Crystallography Open Database

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1010849 CIFH4 O7 Pb55.93; 4.65; 6.36
90; 105.78; 90
168.8Clark, G L; Tyler, W P
On Lead Oxides. II. Hydrous, Normal and Active Lead Monoxides
Journal of the American Chemical Society, 1939, 61, 58-65
1010850 CIFCr H24 O20 S2 Tl12.238; 12.238; 12.238
90; 90; 90
1832.9Klug, H P
Crystal-Chemical Studies of the Alums. II. The Purple Chrome Alums
Journal of the American Chemical Society, 1940, 62, 2992-2993
1010855 CIFBr2 H18 N6 Ni10.48; 10.48; 10.48
90; 90; 90
1151Wyckoff, R W G
The crystal structures of the hexaammoniates of the nickel halides
Journal of the American Chemical Society, 1922, 44, 1239-1245
1010856 CIFH18 I2 N6 Ni11.01; 11.01; 11.01
90; 90; 90
1334.6Wyckoff, R W G
The crystal structures of the hexaammoniates of the nickel halides
Journal of the American Chemical Society, 1922, 44, 1239-1245
4124110 CIFC14 Co6 O14 S4A -111.78; 18; 14.9
69.62; 86.7; 65.52
2681.43Stevenson, D.L.; Dahl, L.F.; Magnuson, V.R.
Organometallic Sulfur Complexes. IX. Structure of a Hexanuclear Cobalt Carbonyl Sulfur Complex, (S Co3 (C O)7)2 S2, Containing a Tetrametal-Coordinated Bridginq Disulfide Group
Journal of the American Chemical Society, 1967, 89, 3727-3732
4123973 CIFNb12 O29A 1 2/m 115.6856; 3.8307; 20.7098
90; 113.056; 90
1144.99Waldron, J.E.L.; Green, M.A.; Neumann, D.A.
Charge and spin ordering in monoclinic Nb12 O29
Journal of the American Chemical Society, 2001, 123, 5833-5834
4120551 CIFAl Ba N5 O3 Si4A 21 a m9.48461; 13.47194; 5.773234
90; 90; 90
737.681Park, Woon Bae; Singh, Satendra Pal; Sohn, Kee-Sun
Discovery of a phosphor for light emitting diode applications and its structural determination, ba(si,al)5(o,n)8:eu(2+).
Journal of the American Chemical Society, 2014, 136, 2363-2373
4120552 CIFAl2 Ba N4 O4 Si3A 21 a m9.47791; 13.45426; 5.7694
90; 90; 90
735.704Park, Woon Bae; Singh, Satendra Pal; Sohn, Kee-Sun
Discovery of a phosphor for light emitting diode applications and its structural determination, ba(si,al)5(o,n)8:eu(2+).
Journal of the American Chemical Society, 2014, 136, 2363-2373
4131513 CIFC8 H32 Cl10 N4 Pb3A 21 m a8.024; 45.498; 8.08
90; 90; 90
2950Mao, Lingling; Wu, Yilei; Stoumpos, Constantinos C.; Traore, Boubacar; Katan, Claudine; Even, Jacky; Wasielewski, Michael R.; Kanatzidis, Mercouri G.
Tunable White-Light Emission in Single-Cation-Templated Three-Layered 2D Perovskites (CH<sub>3</sub>CH<sub>2</sub>NH<sub>3</sub>)<sub>4</sub>Pb<sub>3</sub>Br<sub>10-x</sub>Cl<sub>x</sub>.
Journal of the American Chemical Society, 2017, 139, 11956-11963
4100318 CIFC44 H103 Cl12 Fe10 N15A b a 243.523; 23.303; 15.201
90; 90; 90
15417Journal of the American Chemical Society, 2005
4101011 CIFC23 H14 Cr N2 O9A b a 224.13; 12.02; 16.008
90; 90; 90
4643Journal of the American Chemical Society, 2006
4102736 CIFC53 H54 N4 O8 S2A b a 210.31; 35.917; 12.402
90; 90; 90
4593Benjamin J. Coe; John Fielden; Simon P. Foxon; James A. Harris; Madeleine Helliwell; Bruce S. Brunschwig; Inge Asselberghs; Koen Clays; Javier Garín; Jesús Orduna
Diquat Derivatives: Highly Active, Two-Dimensional Nonlinear Optical Chromophores with Potential Redox Switchability
Journal of the American Chemical Society, 2010, 132, 10498-10512
4105011 CIFC66 H150 Fe8 N6 O3 S9 Si8A b a 226.522; 28.749; 26.062
90; 90; 90
19872Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi
Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster
Journal of the American Chemical Society, 2009, 131, 13168-13178
4105013 CIFC62 H140 Cl2 Fe8 N6 O2.5 S9 Si8A b a 226.503; 29.012; 26.224
90; 90; 90
20164Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi
Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster
Journal of the American Chemical Society, 2009, 131, 13168-13178
4105014 CIFC64 H144 Br2 Fe8 N6 O3 S9 Si8A b a 226.201; 28.989; 26.46
90; 90; 90
20097Yasuhiro Ohki; Motosuke Imada; Ayuro Murata; Yusuke Sunada; Shun Ohta; Masaru Honda; Takahiro Sasamori; Norihiro Tokitoh; Motomi Katada; Kazuyuki Tatsumi
Synthesis, Structures, and Electronic Properties of [8Fe-7S] Cluster Complexes Modeling the Nitrogenase P-Cluster
Journal of the American Chemical Society, 2009, 131, 13168-13178
4105838 CIFGa Pr4 S9 SbA b a 213.799; 14.187; 14.323
90; 90; 90
2804Mei-Chun Chen; Long-Hua Li; Yu-Biao Chen; Ling Chen
In-Phase Alignments of Asymmetric Building Units in Ln4GaSbS9 (Ln = Pr, Nd, Sm, Gd-Ho) and Their Strong Nonlinear Optical Responses in Middle IR
Journal of the American Chemical Society, 2011, 133, 4617-4624
4105839 CIFGa Nd4 S9 SbA b a 213.759; 14.113; 14.3
90; 90; 90
2776.8Mei-Chun Chen; Long-Hua Li; Yu-Biao Chen; Ling Chen
In-Phase Alignments of Asymmetric Building Units in Ln4GaSbS9 (Ln = Pr, Nd, Sm, Gd-Ho) and Their Strong Nonlinear Optical Responses in Middle IR
Journal of the American Chemical Society, 2011, 133, 4617-4624
4105840 CIFGa S9 Sb Sm4A b a 213.64; 13.983; 14.166
90; 90; 90
2701.9Mei-Chun Chen; Long-Hua Li; Yu-Biao Chen; Ling Chen
In-Phase Alignments of Asymmetric Building Units in Ln4GaSbS9 (Ln = Pr, Nd, Sm, Gd-Ho) and Their Strong Nonlinear Optical Responses in Middle IR
Journal of the American Chemical Society, 2011, 133, 4617-4624
4105841 CIFGa Gd4 S9 SbA b a 213.5733; 13.8956; 14.0982
90; 90; 90
2659Mei-Chun Chen; Long-Hua Li; Yu-Biao Chen; Ling Chen
In-Phase Alignments of Asymmetric Building Units in Ln4GaSbS9 (Ln = Pr, Nd, Sm, Gd-Ho) and Their Strong Nonlinear Optical Responses in Middle IR
Journal of the American Chemical Society, 2011, 133, 4617-4624
4105842 CIFGa S9 Sb Tb4A b a 213.53; 13.85; 14.05
90; 90; 90
2632.8Mei-Chun Chen; Long-Hua Li; Yu-Biao Chen; Ling Chen
In-Phase Alignments of Asymmetric Building Units in Ln4GaSbS9 (Ln = Pr, Nd, Sm, Gd-Ho) and Their Strong Nonlinear Optical Responses in Middle IR
Journal of the American Chemical Society, 2011, 133, 4617-4624
4105843 CIFDy4 Ga S9 SbA b a 213.4762; 13.8105; 14.0109
90; 90; 90
2607.6Mei-Chun Chen; Long-Hua Li; Yu-Biao Chen; Ling Chen
In-Phase Alignments of Asymmetric Building Units in Ln4GaSbS9 (Ln = Pr, Nd, Sm, Gd-Ho) and Their Strong Nonlinear Optical Responses in Middle IR
Journal of the American Chemical Society, 2011, 133, 4617-4624
4105844 CIFGa Ho4 S9 SbA b a 213.427; 13.756; 13.954
90; 90; 90
2577.3Mei-Chun Chen; Long-Hua Li; Yu-Biao Chen; Ling Chen
In-Phase Alignments of Asymmetric Building Units in Ln4GaSbS9 (Ln = Pr, Nd, Sm, Gd-Ho) and Their Strong Nonlinear Optical Responses in Middle IR
Journal of the American Chemical Society, 2011, 133, 4617-4624
4110858 CIFC92 H164 B4 Fe12 Mo4 N37 S20A b a 236.478; 26.208; 16.165
90; 90; 90
15454Curtis P. Berlinguette; R. H. Holm
Edge-Bridged Mo2Fe6S8 to PN-Type Mo2Fe6S9 Cluster Conversion: Structural Fate of the Attacking Sulfide/Selenide Nucleophile
Journal of the American Chemical Society, 2006, 128, 11993-12000
4113599 CIFC46 H82 B2 Fe6 Mo2 N18.5 S7 Se3A b a 236.883; 26.168; 16.194
90; 90; 90
15630Yugen Zhang; R. H. Holm
Synthesis of a Molecular Mo2Fe6S9 Cluster with the Topology of the PN Cluster of Nitrogenase by Rearrangement of an Edge-Bridged Mo2Fe6S8 Double Cubane
Journal of the American Chemical Society, 2003, 125, 3910-3920
4114009 CIFGe2 Hg3 K2 S8A b a 219.082; 9.551; 8.2871
90; 90; 90
1510.3J.-H. Liao; G. M. Marking; K. F. Hsu; Y. Matsushita; M. D. Ewbank; R. Borwick; P. Cunningham; M. J. Rosker; M. G. Kanatzidis
α- and β-A2Hg3M2S8 (A = K, Rb; M = Ge, Sn): Polar Quaternary Chalcogenides with Strong Nonlinear Optical Response
Journal of the American Chemical Society, 2003, 125, 9484-9493
4114010 CIFHg3 K2 S8 Sn2A b a 219.5634; 9.8527; 8.4667
90; 90; 90
1632J.-H. Liao; G. M. Marking; K. F. Hsu; Y. Matsushita; M. D. Ewbank; R. Borwick; P. Cunningham; M. J. Rosker; M. G. Kanatzidis
α- and β-A2Hg3M2S8 (A = K, Rb; M = Ge, Sn): Polar Quaternary Chalcogenides with Strong Nonlinear Optical Response
Journal of the American Chemical Society, 2003, 125, 9484-9493
4114672 CIFC29 H38 Cu F12 N5 O5 P2A b a 245.47; 20.523; 8.229
90; 90; 90
7679Shin-ichiro Noro; Ryo Kitaura; Mitsuru Kondo; Susumu Kitagawa; Tomohiko Ishii; Hiroyuki Matsuzaka; Masahiro Yamashita
Framework Engineering by Anions and Porous Functionalities of Cu(II)/4,4'-bpy Coordination Polymers
Journal of the American Chemical Society, 2002, 124, 2568-2583
4114673 CIFC29 H38 Cl Cu F6 N5 O9 PA b a 244.87; 20.292; 8.17
90; 90; 90
7439Shin-ichiro Noro; Ryo Kitaura; Mitsuru Kondo; Susumu Kitagawa; Tomohiko Ishii; Hiroyuki Matsuzaka; Masahiro Yamashita
Framework Engineering by Anions and Porous Functionalities of Cu(II)/4,4'-bpy Coordination Polymers
Journal of the American Chemical Society, 2002, 124, 2568-2583
4115433 CIFC16 H41 Ge N Si4A b a 214.2877; 21.2552; 8.2422
90; 90; 90
2503.06Karla A. Miller; Thomas W. Watson; John E. Bender; Mark M. Banaszak Holl; Jeff W. Kampf
Intermolecular C-H Insertions and Cyclization Reactions Involving a Stable Germylene
Journal of the American Chemical Society, 2001, 123, 982-983
4116818 CIFC46 H88 Cl4 N10 O12A b a 222.942; 24.674; 10.775
90; 90; 90
6099Anton W. Bosman; Monique J. Bruining; Huub Kooijman; Anthony L. Spek; René A. J. Janssen; E. W. Meijer
Concerning the Localization of End Groups in Dendrimers
Journal of the American Chemical Society, 1998, 120, 8547-8548
4121603 CIFC28 H20 Co N2 O4A b a 213.1543; 21.7445; 8.6774
90; 90; 90
2482Elsaidi, Sameh K.; Mohamed, Mona H.; Wojtas, Lukasz; Chanthapally, Anjana; Pham, Tony; Space, Brian; Vittal, Jagadese J.; Zaworotko, Michael J.
Putting the Squeeze on CH4 and CO2 through Control over Interpenetration in Diamondoid Nets.
Journal of the American Chemical Society, 2014, 136, 5072-5077
4122326 CIFC304 H320 Au16 N16 O16 S32A b a 236.036; 21.732; 41.308
90; 90; 90
32350Jiang, Xuan-Feng; Hau, Franky Ka-Wah; Sun, Qing-Fu; Yu, Shu-Yan; Yam, Vivian Wing-Wah
From {au(i)···au(i)}-coupled cages to the cage-built 2-d {au(i)···au(i)} arrays: au(i)···au(i) bonding interaction driven self-assembly and their ag(i) sensing and photo-switchable behavior.
Journal of the American Chemical Society, 2014, 136, 10921-10929
4111564 CIFC54 H93 B36 Cl4 Co2 Fe N7A b m 223.443; 25.146; 13.2883
90; 90; 90
7833.4Julien Bachmann; Daniel G. Nocera
Multielectron Redox Chemistry of Iron Porphyrinogens
Journal of the American Chemical Society, 2005, 127, 4730-4743
4110987 CIFC120 H160 Al6 Cl12 N4 O22A e a 227.854; 25.16; 18.562
90; 90; 90
13008Weiping Su; Youngjo Kim; Arkady Ellern; Ilia A. Guzei; John G. Verkade
Facile Synthesis of Monomeric Alumatranes
Journal of the American Chemical Society, 2006, 128, 13727-13735
4118230 CIFC78 H102 Co3 N13 O2A e a 229.641; 22.626; 10.566
90; 90; 90
7086Julia Kozhukh; Stephen J. Lippard
Influence of Tetraazamacrocyclic Ligands on the Nitric Oxide Reactivity of their Cobalt(II) Complexes
Journal of the American Chemical Society, 2012, 134, 11120-11123
4124996 CIFC84 H86 B F20 Li N4 Si2A e a 221.7127; 29.2279; 26.0364
90; 90; 90
16523.1Arz, Marius I.; Straßmann, Martin; Geiß, Daniel; Schnakenburg, Gregor; Filippou, Alexander C.
Addition of Small Electrophiles to N-Heterocyclic-Carbene-Stabilized Disilicon(0): A Revisit of the Isolobal Concept in Low-Valent Silicon Chemistry.
Journal of the American Chemical Society, 2016, 138, 4589-4600
4127247 CIFC16 H16 N2 O2A e a 221.686; 17.836; 7.2977
90; 90; 90
2822.7Shao, Baihao; Qian, Hai; Li, Quan; Aprahamian, Ivan
Structure Property Analysis of the Solution and Solid-State Properties of Bistable Photochromic Hydrazones.
Journal of the American Chemical Society, 2019, 141, 8364-8371
4129594 CIFC27 H31 Co N2A e a 216.0692; 16.4154; 8.581
90; 90; 90
2263.5Chen, Chi; Hecht, Maxwell B.; Kavara, Aydin; Brennessel, William W.; Mercado, Brandon Q.; Weix, Daniel J.; Holland, Patrick L.
Rapid, Regioconvergent, Solvent-Free Alkene Hydrosilylation with a Cobalt Catalyst.
Journal of the American Chemical Society, 2015, 137, 13244-13247
4131240 CIFC6 H18 Br4 N2 PbA e a 241.685; 23.962; 12
90; 90; 90
11986Mao, Lingling; Wu, Yilei; Stoumpos, Constantinos C.; Wasielewski, Michael R.; Kanatzidis, Mercouri G.
White-Light Emission and Structural Distortion in New Corrugated Two-Dimensional Lead Bromide Perovskites.
Journal of the American Chemical Society, 2017, 139, 5210-5215
4131953 CIFC24 H26 N2 O7A e a 213.6713; 37.374; 8.2094
90; 90; 90
4194.6Miloserdov, Fedor M.; Kirillova, Mariia S.; Muratore, Michael E.; Echavarren, Antonio M.
Unified Total Synthesis of Pyrroloazocine Indole Alkaloids Sheds Light on Their Biosynthetic Relationship.
Journal of the American Chemical Society, 2018, 140, 5393-5400
4131995 CIFC12 H7 F3 N2A e a 214.047; 14.609; 10.026
90; 90; 90
2057.5Kobayashi, Kensuke; Horiuchi, Sachio; Ishibashi, Shoji; Murakami, Youichi; Kumai, Reiji
Field-Induced Antipolar-Polar Structural Transformation and Giant Electrostriction in Organic Crystal.
Journal of the American Chemical Society, 2018, 140, 3842-3845
4134273 CIFC10 H20 F4 I4 N2 PbA e a 29.2974; 25.1758; 8.9611
90; 90; 90
2097.52Zhang, Han-Yue; Song, Xian-Jiang; Chen, Xiao-Gang; Zhang, Zhi-Xu; You, Yu-Meng; Tang, Yuan-Yuan; Xiong, Ren-Gen
Observation of vortex domains in a two-dimensional lead iodide perovskite ferroelectric.
Journal of the American Chemical Society, 2020
4134277 CIFC10 H20 F4 I4 N2 PbA e a 29.2541; 25.0703; 8.9483
90; 90; 90
2076.03Zhang, Han-Yue; Song, Xian-Jiang; Chen, Xiao-Gang; Zhang, Zhi-Xu; You, Yu-Meng; Tang, Yuan-Yuan; Xiong, Ren-Gen
Observation of vortex domains in a two-dimensional lead iodide perovskite ferroelectric.
Journal of the American Chemical Society, 2020
4134282 CIFC10 H20 F4 I4 N2 PbA e a 29.3456; 25.3587; 9.0113
90; 90; 90
2135.61Zhang, Han-Yue; Song, Xian-Jiang; Chen, Xiao-Gang; Zhang, Zhi-Xu; You, Yu-Meng; Tang, Yuan-Yuan; Xiong, Ren-Gen
Observation of vortex domains in a two-dimensional lead iodide perovskite ferroelectric.
Journal of the American Chemical Society, 2020
4133782 CIFC82 H120 K2 N4 O3 Sc2A e m 210.13686; 27.9904; 29.413
90; 90; 90
8345.5Lv, Ze-Jie; Huang, Zhe; Shen, Jinghang; Zhang, Wen-Xiong; Xi, Zhenfeng
Well-Defined Scandacyclopropenes: Synthesis, Structure, and Reactivity.
Journal of the American Chemical Society, 2019, 141, 20547-20555
4100299 CIFC8 H9 N O SA m a 29.2374; 18.966; 4.6027
90; 90; 90
806.37Journal of the American Chemical Society, 2005
4121641 CIFBr2 Cd I2 Rb2A m a 211.764; 12.025; 8.446
90; 90; 90
1194.8Wu, Qi; Meng, Xianggao; Zhong, Cheng; Chen, Xingguo; Qin, Jingui
Rb2CdBr2I2: A New IR Nonlinear Optical Material with a Large Laser Damage Threshold.
Journal of the American Chemical Society, 2014, 136, 5683
4122386 CIFC14 H14 N2 O2A m a 26.8074; 21.719; 7.9131
90; 90; 90
1169.95Hsu, Yen-Hao; Chen, Yi-An; Tseng, Huan-Wei; Zhang, Zhiyun; Shen, Jiun-Yi; Chuang, Wei-Ti; Lin, Tzu-Chieh; Lee, Chun-Shu; Hung, Wen-Yi; Hong, Bor-Cherng; Liu, Shih-Hung; Chou, Pi-Tai
Locked ortho- and para-Core Chromophores of Green Fluorescent Protein; Dramatic Emission Enhancement via Structural Constraint.
Journal of the American Chemical Society, 2014, 136, 11805-11812
4123987 CIFC H2 Cl4 Cs2 O2 RuA m a m8.096; 17.19; 7.437
90; 90; 90
1035.01Stanko, J.A.; Chaipayungpundhu, S.
Crystal structure of cesium trans-tetrachloroaquocarbonylruthenate(II)
Journal of the American Chemical Society, 1970, 92, 5580-5585
4110502 CIFO2 SiA m m 212.4802; 21.0374; 13.4698
90; 90; 90
3536.5Angel Cantín; Avelino Corma; Maria J. Diaz-Cabanas; Jose L. Jordá; Manuel Moliner
Rational Design and HT Techniques Allow the Synthesis of New IWR Zeolite Polymorphs
Journal of the American Chemical Society, 2006, 128, 4216-4217

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