Crystallography Open Database

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7100100 CIFBi9 Cl5 H12 O37I 1 m 19.983; 16.774; 10.608
90; 92.85; 90
1774.2J.H. Thurston; D.C. Swenson; L. Messerle
Chemical Communications, 2005
7100101 CIFC28 H78 Bi9 Cl5 O42P 1 21/c 113.434; 26.027; 20.985
90; 106.87; 90
7022Chemical Communications, 2005
7100102 CIFC6 H43 Cs4 Na2 O43 P Ru S3 W7P 1 21/n 111.8045; 14.1144; 30.313
90; 97.363; 90
5009Ulrich Kortz; Lihua Bi.; Michael H. Dickman; Ina Dix
The Ru (II)-supported heptatungstates [HXW7O28RU(dmso)3]6 (X = P,As)
Chemical Communications, 2005
7100103 CIFC6 H35 As Cs2 Na4 O39 Ru S3 W7P 1 21/c 114.8022; 23.421; 16.4215
90; 92.037; 90
5689.4Ulrich Kortz; Lihua Bi.; Michael H. Dickman; Ina Dix
The Ru (II)-supported heptatungstates [HXW7O28RU(dmso)3]6 (X = P,As)
Chemical Communications, 2005
7100104 CIFC108 H194 Cr9 F12 N Ni O37C 1 2 131.133; 17.213; 32.873
90; 112.94; 90
16223R. Winpenny; Andrei S. Batsanov; Finn Krebs Larsen; Chris Muryn; Jacob Overgaard; S.J. Teat; Grigore A. Timco
Influencing The Nuclearity and Constitution of Heterometallic Rings Via Templates
Chemical Communications, 2005
7100105 CIFC104 H190 Cr8 F12 N4 Ni2 O39P 1 21/n 120.328; 17.41; 23.585
90; 114.734; 90
7581.2R. Winpenny; Andrei S. Batsanov; Finn Krebs Larsen; Chris Muryn; Jacob Overgaard; S.J. Teat; Grigore A. Timco
Influencing The Nuclearity and Constitution of Heterometallic Rings Via Templates
Chemical Communications, 2005
7100106 CIFC97 H182 Cd Cr8 F9 N O37P 1 21/n 119.3987; 22.2606; 31.3094
90; 91.663; 90
13514.5R. Winpenny; Andrei S. Batsanov; Finn Krebs Larsen; Chris Muryn; Jacob Overgaard; S.J. Teat; Grigore A. Timco
Influencing The Nuclearity and Constitution of Heterometallic Rings Via Templates
Chemical Communications, 2005
7100107 CIFC104 H200 Cr9 F12 N Ni O40P 1 21/n 119.934; 16.0192; 26.206
90; 90.054; 90
8368.3R. Winpenny; Andrei S. Batsanov; Finn Krebs Larsen; Chris Muryn; Jacob Overgaard; S.J. Teat; Grigore A. Timco
Influencing The Nuclearity and Constitution of Heterometallic Rings Via Templates
Chemical Communications, 2005
7100108 CIFC91 H167 Cr8 F11 N4 Ni O37P -3 c 136.0766; 36.0766; 19.0238
90; 90; 120
21442.7R. Winpenny; Andrei S. Batsanov; Finn Krebs Larsen; Chris Muryn; Jacob Overgaard; S.J. Teat; Grigore A. Timco
Influencing The Nuclearity and Constitution of Heterometallic Rings Via Templates
Chemical Communications, 2005
7100109 CIFC104 H186.5 Cr8 F12 N4 Ni2 O36.75P 1 21/n 112.5916; 21.808; 27.727
90; 93.89; 90
7596.2R. Winpenny; Andrei S. Batsanov; Finn Krebs Larsen; Chris Muryn; Jacob Overgaard; S.J. Teat; Grigore A. Timco
Influencing The Nuclearity and Constitution of Heterometallic Rings Via Templates
Chemical Communications, 2005
7100110 CIFC116 H214 Cr8 F12 N2 Ni2 O36I 1 2/a 126.003; 19.882; 31.266
90; 102.99; 90
15751R. Winpenny; Andrei S. Batsanov; Finn Krebs Larsen; Chris Muryn; Jacob Overgaard; S.J. Teat; Grigore A. Timco
Influencing The Nuclearity and Constitution of Heterometallic Rings Via Templates
Chemical Communications, 2005
7100111 CIFC107 H198 Cr9 F10 N Ni O40C m c a32.686; 20.8976; 22.154
90; 90; 90
15132R. Winpenny; Andrei S. Batsanov; Finn Krebs Larsen; Chris Muryn; Jacob Overgaard; S.J. Teat; Grigore A. Timco
Influencing The Nuclearity and Constitution of Heterometallic Rings Via Templates
Chemical Communications, 2005
7100112 CIFC89 H159 Cr6 F8 N4 Ni2 O32P 1 21/c 124.9758; 16.6444; 31.0706
90; 111.149; 90
12046.3R. Winpenny; Andrei S. Batsanov; Finn Krebs Larsen; Chris Muryn; Jacob Overgaard; S.J. Teat; Grigore A. Timco
Influencing The Nuclearity and Constitution of Heterometallic Rings Via Templates
Chemical Communications, 2005
7100113 CIFC9.17 H18.26 N2.08 O4P 6518.1402; 18.1402; 6.1582
90; 90; 120
1754.96C. Gorbitz; M. Nilsen; K. Szeto; L.W. Tangen
Chemical Communications, 2005
7100114 CIFC9 H18 N2 O4P 6518.1253; 18.1253; 6.1497
90; 90; 120
1749.66C. Gorbitz; M. Nilsen; K. Szeto; L.W. Tangen
Chemical Communications, 2005
7100115 CIFC9 H18 I0.07 N2 O4P 6518.147; 18.147; 6.1536
90; 90; 120
1754.97C. Gorbitz; M. Nilsen; K. Szeto; L.W. Tangen
Chemical Communications, 2005
7100116 CIFC87 H143 N O41P 21 21 2110.8191; 29.4126; 31.945
90; 90; 90
10165.6Arnaud Grandeury; Samuel Petit; Servane Coste; Gerard Coquerel; Cecile Perrio; Geraldine Gouhier
New synthesis of (Z,E)-2,7-bis(4-cyanobenzylidene)cycloheptan-1-one under stereospecific constraints induced by host-guest interactions
Chemical Communications, 2005
7100117 CIFC37 H50 Cl4 I N3 NiP 1 21/c 112.78; 17.04; 19.13
90; 104.82; 90
4028David Vicic; Thomas J. Anderson; Gavin D. Jones; Chris McFarland
Analysis of Key Steps in the Catalytic Cross-Coupling of Alkyl Electrophiles Under Negishi-like Conditions
Chemical Communications, 2005
7100118 CIFC28 H38 N3 NiP 1 21/c 111.89; 10.947; 20.178
90; 105.977; 90
2525David Vicic; Thomas J. Anderson; Gavin D. Jones; Chris McFarland
Analysis of Key Steps in the Catalytic Cross-Coupling of Alkyl Electrophiles Under Negishi-like Conditions
Chemical Communications, 2005
7100119 CIFC25 H15 Br D6 N5 O6 Re SP -18.6135; 10.6869; 15.705
73.925; 75.037; 83.696
1340.9Reger, Daniel L.; Elgin, J. Derek; Semeniuc, Radu F.; Pellechia, Perry J.; Smith, Mark D.
Directional Control of pi Stacked Building Blocks for Crystal Engineering: the 1,8-Naphthalimide Synthon
Chemical Communications, 2005
7100120 CIFC30 H29 Br N5 O6 ReP -18.8427; 13.4707; 13.9727
67.162; 89.579; 82.302
1518.27Reger, Daniel L.; Elgin, J. Derek; Semeniuc, Radu F.; Pellechia, Perry J.; Smith, Mark D.
Directional Control of pi Stacked Building Blocks for Crystal Engineering: the 1,8-Naphthalimide Synthon
Chemical Communications, 2005
7100121 CIFC48 H57 Cl6 Ir3 N6R 3 m :H24.096; 24.096; 7.479
90; 90; 120
3761Guo-Xin Jin; Chun-Xia Ren; Jianqiang Wang
Route to Multicluster Containing Ancillary ortho-Carborane-1,2-Dithiolato Ligands
Chemical Communications, 2005
7100122 CIFC54 H87 B30 Ir3 N6 S6P 42/n c m :235.258; 35.258; 16.15
90; 90; 90
20076Guo-Xin Jin; Chun-Xia Ren; Jianqiang Wang
Route to Multicluster Containing Ancillary ortho-Carborane-1,2-Dithiolato Ligands
Chemical Communications, 2005
7100123 CIFC36 H62 B20 Cl4 Ir2 N2 S4P -110.223; 11.336; 13.688
101.052; 109.107; 94.826
1452.6Guo-Xin Jin; Chun-Xia Ren; Jianqiang Wang
Route to Multicluster Containing Ancillary ortho-Carborane-1,2-Dithiolato Ligands
Chemical Communications, 2005
7100124 CIFC45 H41 Cl Mn2 N6 O8C 1 2 115.226; 12.924; 10.944
90; 90.157; 90
2153.6Chemical Communications, 2005
7100125 CIFC2 H5 Li SP 1 21/c 18.32854; 5.03756; 9.82453
90; 100.375; 90
405.454Matthias Wagner; Edith Alig; Robert E. Dinnebier; Hans-Wolfram Lerner; Kai Ruth; Ingebororg Sanger; S. Tonnes
Solvent-Free Methylthiomethyllithium [LiCH2SMe] : Solid State Structure and Thermal Decomposition.
Chemical Communications, 2005
7100126 CIFC19 H44 Si8P 1 21/n 19.9526; 16.4089; 18.5655
90; 92.026; 90
3030.1Mitsuo Kira; Natsuki Hamada; Chizuko Kabuto; Wataru Setaka
Intramolecular Charge-Transfer Fluorescence of 1-Phenylbicyclo[2.2.2]octasilane
Chemical Communications, 2005
7100127 CIFC14 H16 N2 O4 SP 21 21 217.7121; 10.729; 17.409
90; 90; 90
1440.5Mitsuo Kira; Natsuki Hamada; Chizuko Kabuto; Wataru Setaka
Intramolecular Charge-Transfer Fluorescence of 1-Phenylbicyclo[2.2.2]octasilane
Chemical Communications, 2005
7100128 CIFN Na SnP 63 m c3.3306; 3.3306; 10.8919
90; 90; 120
104.636Simon Clarke; Oltan Gal; Nicholas Watney; D. Webster; Simon J. Clarke
The first ternary tin (II) nitride: NaSnN
Chemical Communications, 2005
7100129 CIFC108 H163 N8 O25.5P -118.8106; 23.1537; 28.968
98.409; 104.443; 102.706
11645.5Volker Bohmer; Michael Bolte; Yudong Cao.; Myroslav O. Vysotsky; Le-Yong Wang.
Synthesis of Huge Macrocycles Using Twice a Calix[4]arene as Template
Chemical Communications, 2005
7100130 CIFC21 H19 N O3 SP 1 21/n 112.6115; 5.9741; 24.2313
90; 101.681; 90
1787.83Villar, Amparo; Hovelmann, Claas H.; Nieger, Martin; Muniz, Kilian
First Direct Osmium-Catalysed Ketamination of Alkenes
Chemical Communications, 2005
7100131 CIFC44 H26 Cu2 N6 O10P -17.198; 12.339; 12.865
89.136; 84.562; 82.987
1129George Newkome; Charles N. Moorefield; Matthew Panzer; Pingshan Wang.
Terpyridine copperII-polycarboxylic acid architectures: formation of dimeric, helical, and cyclic nanostructures and their included-water molecule motifs
Chemical Communications, 2005
7100132 CIFC44 H28 Cu2 N8 O8F d d d :28.728; 18.451; 49.722
90; 90; 90
8007George Newkome; Charles N. Moorefield; Matthew Panzer; Pingshan Wang.
Terpyridine copperII-polycarboxylic acid architectures: formation of dimeric, helical, and cyclic nanostructures and their included-water molecule motifs
Chemical Communications, 2005
7100133 CIFC44 H28 Cu2 N8 O14P -19.263; 10.844; 12.754
113.383; 93.11; 111.129
1067.3George Newkome; Charles N. Moorefield; Matthew Panzer; Pingshan Wang.
Terpyridine copperII-polycarboxylic acid architectures: formation of dimeric, helical, and cyclic nanostructures and their included-water molecule motifs
Chemical Communications, 2005
7100134 CIFC139.19 H128.81 N12.09 Zn2P -115.1012; 17.6792; 22.9949
80.408; 83.655; 77.243
5886.5Atsuhiro Osuka; Yasuhide Inokuma; Deok Yun Kim; Dongho Kim; Soo Bum Noh; Noboru Ono; Hidemitsu Uno
Enlarged pai-electronic network of a meso-meso beta-beta, beta-beta triply linked dibenzoporphyrin dimer that exhibits a large two-photon cross section
Chemical Communications, 2005
7100135 CIFC18 H21 N O4 SP 1 21/c 15.9474; 19.586; 14.4749
90; 97.26; 90
1672.6P.A.Evans; J.Sawyer; K.W.Lai; J.C.Huffman
Intermolecular rhodium-catalyzed [2+2+2] carbocyclization reactions of 1,6-enynes with symmetrical and unsymmetrical alkynes
Chemical Communications, 2005
7100136 CIFC56 H76 Cl2 Hg N2 O12 S2P c c n21.794; 45.754; 12.395
90; 90; 90
12359.8de Namor,Angela F. Danil; Eduardo E. Castellano; Samir Chahine; H. Donald Brooke Jenkins; Oscar E. Piro
A Preliminary Observation of Additive Thermodynamic Contribution of Pendant Arms to the Complexation of Calixarene Derivatives with Mercury (II)
Chemical Communications, 2005
7100137 CIFC29 H29 Mn2 N3 O8.5 PP 1 21/c 112.1027; 20.563; 13.6644
90; 111.888; 90
3155.5A. Carty; Todd Graham; Konstantin A. Udachin
Reactivity of Electrophilic m2-Phosphinidene Complexes with Heterocumulenes: Formation of the First s-p-Aminophosphaimine Complexes [Mn2(CO)8{m-h1,h2-P(NiPr2)=NR}] and Diazoalkane Insertions into Metal-Phosphorus Bonds.
Chemical Communications, 2005
7100138 CIFC39 H42 Co2 N O4 P3C 1 2/c 130.17; 10.6655; 23.493
90; 102.347; 90
7385A. Carty; Todd Graham; Konstantin A. Udachin
Reactivity of Electrophilic m2-Phosphinidene Complexes with Heterocumulenes: Formation of the First s-p-Aminophosphaimine Complexes [Mn2(CO)8{m-h1,h2-P(NiPr2)=NR}] and Diazoalkane Insertions into Metal-Phosphorus Bonds.
Chemical Communications, 2005
7100139 CIFC40 H38 Mn4 N4 O16 P2P 1 21/c 18.8228; 9.7766; 28.072
90; 97.045; 90
2403.1A. Carty; Todd Graham; Konstantin A. Udachin
Reactivity of Electrophilic m2-Phosphinidene Complexes with Heterocumulenes: Formation of the First s-p-Aminophosphaimine Complexes [Mn2(CO)8{m-h1,h2-P(NiPr2)=NR}] and Diazoalkane Insertions into Metal-Phosphorus Bonds.
Chemical Communications, 2005
7100140 CIFC17 H23 Mn2 N2 O8 P SiP 1 21/c 115.7307; 10.5029; 15.5917
90; 113.01; 90
2371.1A. Carty; Todd Graham; Konstantin A. Udachin
Reactivity of Electrophilic m2-Phosphinidene Complexes with Heterocumulenes: Formation of the First s-p-Aminophosphaimine Complexes [Mn2(CO)8{m-h1,h2-P(NiPr2)=NR}] and Diazoalkane Insertions into Metal-Phosphorus Bonds.
Chemical Communications, 2005
7100141 CIFC14 H14 Mn2 N O8 PP -16.6736; 9.5035; 15.4285
104.344; 96.656; 97.44
928.81A. Carty; Todd Graham; Konstantin A. Udachin
Reactivity of Electrophilic m2-Phosphinidene Complexes with Heterocumulenes: Formation of the First s-p-Aminophosphaimine Complexes [Mn2(CO)8{m-h1,h2-P(NiPr2)=NR}] and Diazoalkane Insertions into Metal-Phosphorus Bonds.
Chemical Communications, 2005
7100142 CIFC64 H72 Cu4 F4 N12 O12 S12P -114.22; 16.12; 18.39
73.37; 89.56; 84.76
4021.5Isamu Kinoshita; Rika Tanaka Hamazawa; Masakazu Hirotsu; Riichi Miyamoto; Takanori Nishioka; L.J. Wright
A Two-Dimensional Clathrate Hydrate Sandwiched by Planar Arrays of a Copper Complex
Chemical Communications, 2005
7100143 CIFC99.5 H105 Cu6 F6 N18 O14.5 S18P -116.65; 16.85; 23.68
78.23; 67.42; 84.61
6004.4Chemical Communications, 2005
7100144 CIFC53 H39 N SiC 1 c 114.3168; 14.7242; 18.7652
90; 102.536; 90
3861.5Mi, Baoxiu; Dong, Yongqiang; Li, Zhen; Lam, Jacky W. Y.; Häußler, Matthias; Sung, Herman H. Y.; Kwok, Hoi-Sing; Dong, Yuping; Williams, Ian D.; Liu, Yunqi; Luo, Yi; Shuai, Zhigang; Zhu, Daoben; Tang, Ben Zhong
Making silole photovoltaically active by attaching carbazolyl donor groups to the silolyl acceptor core
Chemical Communications, 2005, 3583-3585
7100145 CIFC24 H27 Ag B3 F6 N6P -313.9626; 13.9626; 7.4577
90; 90; 120
1259.12L. Barbour; Liliana Dobrzanska; Helgard G. Raubenheimer
Borromean sheets assembled by self-supporting argentophilic interactions
Chemical Communications, 2005
7100146 CIFC183 H127 Cl48 Co6 N17 O35P -19.0119; 34.547; 46.453
89.623; 85.25; 89.862
14412J. Veciana; Neus Domingo; Joan-Manuel Hernandez; F. Lloret; Daniel Maspoch; C. Rovira; Daniel Ruiz-Molina; Javier Tejada; Gavin Vaughan; Klaus Wurst
Ferromagnetic interactions in a metal-organic radical-based (6,3)-helical network with large channels
Chemical Communications, 2005
7100147 CIFC37 H74 B9 Mo2 N3 O6P c a 2126.518; 17.1036; 20.3798
90; 90; 90
9243.4P. Lei; T.D. McGrath; F.G.A. Stone
The bis-molybdenum(0) trianion [1,3,6-{Mo(CO)~3~}-3,6-(μ-H)~2~-1,1,1- (CO)~3~-2-Ph-closo-1,2-MoCB~9~H~7~]^3-^ and its use as a scaffold in the assembly of heteropolymetallic complexes
Chemical Communications, 2005
7100148 CIFC44.5 H59 B9 Cl Mo N O3 P2 PtP 1 21/n 114.4426; 22.8219; 15.1963
90; 101.002; 90
4916.8P. Lei; T.D. McGrath; F.G.A. Stone
The bis-molybdenum(0) trianion [1,3,6-{Mo(CO)~3~}-3,6-(μ-H)~2~-1,1,1- (CO)~3~-2-Ph-closo-1,2-MoCB~9~H~7~]^3-^ and its use as a scaffold in the assembly of heteropolymetallic complexes
Chemical Communications, 2005
7100149 CIFC40.125 H40.25 B9 Cl2.25 Mn Mo O6 P2 PtC 1 2/c 156.424; 11.4786; 38.7221
90; 129.652; 90
19309.1P. Lei; T.D. McGrath; F.G.A. Stone
The bis-molybdenum(0) trianion [1,3,6-{Mo(CO)~3~}-3,6-(μ-H)~2~-1,1,1- (CO)~3~-2-Ph-closo-1,2-MoCB~9~H~7~]^3-^ and its use as a scaffold in the assembly of heteropolymetallic complexes
Chemical Communications, 2005

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