganic chemistry, 2014, 53, 221-228
4337512 CIFBr F27 K10 Nb6 O6P m n 2120.1125; 7.7382; 11.4797
90; 90; 90		1786.64Holland, Michael; Donakowski, Martin D.; Pozzi, Eric A.; Rasmussen, Andrew M.; Tran, Thanh Thao; Pease-Dodson, Shannon E; Halasyamani, P. Shiv; Seideman, Tamar; Van Duyne, Richard P.; Poeppelmeier, Kenneth R.
Polar alignment of Λ-shaped basic building units within transition metal oxide fluoride materials.
Inorganic chemistry, 2014, 53, 221-228
4337513 CIFF21 I2 K10 Mo6 O12P m n 2120.072; 7.7549; 11.4644
90; 90; 90		1784.51Holland, Michael; Donakowski, Martin D.; Pozzi, Eric A.; Rasmussen, Andrew M.; Tran, Thanh Thao; Pease-Dodson, Shannon E; Halasyamani, P. Shiv; Seideman, Tamar; Van Duyne, Richard P.; Poeppelmeier, Kenneth R.
Polar alignment of Λ-shaped basic building units within transition metal oxide fluoride materials.
Inorganic chemistry, 2014, 53, 221-228
4337514 CIFCl2 F42.02 K20 Mo12 O24P m n 2119.907; 7.7643; 11.2139
90; 90; 90		1733.3Holland, Michael; Donakowski, Martin D.; Pozzi, Eric A.; Rasmussen, Andrew M.; Tran, Thanh Thao; Pease-Dodson, Shannon E; Halasyamani, P. Shiv; Seideman, Tamar; Van Duyne, Richard P.; Poeppelmeier, Kenneth R.
Polar alignment of Λ-shaped basic building units within transition metal oxide fluoride materials.
Inorganic chemistry, 2014, 53, 221-228
4337516 CIFF27 I2 K10 Nb6 O6P m n 2120.3471; 7.8376; 11.6367
90; 90; 90		1855.73Holland, Michael; Donakowski, Martin D.; Pozzi, Eric A.; Rasmussen, Andrew M.; Tran, Thanh Thao; Pease-Dodson, Shannon E; Halasyamani, P. Shiv; Seideman, Tamar; Van Duyne, Richard P.; Poeppelmeier, Kenneth R.
Polar alignment of Λ-shaped basic building units within transition metal oxide fluoride materials.
Inorganic chemistry, 2014, 53, 221-228
4338983 CIFC3 H6 O3 P2P m n 218.389; 5.7804; 6.4204
90; 90; 90		311.34Thirupathi, Natesan; Stricklen, Phillip M.; Liu, Xiaodong; Oshel, Reed; Guzei, Ilia; Ellern, Arkady; Verkade, John G.
Comparisons of phosphorus ligation properties in P(CH2NR)3P.
Inorganic chemistry, 2007, 46, 9351-9363
4341693 CIFC19 H36 O7 TiP m n 2115.9892; 8.1331; 9.2864
90; 90; 90		1207.62Boyle, Timothy J.; Yonemoto, Daniel T.; Doan, Thu Q.; Alam, Todd M.
Synthesis and Structural Characterization of Group 4 Metal Carboxylates for Nanowire Production.
Inorganic chemistry, 2014, 141117102556003
4341831 CIFMo2 O266 P16 U44P m n 2129.395; 25.5532; 27.939
90; 90; 90		20986Ling, Jie; Hobbs, Franklin; Prendergast, Steven; Adelani, Pius O.; Babo, Jean-Marie; Qiu, Jie; Weng, Zhehui; Burns, Peter C.
Hybrid Uranium-Transition-Metal Oxide Cage Clusters.
Inorganic chemistry, 2014, 141201075026001
4342324 CIFAl3 Ca2 Na11 Sb8P m n 2118.969; 8.8533; 7.9304
90; 90; 90		1331.82Wang, Yi; Stoyko, Stanislav; Bobev, Svilen
Quaternary Pnictides with Complex, Noncentrosymmetric Structures. Synthesis and Structural Characterization of the New Zintl Phases Na11Ca2Al3Sb8, Na4CaGaSb3, and Na15Ca3In5Sb12.
Inorganic chemistry, 2015, 54, 1931-1939
4344218 CIFI2 ZrP m n 213.7442; 6.831; 14.886
90; 90; 90		380.734Corbett, J.D.; Guthrie, D.H.
A Second Infinite-Chain Form of Zirconium Diiodide (beta) and Its Coherent Intergrowth with alpha-Zirconium Diiodide
Inorganic Chemistry, 1982, 21, 1747-1751
4344748 CIFC48 H36 Fe6 O36P m n 2110.5869; 19.5108; 11.8159
90; 90; 90		2440.68Krap, Cristina P.; Newby, Ruth; Dhakshinamoorthy, Amarajothi; García, Hermenegildo; Cebula, Izabela; Easun, Timothy L.; Savage, Mathew; Eyley, Jennifer E.; Gao, Shan; Blake, Alexander J.; Lewis, William; Beton, Peter H.; Warren, Mark R.; Allan, David R.; Frogley, Mark D.; Tang, Chiu C.; Cinque, Gianfelice; Yang, Sihai; Schröder, Martin
Enhancement of CO2 Adsorption and Catalytic Properties by Fe-Doping of [Ga2(OH)2(L)] (H4L = Biphenyl-3,3',5,5'-tetracarboxylic Acid), MFM-300(Ga2).
Inorganic chemistry, 2016, 55, 1076-1088
4345040 CIFC26 H42 B N10 TiP m n 2111.634; 8.1814; 15.62
90; 90; 90		1486.7Brown, Andrew; Saber, Mohamed; Van den Heuvel, Willem; Schulte, Kelsey; Soncini, Alessandro; Dunbar, Kim R.
Titanium(III) Member of the Family of Trigonal Building Blocks with Scorpionate and Cyanide Ligands.
Inorganic chemistry, 2017, 56, 1031-1035
4347140 CIFC27 H36 Fe2 N6 S2P m n 2116.3918; 11.3097; 8.0218
90; 90; 90		1487.13Zhou, Xiaoyuan; Barton, Bryan E.; Chambers, Geoffrey M.; Rauchfuss, Thomas B.; Arrigoni, Federica; Zampella, Giuseppe
Preparation and Protonation of Fe2(pdt)(CNR)6, Electron-Rich Analogues of Fe2(pdt)(CO)6.
Inorganic chemistry, 2016, 55, 3401-3412
4350528 CIFC4 H7 Cu1.5 F N6 O1.5P m n 218.9307; 12.8226; 7.9821
90; 90; 90		914.07Ouellette, Wayne; Prosvirin, Andrey V.; Chieffo, Vincent; Dunbar, Kim R.; Hudson, Bruce; Zubieta, Jon
Solid-state coordination chemistry of the Cu/triazolate/X system (X = F-, Cl-, Br-, I-, OH-, and SO4(2-)).
Inorganic chemistry, 2006, 45, 9346-9366
4509224 CIFBa Ga4 S7P m n 2114.755; 6.228; 5.929
90; 90; 90		544.8Lin, Xinsong; Zhang, Ge; Ye, Ning
Growth and Characterization of BaGa4S7: A New Crystal for Mid-IR Nonlinear Optics
Crystal Growth & Design, 2009, 9, 1186
4511722 CIFC7 H14 Br2 O3P m n 2112.016; 10.6738; 4.4634
90; 90; 90		572.46Yufit, D. S.; Shishkin, O. V.; Zubatyuk, R. I.; Howard, J. A. K.
Trimethyltrioxane (Paraldehyde) and Its Halomethanes Complexes: Crystallization, Structures, and Analysis of Packing Motifs
Crystal Growth & Design, 2014, 14, 4303
4511723 CIFC7 H14 Cl2 O3P m n 2111.703; 10.49; 4.4154
90; 90; 90		542.05Yufit, D. S.; Shishkin, O. V.; Zubatyuk, R. I.; Howard, J. A. K.
Trimethyltrioxane (Paraldehyde) and Its Halomethanes Complexes: Crystallization, Structures, and Analysis of Packing Motifs
Crystal Growth & Design, 2014, 14, 4303
4514644 CIFC48 H60 Co Li N2 OP m n 2117.4715; 10.5472; 10.9763
90; 90; 90		2022.66Sandl, Sebastian; Maier, Thomas M.; van Leest, Nicolaas P.; Kröncke, Susanne; Chakraborty, Uttam; Demeshko, Serhiy; Koszinowski, Konrad; de Bruin, Bas; Meyer, Franc; Bodensteiner, Michael; Herrmann, Carmen; Wolf, Robert; Jacobi von Wangelin, Axel
Cobalt-Catalyzed Hydrogenations via Olefin Cobaltate and Hydride Intermediates
ACS Catalysis, 2019, 9, 7596
6000033 CIFAg Cd2 Ga S4P m n 218.146; 6.8989; 6.5932
90; 90; 90		370.53Chykhrij, S. I.; Parasyuk, O. V.; Halka, V. O.
Crystal structure of the new quaternary phase AgCd2GaS4 and phase diagram of the quasi-binary system AgGaS2-CdS
Journal of Alloys and Compounds, 2000, 312, 189-195
6000692 CIFAg7 S6 TaP m n 217.442; 7.403; 10.531
90; 90; 90		580.19Onoda, M.; Wada, H.; Yukino, K.; Ishii, M.
Powder X-ray-diffraction of low-temperature phases of Argyrodite-family compound AG7TAS6
Solid State Ionics, 1995, 79, 75-80
7006461 CIFC6 H7 Co O4 PP m n 215.6238; 14.391; 4.8615
90; 90; 90		393.45Salami, T. O.; Fan, X.; Zavalij, P. Y.; Oliver, S. R. J.
Hydrothermal synthesis and characterization of a layered cobalt phenylphosphonate, Co(PhPO3)(H2O).
Dalton transactions (Cambridge, England : 2003), 2006, 1574-1578
7011031 CIFC12 H18 Ag N5 O3 SP m n 216.562; 13.342; 8.555
90; 90; 90		749Shao-Liang Zheng; Ming-Liang Tong; Xiao-Ming Chen; Seik Weng Ng
Self-assembly of new three-dimensional molecular architectures constructed from silver(I)‒hexamethylenetetramine layers with supramolecular interactions
J. Chem. Soc., Dalton Trans., 2002, 360-364
7011847 CIFC14 H8 Fe N8P m n 2111.5198; 17.0112; 8.6659
90; 90; 90		1698.22Jensen, Paul; Batten, Stuart R.; Moubaraki, Boujemaa; Murray, Keith S.
Syntheses, crystal structures, and magnetic properties of first row transition metal coordination polymers containing dicyanamide and 4,4???-bipyridineElectronic supplementary information (ESI) available: atom numbering diagrams for compounds 1 (123 K and 294 K) and 7???11. See http://www.rsc.org/suppdata/dt/b2/b205007b/
Journal of the Chemical Society, Dalton Transactions, 2002, 3712
7015272 CIFC6 H15 Cl2 Co N4 O14P m n 2112.923; 6.542; 10.446
90; 90; 90		883.1Caballero, Ana B.; Rodríguez-Diéguez, Antonio; Lezama, Luis; Barea, Elisa; Salas, Juan M.
Structural and magnetic properties of three novel complexes with the versatile ligand 5-methyl-1,2,4-triazolo[1,5-a]pyrimidin-7(4H)-one.
Dalton transactions (Cambridge, England : 2003), 2011, 40, 5180-5187
7015804 CIFC15 H8 F2 OP m n 2124.758; 3.7984; 6.0626
90; 90; 90		570.13Chotima, Ratanon; Dale, Tim; Green, Michael; Hey, Thomas W.; McMullin, Claire L.; Nunns, Adam; Guy Orpen, A.; Shishkov, Igor V.; Wass, Duncan F.; Wingad, Richard L.
Cyclopropenylidene carbene ligands in palladium catalysed coupling reactions: carbene ligand rotation and application to the Stille reaction.
Dalton transactions (Cambridge, England : 2003), 2011, 40, 5316-5323
7015830 CIFC40 H38 Cl F6 N3 Ni P3P m n 2121.7288; 7.6413; 11.6265
90; 90; 90		1930.42Cariou, Renan; Dahcheh, Fatme; Graham, Todd W.; Stephan, Douglas W.
Mononuclear and dinuclear palladium and nickel complexes of phosphinimine-based tridentate ligands.
Dalton transactions (Cambridge, England : 2003), 2011, 40, 4918-4925
7016623 CIFC140 H120 B8 F32 N40 Ni4 S6P m n 2143.1698; 18.8181; 20.4261
90; 90; 90		16593.6Stephenson, Andrew; Ward, Michael D.
Molecular squares, cubes and chains from self-assembly of bis-bidentate bridging ligands with transition metal dications.
Dalton transactions (Cambridge, England : 2003), 2011, 40, 10360-10369
7018497 CIFC29 H40 Cl2 Co N6 O3P m n 2116.4879; 9.9059; 9.463
90; 90; 90		1545.57Matsumoto, Jun; Suzuki, Tatsuya; Kajita, Yuji; Masuda, Hideki
Synthesis and characterization of cobalt(ii) complexes with tripodal polypyridine ligand bearing pivalamide groups. Selective formation of six- and seven-coordinate cobalt(ii) complexes.
Dalton transactions (Cambridge, England : 2003), 2012, 41, 4107-4117
7021867 CIFFe Li2 O4 SiP m n 216.27758; 5.35136; 4.97208
90; 90; 90		167.03Yabuuchi, Naoaki; Yamakawa, Yuto; Yoshii, Kazuhiro; Komaba, Shinichi
Low-temperature phase of Li2FeSiO4: crystal structure and a preliminary study of electrochemical behavior.
Dalton transactions (Cambridge, England : 2003), 2011, 40, 1846-1848
7022771 CIFC12 H24 F6 N O9 P PbP m n 2112.958; 8.475; 9.296
90; 90; 90		1020.9Farina, Paolo; Latter, Thomas; Levason, William; Reid, Gillian
Lead(II) tetrafluoroborate and hexafluorophosphate complexes with crown ethers, mixed O/S- and O/Se-donor macrocycles and unusual [BF(4)](-) and [PF(6)](-) coordination.
Dalton transactions (Cambridge, England : 2003), 2013, 42, 4714-4724
7025973 CIFC48 H75 F4 N P2 PdP m n 2113.9664; 16.9951; 9.6839
90; 90; 90		2298.6Breyer, David; Braun, Thomas; Penner, Anna
Isolation and reactivity of palladium hydrido complexes: intermediates in the hydrodefluorination of pentafluoropyridine.
Dalton transactions (Cambridge, England : 2003), 2010, 39, 7513-7520
7026805 CIFC12.5 H8 Cu2 N2 O10.5P m n 2112.0693; 11.0441; 10.9609
90; 90; 90		1461.03Yang, En-Cui; Liu, Zheng-Yu; Liu, Zhong-Yi; Zhao, Li-Na; Zhao, Xiao-Jun
Long-range ferromagnetic ordering in a 3D Cu(II)-tetracarboxylate framework assisted by an unprecedented bidentate μ2-O1,N4 hypoxanthine nucleobase.
Dalton transactions (Cambridge, England : 2003), 2010, 39, 8868-8871
7027685 CIFC7 H18 Cl10 N4 SeP m n 2113.974; 7.633; 10.23
90; 90; 90		1091.2Boyle, Philip D.; Godfrey, Stephen M.; Pritchard, Robin G.
The reaction of N-methylbenzothiazole-2-selone and 1,1-dimethylselenourea with sulfuryl chloride and dichlorine †
Journal of the Chemical Society, Dalton Transactions, 1999, 4245
7030284 CIFC2 H4 Ba O6 S2P m n 216.259; 8.266; 7.411
90; 90; 90		383.42Abdollahian, Yashar; Hauser, Jesse L.; Rogow, David L.; Oliver, Allen G.; Oliver, Scott R. J.
Solvothermal synthesis and characterization of two inorganic-organic hybrid materials based on barium.
Dalton transactions (Cambridge, England : 2003), 2012, 41, 12630-12634
7035628 CIFO7 S Te2P m n 218.8798; 6.937; 4.6535
90; 90; 90		286.652Ahmed, M.A.K.; Kjekshus, A.; Fjellvag, H.
Synthesis, structure and thermal stability of tellurium oxides and oxide sulfate formed from reactions in refluxing sulfuric acid
Journal of the Chemical Society. Dalton Transactions (2000- ), 2000, 2000, 4542-4549
7036771 CIFB2 K O6 SbP m n 217.1133; 3.6883; 9.4096
90; 90; 90		246.87Zhao, Dan; Zhang, Rong-Hua; Li, Fei-Fei; Yang, Juan; Liu, Bing-Guo; Fan, Yun-Chang
(3 + 1)-Dimensional commensurately modulated structure and photoluminescence properties of diborate KSbOB2O5.
Dalton transactions (Cambridge, England : 2003), 2015, 44, 6277-6287
7039322 CIFC3 H3 I2 N3P m n 2111.4559; 4.1982; 7.7048
90; 90; 90		370.56Chand, Deepak; He, Chunlin; Hooper, Joseph P.; Mitchell, Lauren A.; Parrish, Damon A.; Shreeve, Jean'ne M.
Mono- and diiodo-1,2,3-triazoles and their mono nitro derivatives.
Dalton transactions (Cambridge, England : 2003), 2016, 45, 9684-9688
7040825 CIFC6 H7 Cu O4 PP m n 215.65908; 14.3406; 4.79644
90; 90; 90		389.25Wilke, Manuel; Kabelitz, Anke; Gorelik, Tatiana E.; Buzanich, Ana Guilherme; Reinholz, Uwe; Kolb, Ute; Rademann, Klaus; Emmerling, Franziska
The crystallisation of copper(ii) phenylphosphonates.
Dalton transactions (Cambridge, England : 2003), 2016, 45, 17453-17463
7041891 CIFC23 H15 O14 Zn3P m n 2120.137; 10.702; 11.418
90; 90; 90		2461Wu, Xue-Qian; Huang, Dan-Dan; Zhou, Zhi-Hang; Dong, Wen-Wen; Wu, Ya-Pan; Zhao, Jun; Li, Dong-Sheng; Zhang, Qichun; Bu, Xianhui
Ag-NPs embedded in two novel Zn3/Zn5-cluster-based metal-organic frameworks for catalytic reduction of 2/3/4-nitrophenol.
Dalton transactions (Cambridge, England : 2003), 2017, 46, 2430-2438
7043233 CIFB18 Ba4 H30 O46P m n 2110.1679; 16.2316; 7.5544
90; 90; 90		1246.79Yang, Guo-Yu; Wei, Qi; Sun, Li; Zhang, Jie
Two Deep-Ultraviolet Nonlinear Optical Alkaline-Earth Metal Borates Based on Different Types of Oxoboron Clusters
Dalton Trans., 2017
7043348 CIFBr H6 O6 P3 Sn2P m n 215.4177; 7.1467; 13.8359
90; 90; 90		535.71Xie, Jie-Ling; Zhou, Yu-Hua; Li, Longhua; Zhang, Jian-Han; Song, Jun-Ling
A new method for the preparation of [Sn2(H2PO2)3]Br SHG-active polar crystal by surfactant-induced strategy
Dalton Trans., 2017
7048572 CIFC37 H46 B N O3P m n 2117.996; 8.254; 10.502
90; 90; 90		1560Kitamoto, Yuichi; Kobayashi, Fumiaki; Suzuki, Takatsugu; Miyata, Yasuo; Kita, Hiroshi; Funaki, Kenji; Oi, Shuichi
Investigation of the Lewis acidic behaviour of an oxygen-bridged planarized triphenylborane toward amines and the properties of their Lewis acid-base adducts.
Dalton transactions (Cambridge, England : 2003), 2019, 48, 2118-2127
7050838 CIFC2 H5 O4 P ZnP m n 215.6805; 9.8101; 4.7988
90; 90; 90		267.419Menaa, Bouzid; Kariuki, Benson M.; Shannon, Ian J.
Preparation using metal oxide precursors and crystal structures of the copper and zinc vinylphosphonate materials M(O3PC2H3)·H2O (M = Cu, Zn)Electronic supplementary information (ESI) available: rotatable 3-D crystal structure diagrams in CHIME format. See http://www.rsc.org/suppdata/nj/b2/b200438k/
New Journal of Chemistry, 2002, 26, 906
7052519 CIFC12 H13 Cl N2 OP m n 216.801; 12.199; 7.327
90; 90; 90		607.89Crystal engineering of neutral N-arylpyrimidinones and their HCl and HNO3 adducts with a C‒H⋯O supramolecular synthon. Implications for non-linear optics
New Journal of Chemistry, 2001, 25, 1520
7056175 CIFC20 H23 Cl F6 N2 P RhP m n 2112.9323; 8.1971; 10.4445
90; 90; 90		1107.19Kerner, Christian; Neu, Jens P.; Gaffga, Maximilian; Lang, Johannes; Oelkers, Benjamin; Sun, Yu; Niedner-Schatterburg, Gereon; Thiel, Werner R.
Gas-phase reactivity of Cp* Group IX metal complexes bearing aromatic N,N’-chelating ligands
New J. Chem., 2017
7058616 CIFGa2 P2 Rb2 S9P m n 217.067; 11.938; 9.694
90; 90; 90		817.8Hu, Qichang; Ruan, Kaibin; Wang, Yuzhu; Ding, Kai; Xu, Yong
Synthesis and nonlinear optical properties of new gallium thiophosphate Rb2Ga2P2S9
New Journal of Chemistry, 2019, 43, 12468
7061560 CIFC19 H14 NP m n 2114.1719; 8.9226; 5.6638
90; 90; 90		716.19Zhang, Fang; An, Yi; Liu, Jichang; Du, Guangfen; Cai, Zhihua; He, Lin
Assembly of unsymmetrical 1,3,5-triarylbenzenes via tandem reaction of β-arylethenesulfonyl fluorides and α-cyano-β-methylenones
New Journal of Chemistry, 2022, 46, 12367-12371
7062032 CIFC10 H6 B F4 S2P m n 2110.1169; 6.6072; 46.904
90; 90; 90		3135.3Roemmele, Tracey L.; Knight, Fergus R.; Crawford, Ellis; Robertson, Stuart D.; Bode, Bela E.; Bühl, Michael; Slawin, Alexandra M. Z.; Woollins, J. Derek; Boeré, René T.
Chalcogen controlled redox behaviour in peri-substituted S, Se and Te naphthalene derivatives
New Journal of Chemistry, 2022, 46, 22363-22383
7062764 CIFC71 H60 Cl2 N4 O5 P2 Ru S2P m n 2116.9228; 10.5794; 18.136
90; 90; 90		3246.94Singh, 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
7100560 CIFC28 H26 Ag Cl3 N8 O5.74P m n 2143.826; 5.2608; 14.096
90; 90; 90		3250Jonathan 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 CIFC30 H45 Cl2 N20 O17.5P m n 2114.28; 11.56; 13.183
90; 90; 90		2176.2Bardelang, 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 CIFC14 H31 B2 O ScP m n 2113.8226; 8.066; 7.6377
90; 90; 90		851.55Bonnet, 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 CIFC5 H15 Cl P2P m n 219.4581; 6.5601; 7.306
90; 90; 90		453.31Saurabh 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 CIFC14 H23 Cl2 Ga N2P m n 2110.2217; 12.2916; 6.462
90; 90; 90		811.89Luo, 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 CIFC31 H43 Eu I N2 O4P m n 2117.7513; 8.7645; 10.3139
90; 90; 90		1604.65Wiecko, 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 CIFC31 H43 I N2 O4 YbP m n 2117.6761; 8.7327; 10.1877
90; 90; 90		1572.57Wiecko, 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 CIFC14 H31 B2 Co F8 N5P m n 218.794; 14.351; 16.856
90; 90; 90		2127Cui, 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 CIFC16 H16 Au2 N10P m n 216.2753; 8.0957; 18.757
90; 90; 90		952.91Liu, 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 CIFC16 H16 Au2 N10P m n 216.3306; 8.141; 18.7077
90; 90; 90		964.15Liu, 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 CIFC16 H16 Au2 N10P m n 216.2961; 8.1146; 18.7357
90; 90; 90		957.21Liu, 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 CIFC35 H80 Br15 N10 Rb5P m n 2148.9591; 6.8436; 9.8667
90; 90; 90		3305.9Han, 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 CIFB2 Be2 O6 PbP m n 2110.737; 4.7501; 4.5368
90; 90; 90		231.39Chen, 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 CIFC19 H23 Co F6 N2 O3 SP m n 2110.9754; 9.2478; 11.0627
90; 90; 90		1122.85Zou, Minzhu; Waldie, Kate MacKenzie
Redox-Active Ligand Promoted Electrophile Addition at Cobalt
Chemical Communications, 2023
7151433 CIF?P m n 2118.713; 9.553; 4.831
90; 90; 90		863.6Levy, 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 2118.811; 9.702; 4.639
90; 90; 90		846.6Levy, 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 CIFC66 H70 N2 O4 S4P m n 2115.1668; 14.7772; 12.7612
90; 90; 90		2860.1Zhao, 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 CIFC21 H19 B N2 O5P m n 2114.507; 9.3436; 14.134
90; 90; 90		1915.8Maeda, 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 CIFC6 H12 Ag2 Cl N3 O0 S2P m n 2114.9; 6.4724; 6.4724
90; 90; 90		624.2Liu, 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 CIFC13 H6 F4 I NP m n 2112.0266; 10.2443; 4.9988
90; 90; 90		615.87Christer 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 CIFC17 H33 N5 O4P m n 2151.63; 4.7775; 4.129
90; 90; 90		1018.47Duong, 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 CIFB4 Ca O7P m n 2110.584; 4.3694; 4.1935
90; 90; 90		193.931Huppertz, 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 CIFB4 Hg O7P m n 2110.656; 4.381; 4.1872
90; 90; 90		195.475Huppertz, 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 CIFC31 H106 N Na5 O55 P4P m n 2116.2938; 16.3581; 16.329
90; 90; 90		4352.26Ling, 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 CIFC4 H5 N3 O2 ZnP m n 219.303; 8.413; 8.161
90; 90; 90		638.7Yin, 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 CIFC11 H18 N8 O3P m n 219.5289; 9.1191; 8.667
90; 90; 90		753.12Gryl, 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 CIFHg O4 SeP m n 216.7311; 4.9308; 4.989
90; 90; 90		165.583Weil, 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 CIFCu3 P S0.71 Se3.29P m n 217.6164; 6.5945; 6.3107
90; 90; 90		316.96Vorranutch 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 CIFCu3 P S1.89 Se2.11P m n 217.5034; 6.4951; 6.2174
90; 90; 90		303.01Vorranutch 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 CIFB3 Be La O7P m n 2110.669; 4.4434; 4.2996
90; 90; 90		203.83Xue 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 CIFB Ba Cl F4P m n 215.228; 9.351; 4.734
90; 90; 90		231.4Min 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 CIFCl O8 P Pr4P m n 2113.1523; 5.8211; 5.8211
90; 90; 90		445.67Hamdi 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 CIFCl Cu H3 O3 SrP m n 2116.131; 6.4733; 6.5363
90; 90; 90		682.5Teng-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 CIFC38 H25 F N4P m n 2133.005; 3.7442; 10.782
90; 90; 90		1332.4Takahiro 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 CIFH12 Mg O10 P RbP m n 216.896; 6.191; 11.341
90; 90; 90		484.2Yuqiao 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 CIFC8 H20 Cl5 N2 SbP m n 218.5385; 11.0894; 17.9031
90; 90; 90		1695.19Ksiądzyna, 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 CIFC112 H106 Co5 N28 O28P m n 2152.46; 7.211; 19.47
90; 90; 90		7365.3Wang, 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 CIFC23 H18 O17 Zn3P m n 2117.6198; 11.9264; 14.1457
90; 90; 90		2972.59Chen, 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 CIFH10 Ni O15 S1.38 Se0.62 UP m n 2112.8182; 8.2926; 11.3803
90; 90; 90		1209.68Kornyakov, 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 CIFH10 Ni O15 S2 UP m n 2112.7506; 8.3095; 11.2929
90; 90; 90		1196.5Kornyakov, 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 CIFH10 Ni O15 S1.2 Se0.8 UP m n 2112.8291; 8.2825; 11.3826
90; 90; 90		1209.48Kornyakov, 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 CIFH10 Ni O15 S1.85 Se0.15 UP m n 2112.7808; 8.2806; 11.3074
90; 90; 90		1196.69Kornyakov, 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 CIFCo H10 O15 S2 UP m n 2112.916; 8.296; 11.2937
90; 90; 90		1210.13Kornyakov, 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 CIFH10 Ni O15 S1.64 Se0.35 UP m n 2112.783; 8.2863; 11.3033
90; 90; 90		1197.29Kornyakov, 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 CIFH10 O15 S2 U ZnP m n 2112.8695; 8.28206; 11.292
90; 90; 90		1203.57Kornyakov, 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 CIFC13 H18 N4 O5 SP m n 2120.0136; 8.2017; 9.831
90; 90; 90		1613.71Pagliari, 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 CIFAg1.5 Cu1.5 P S4P m n 217.718; 6.562; 6.318
90; 90; 90		320Yang, 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 CIFAg3 P S4P m n 217.6383; 6.8528; 6.4976
90; 90; 90		340.11Yang, 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 CIFCu3 P S4P m n 217.2789; 6.3341; 6.0828
90; 90; 90		280.45Yang, 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 CIFN5 NaP m n 215.455; 2.836; 5.662
90; 90; 90		87.6Bykov, 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 CIFC124 H102 N20 O70 Ti19P m n 2122.0234; 15.8771; 28.8999
90; 90; 90		10105.4Gao, 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 CIFC18 H31 Ga I3 O PP m n 2114.875; 7.1776; 11.9265
90; 90; 90		1273.35Dankert, Fabian; Fischer, Malte; Hering-Junghans, Christian
Modulating the reactivity of phosphanylidenephosphoranes towards water with Lewis acids
Dalton Transactions, 2022
7712599 CIFB6.5 Co0.5 H3 K3.5 O14P m n 2112.3437; 9.1086; 12.9438
90; 90; 90		1455.32Deng, 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
8100168 CIFC9 H11 Cl Cu N6P m n 2113.733; 6.102; 7.252
90; 90; 90		607.7Lin, 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 CIFCe2 Ni7 P4P m n 213.7769; 9.2225; 10.4129
90; 90; 90		362.71Budnyk, 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 CIFC44 H58 O10 P2P m n 2123.7325; 7.9631; 12.3151
90; 90; 90		2327.4Reck, 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 CIFH7.5 Ni0.5 O5.5 P0.5P m n 216.916; 6.1032; 11.1679
90; 90; 90		471.39X.-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 CIFKP m n 2111.048; 8.367; 7.402
90; 90; 90		684.231Davis, 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 CIFCu3 P S4P m n 217.2817; 6.3387; 6.0746
90; 90; 90		280.382Pfitzner, 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 CIFC6 H18 Br6 In Na O2 S2P m n 2110.5451; 7.1169; 13.7034
90; 90; 90		1028.42Jin, 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 CIFH10 O10 S VP m n 217.242; 9.319; 6.192
90; 90; 90		417.887Hawthorne, 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 CIFAs Cu3 S4P m n 217.407; 6.436; 6.154
90; 90; 90		293.37Adiwidjaja, G.; Lohn, J.
Strukturverfeinerung von enargit, Cu3AsS4
Acta Crystallographica, Section B, 1970, 26, 1878-1879
9007573 CIFAs H16 Mg N O10P m n 217.054; 6.205; 11.368
90; 90; 90		497.578Ferraris, 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 CIFC H6 Cu2 O21 Pb5 S3P m n 2120.089; 7.146; 6.56
90; 90; 90		941.727Giacovazzo, C.; Menchetti, S.; Scordari, F.
The crystal structure of caledonite, Cu2Pb5(SO4)3CO3(OH)6
Acta Crystallographica, Section B, 1973, 29, 1986-1990
9007674 CIFH16 Mg N O10 PP m n 216.955; 6.142; 11.218
90; 90; 90		479.206Ferraris, 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 CIFAl3 Ca0.3 H12 K1.125 Na1.3 O21.325 Si5P m n 2110.108; 9.766; 10.171
90; 90; 90		1004.03McCusker, 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 CIFBa Be2 O7 Si2P m n 2111.65; 4.922; 4.674
90; 90; 90		268.013Krivovichev, 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 CIFAl2.8 Ca0.47 H12 Na2 O22 Si5.2P m n 2110.1027; 9.8016; 10.1682
90; 90; 90		1006.88Artioli, G.; Foy, H.
Gobbinsite from Magheramorne quarry, Northern Ireland
Mineralogical Magazine, 1994, 58, 615-620
9010013 CIFGa H3 O3P m n 217.4865; 7.4379; 7.4963
90; 90; 90		417.423Scott, J. D.
Crystal structure of a new mineral, sohngeite
American Mineralogist, 1971, 56, 355-355
9010847 CIFH12 K Mg O10 PP m n 216.892; 6.166; 11.139
90; 90; 90		473.364Graeser, 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 CIFCu3 P Se4P m n 217.697; 6.661; 6.381
90; 90; 90		327.152Garin, 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 CIFH12 K Mg O10 PP m n 216.873; 6.16; 11.087
90; 90; 90		469.398Mathew, M.; Schroeder, L. W.
Crystal structure of a struvite analogue, MgKPO4*6H2O
Acta Crystallographica, Section B, 1979, 35, 11-13
9012219 CIFMg0.01 O5 V2P m n 2111.544; 4.383; 3.574
90; 90; 90		180.835Shklover, 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 CIFO5 V2P m n 2111.544; 4.383; 3.571
90; 90; 90		180.683Shklover, 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 CIFLi3 O4 PP m n 216.115; 5.2394; 4.8554
90; 90; 90		155.562Keffer, 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 CIFD6 Mn N O5 PP m n 215.7173; 8.8312; 4.8774
90; 90; 90		246.263Carling, 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 CIFD6 Mn N O5 PP m n 215.7142; 8.8255; 4.8762
90; 90; 90		245.91Carling, 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 CIFD6 Mn N O5 PP m n 215.7302; 8.8191; 4.9087
90; 90; 90		248.062Carling, 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 CIFC H6 Cu2 O21 Pb5 S3P m n 2120.085; 7.141; 6.563
90; 90; 90		941.311Schofield, 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 CIFAs Cu3 S4P m n 217.426; 6.4521; 6.1631
90; 90; 90		295.294Henao, 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 CIFAs Cu3 S4P m n 217.399; 6.428; 6.145
90; 90; 90		292.261Pfitzner, A.; Bernert, T.
The system Cu3AsS4 - Cu3SbS4 and investigations on normal tetrahedral structures Sample: Cu3AsS4
Zeitschrift fur Kristallographie, 2004, 219, 20-26
9015642 CIFAs Cu3 S4P m n 217.4127; 6.4404; 6.1577
90; 90; 90		293.973Karanovic, 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 CIFAs Cu5 H8 O15P m n 213.0113; 14.259; 14.932
90; 90; 90		641.152Mills, 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 CIFAs0.5 Cu2.5 H2.15 O6.575P m n 213.0088; 14.212; 14.89
90; 90; 90		636.712Mills, 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 CIFH16 Mg N O10 PP m n 216.941; 6.137; 11.199
90; 90; 90		477.043Whitaker, A.; Jeffery, J. W.
The crystal structure of struvite, MgNH4PO4*6H2O
Acta Crystallographica, Section B, 1970, 26, 1429-1440
9017315 CIFH16 Mg N O10 PP m n 216.955; 6.142; 11.218
90; 90; 90		479.206Abbona, 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 CIFCu6 H20 O19 SP m n 216.807; 5.897; 20.653
90; 90; 90		829.03Biagioni, 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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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.