Crystallography Open Database

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Searching space group like 'P 1 21/n 1'

COD ID: 1000002
CIF file Formula: - C3 D3 O7 Sr -
Comments: Vanhoyland, G.; Bourée, F.; Van Bael, M. K.; Mullens, J.; Van Poucke, L. C. Structure determination and refinement of acid strontium oxalate from X-ray and neutron powder diffraction Journal of Solid State Chemistry 157(2) (2001) 283-288
Space group: P 1 21/n 1
Cell volume: 613.2
Cell parameters: 6.341; 16.88; 5.7798; 90; 97.6; 90;  

COD ID: 1000005
CIF file Formula: - F16 H3 O6 Sr5 V3 -
Comments: ()
Space group: P 1 21/n 1
Cell volume: 1753.4
Cell parameters: 11.217; 8.1775; 19.887; 90; 105.999; 90;  

COD ID: 1000101
CIF file Formula: - Co3 H4 O10 P2 -
Comments: Pizarro, J L; Villeneuve, G; Hagenmuller, P; Le Bail, A Synthesis, crystal structure, and magnetic properties of Co~3~(HPO~4~)~2~(OH)~2~ related to the mineral lazulite Journal of Solid State Chemistry 92 (1991) 273-285
Space group: P 1 21/n 1
Cell volume: 370
Cell parameters: 7.531; 7.516; 7.7; 90; 121.91; 90;  

COD ID: 1000102
CIF file Formula: - Co3 H4 O10 P2 -
Comments: Pizarro, J L; Villeneuve, G; Hagenmuller, P; Le Bail, A Synthesis, crystal structure, and magnetic properties of Co~3~(HPO~4~)~2~(OH)~2~ related to the mineral lazulite Journal of Solid State Chemistry 92 (1991) 273-285
Space group: P 1 21/n 1
Cell volume: 366.1
Cell parameters: 7.5024; 7.4896; 7.6716; 90; 121.864; 90;  

COD ID: 1000122
CIF file Formula: - Ba F5 Fe -
Comments: Le Bail, A.; Mercier, A. M. Helical octahedral cis chains in α'-BaFeF~5~ European Journal of Solid State and Inorganic Chemistry 32 (1995) 15-24
Space group: P 1 21/n 1
Cell volume: 856.9
Cell parameters: 9.532; 7.901; 11.398; 90; 93.45; 90;  

COD ID: 1000130
CIF file Formula: - Al Ba F5 -
Comments: Le Bail, A.; Ferey, G.; Mercier, A.-M.; de Kozak, A.; Samouel, M. Structure determination of β- and γ-BaAlF~5~ by X-ray and neutron powder diffraction: a model for the α→ β ←→ γ transitions Journal of Solid State Chemistry 89 (1990) 282-291
Space group: P 1 21/n 1
Cell volume: 761
Cell parameters: 5.1517; 19.56659; 7.5567; 90; 92.426; 90;  

COD ID: 1000143
CIF file Formula: - H0.67 Li0.33 O3 Sb -
Comments: Fourquet, J L; Gillet, P A; Le Bail, A Li+ / H+ topotactic exchange on Li Sb O3: The series Li(1-x) Hx Sb O3 (0<=x<=1). Materials Research Bulletin 24 (1989) 1207-1214
Space group: P 1 21/n 1
Cell volume: 214.6
Cell parameters: 5.2526; 4.7331; 8.6322; 90; 90.8; 90;  

COD ID: 1000148
CIF file Formula: - Li6 O18 P6 -
Comments: Ben-Chaabane, T.; Smiri-Dogguy, L.; Laligant, Y.; Le Bail, A. Li~6~P~6~O~18~: X-ray powder structure determination of lithium cyclohexaphosphate European Journal of Solid State and Inorganic Chemistry 35(3) (1998) 255-264
Space group: P 1 21/n 1
Cell volume: 714.4
Cell parameters: 7.9911; 17.03189; 5.3208; 90; 99.433; 90;  

COD ID: 1000201
CIF file Formula: - Ba2 Co F9 Fe -
Comments: de Kozak, A; Leblanc, M; Samouel, M; Ferey, G; de Pape, R Structure Crystalline de Ba~2~ Co Fe F~9~ Revue de Chimie Minerale 18 (1981) 659-666
Space group: P 1 21/n 1
Cell volume: 755.9
Cell parameters: 7.486; 17.757; 5.687; 90; 90.87; 90;  

COD ID: 1000203
CIF file Formula: - Ba Cr2 F9 Na -
Comments: Ferey, G; Leblanc, M; Kozak, A de; Samouel, M; Pannetier, J Crystal Structure of Na Ba Cr~2~ F~9~ - structural correlations with other Enneafluorides. Journal of Fluorine Chemistry 23 (1983) 442-442
Space group: P 1 21/n 1
Cell volume: 689.5
Cell parameters: 7.38; 17.311; 5.398; 90; 91.14; 90;  

COD ID: 1000204
CIF file Formula: - Ba Cr2 F9 Na -
Comments: Ferey, G; Leblanc, M; Kozak, A; Samouel, M; Pannetier, J Crystal structures of Na Ba Cr~2~ F~9~ and Na Ba Fe~2~ F~9~ Structural correlations with other enneafluorides, particularly with K Pb Cr~2~ F~9~ Journal of Solid State Chemistry 56 (1985) 288-297
Space group: P 1 21/n 1
Cell volume: 683.7
Cell parameters: 7.318; 17.311; 5.398; 90; 91.14; 90;  

COD ID: 1000205
CIF file Formula: - Ba F9 Fe2 Na -
Comments: Ferey, G; Leblanc, M; Kozak, A; Samouel, M; Pannetier, J Crystal structures of Na Ba Cr~2~ F~9~ and Na Ba Fe~2~ F~9~ Structural correlations with other enneafluorides, particularly with K Pb Cr~2~ F~9~ Journal of Solid State Chemistry 56 (1985) 288-297
Space group: P 1 21/n 1
Cell volume: 707.5
Cell parameters: 7.363; 17.527; 5.484; 90; 91.5; 90;  

COD ID: 1000219
CIF file Formula: - Ba F9 Fe2 Na -
Comments: De Kozak, A; Samouel, M; Leblanc, M; Ferey, G; Pannetier, J Magnetic structure of the canted 1D-antiferromagnet Na Ba Fe~2~ F~9~ Solid State Communications 55 (1985) 887-890
Space group: P 1 21/n 1
Cell volume: 697.3
Cell parameters: 7.3236; 17.4525; 5.4586; 90; 91.84; 90;  

COD ID: 1000338
CIF file Formula: - Ba3 Cr4 F20 Na2 -
Comments: Abjean, P; Leblanc, M; De, Pape R; Ferey, G Structure of Na~2~ Ba~3~ Cr~4~ F~20~ Acta Crystallographica C (39,1983-) 41 (1985) 1696-1698
Space group: P 1 21/n 1
Cell volume: 815.1
Cell parameters: 7.262; 20.668; 5.431; 90; 90.76; 90;  

COD ID: 1000377
CIF file Formula: - Ga2 H9 N O11 P2 -
Comments: Loiseau, T; Ferey, G Crystal structure of (N H4) (Ga2 (P O4)2(O H)(H2 O)),(H2 O), isotypic with ALPO4-15 European Journal of Solid State Inorganic Chemistry 31 (1994) 575-581
Space group: P 1 21/n 1
Cell volume: 897.4
Cell parameters: 9.689; 9.703; 9.788; 90; 102.78; 90;  

COD ID: 1000427
CIF file Formula: - Bi2 O11 Te4 -
Comments: Rossell, H. J.; Leblanc, M.; Ferey, G.; Bevan, D. J. M.; Simpson, D. J.; Taylor, M. R. On the crystal structure of Bi2Te4O11 Locality: synthetic Australian Journal of Chemistry 45 (1992) 1415-1425
Space group: P 1 21/n 1
Cell volume: 1047.2
Cell parameters: 6.9909; 7.9593; 18.89629; 90; 95.176; 90;  

COD ID: 1000430
CIF file Formula: - F2 Fe O4 P Sr -
Comments: Le Meins, J-M; Hemon-Ribaud, A; Laligant, Y; Courbion, G A new fluorophosphate with a laueite-type structural unit: synthesis, TEM study and crystal structure of Sr Fe P O4 F2 European Journal of Solid State Inorganic Chemistry 34 (1997) 391-404
Space group: P 1 21/n 1
Cell volume: 436.1
Cell parameters: 5.207; 12.216; 7.037; 90; 103; 90;  

COD ID: 1000435
CIF file Formula: - Fe2 H9 N O11 P2 -
Comments: Cavellec, M; Riou, D; Ferey, G Synthetic spheniscidite Acta Crystallographica C (39,1983-) 50 (1994) 1379-1381
Space group: P 1 21/n 1
Cell volume: 920.8
Cell parameters: 9.8232; 9.7376; 9.8716; 90; 102.803; 90;  

COD ID: 1000458
CIF file Formula: - C2.25 H10.5 F2 Ga3 N1.5 O12.5 P3 -
Comments: Loiseau, T; Taulelle, F; Ferey, G Crystal structure and solid-state nuclear magnetic resonance characterization of an oxyfluorinated three-dimensional framework gallophosphate with ULM-4 structural type. Structural relationships with (Ga As O4)-2 Microporous Materials 9 (1997) 83-93
Space group: P 1 21/n 1
Cell volume: 1483.2
Cell parameters: 8.674; 10.19; 16.82599; 90; 94.21; 90;  

COD ID: 1000486
CIF file Formula: - F2 Ga H O8 P2 Sr2 -
Comments: Le Meins, J.-M.; Hemon-Ribaud, A.; Courbion, G. Synthesis and crystal structure of two fluorophosphated compounds with different infinite sheets: Sr~2~Ga(HPO~4~)(PO~4~)F~2~ and Sr~2~Fe~2~(HPO~4~)(PO~4~)~2~F~2~ European Journal of Solid State and Inorganic Chemistry 35(2) (1998) 117-132
Space group: P 1 21/n 1
Cell volume: 769.2
Cell parameters: 8.257; 7.205; 13.596; 90; 108.02; 90;  

COD ID: 1001410
CIF file Formula: - Ca3.11 Na8 O17.52 U3.7 -
Comments: Gasperin, M; Cousson, A; He, L; Jove, J Structure d'un Oxyde d'Uranium a Valence Mixte et Etude par Spectroscopie Mossbauer (^237^Np) d'un Oxyde Isotype de Neptunium Journal of the Less-Common Metals 152 (1989) 339-348
Space group: P 1 21/n 1
Cell volume: 563.2
Cell parameters: 8.258; 8.271; 8.25; 90; 91.78; 90;  

COD ID: 1001428
CIF file Formula: - Ca Cu O7 P2 -
Comments: Riou, D.; Goreaud, M. CaCuP~2~O~7~:a structure closely related to α-Ca~2~P~2~O~7~ Acta Crystallographica, Section C: Crystal Structure Communications 46(7) (1990) 1191-1193
Space group: P 1 21/n 1
Cell volume: 518.1
Cell parameters: 5.2104; 8.0574; 12.344; 90; 91.356; 90;  

COD ID: 1001466
CIF file Formula: - Co O7 P2 Sr -
Comments: Riou, D; Raveau, B Structure of SrCoP~2~O~7~ Acta Crystallographica C (39,1983-) 47 (1991) 1708-1709
Space group: P 1 21/n 1
Cell volume: 556.5
Cell parameters: 5.3165; 8.2574; 12.6755; 90; 90.133; 90;  

COD ID: 1001472
CIF file Formula: - Er O6 Ru Sr2 -
Comments: Battle, P D; Jones, C W; Studer, F The crystal and magnetic structures of Ca~2~NdRuO~6~,Ca~2~HoRuO~6~ and Sr~2~ErRuO~6~ Journal of Solid State Chemistry 90 (1991) 302-312
Space group: P 1 21/n 1
Cell volume: 270.9
Cell parameters: 5.7626; 5.7681; 8.1489; 90; 90.19; 90;  

COD ID: 1001473
CIF file Formula: - Er O6 Ru Sr2 -
Comments: Battle, P D; Jones, C W; Studer, F The crystal and magnetic structures of Ca~2~NdRuO~6~,Ca~2~HoRuO~6~ and Sr~2~ErRuO~6~ Journal of Solid State Chemistry 90 (1991) 302-312
Space group: P 1 21/n 1
Cell volume: 269.6
Cell parameters: 5.75; 5.7636; 8.1354; 90; 90.22; 90;  

COD ID: 1001474
CIF file Formula: - Ca2 Nd O6 Ru -
Comments: Battle, P D; Jones, C W; Studer, F The crystal and magnetic structures of Ca~2~NdRuO~6~,Ca~2~HoRuO~6~ and Sr~2~ErRuO~6~ Journal of Solid State Chemistry 90 (1991) 302-312
Space group: P 1 21/n 1
Cell volume: 259.4
Cell parameters: 5.5564; 5.8296; 8.0085; 90; 90.07; 90;  

COD ID: 1001475
CIF file Formula: - Ca2 Nd O6 Ru -
Comments: Battle, P D; Jones, C W; Studer, F The crystal and magnetic structures of Ca~2~NdRuO~6~,Ca~2~HoRuO~6~ and Sr~2~ErRuO~6~ Journal of Solid State Chemistry 90 (1991) 302-312
Space group: P 1 21/n 1
Cell volume: 258.3
Cell parameters: 5.5439; 5.8282; 7.9931; 90; 90.06; 90;  

COD ID: 1001476
CIF file Formula: - Ca2 Ho O6 Ru -
Comments: Battle, P D; Jones, C W; Studer, F The crystal and magnetic structures of Ca~2~NdRuO~6~,Ca~2~HoRuO~6~ and Sr~2~ErRuO~6~ Journal of Solid State Chemistry 90 (1991) 302-312
Space group: P 1 21/n 1
Cell volume: 252
Cell parameters: 5.4991; 5.7725; 7.9381; 90; 90.18; 90;  

COD ID: 1001517
CIF file Formula: - K Mo O8 P2 -
Comments: Gueho, C; Borel, M M; Grandin, A; Leclaire, A; Raveau, B Crystal structure of the molybdenum(V) diphosphate KMoP~2~O~8~ isotypic with KNbP~2~O~8~ Zeitschrift fuer Anorganische und Allgemeine Chemie 615 (1992) 104-108
Space group: P 1 21/n 1
Cell volume: 684.6
Cell parameters: 5.0862; 11.72; 11.486; 90; 90.91; 90;  

COD ID: 1001618
CIF file Formula: - Cs Mo O8 P2 -
Comments: Guesdon, A; Borel, M M; Leclaire, A; Grandin, A; Raveau, B A molybdenum (V) diphosphate closely related to the $-alpha- NaTiP~2~O~7~ structure: Cs(MoO)P~2~O~7~ Journal of Solid State Chemistry 108 (1994) 46-50
Space group: P 1 21/n 1
Cell volume: 724.7
Cell parameters: 5.134; 11.707; 12.063; 90; 91.77; 90;  

COD ID: 1001713
CIF file Formula: - Li Mo O8 P2 -
Comments: Ledain, S; Borel, M M; Leclaire, A; Provost, J; Raveau, B A molybdenum V diphosphate involving Li O4 tetrahedra: Li Mo O P2 O7 Journal of Solid State Chemistry 120 (1995) 260-267
Space group: P 1 21/n 1
Cell volume: 1843.9
Cell parameters: 16.04599; 11.951; 9.937; 90; 104.62; 90;  

COD ID: 1001809
CIF file Formula: - Mo1.983 O17 P3 Rb2 W1.017 -
Comments: Leclaire, A; Borel, M M; Chardon, J; Raveau, B Mixed valent molybdenotungsten monophosphate Rb2 Mo2 W O5 (P O4)3: an interconnected tunnel structure Journal of Solid State Chemistry 130 (1997) 48-53
Space group: P 1 21/n 1
Cell volume: 1494.4
Cell parameters: 10.756; 9.493; 15.478; 90; 108.99; 90;  

COD ID: 1001823
CIF file Formula: - La2 Mg O6 Pt -
Comments: Ouchetto, K; Archaimbault, F; Choisnet, J; Et-Tabirou, M New ordered and distorted perovskites: the mixed platinates Ln2 M Pt O6 (Ln = La, Pr, Nd, Sm, Eu, Gd; M = Mg, Co, Ni, Zn) Materials Chemistry and Physics 51 (1997) 117-124
Space group: P 1 21/n 1
Cell volume: 249
Cell parameters: 5.5919; 5.6277; 7.914; 90; 90; 90;  

COD ID: 1001824
CIF file Formula: - La2 Ni O6 Pt -
Comments: Ouchetto, K; Archaimbault, F; Choisnet, J; Et-Tabirou, M New ordered and distorted perovskites: the mixed platinates Ln2 M Pt O6 (Ln = La, Pr, Nd, Sm, Eu, Gd; M = Mg, Co, Ni, Zn) Materials Chemistry and Physics 51 (1997) 117-124
Space group: P 1 21/n 1
Cell volume: 247.9
Cell parameters: 5.5741; 5.6304; 7.8973; 90; 90; 90;  

COD ID: 1001825
CIF file Formula: - La2 O6 Pt Zn -
Comments: Ouchetto, K; Archaimbault, F; Choisnet, J; Et-Tabirou, M New ordered and distorted perovskites: the mixed platinates Ln2 M Pt O6 (Ln = La, Pr, Nd, Sm, Eu, Gd; M = Mg, Co, Ni, Zn) Materials Chemistry and Physics 51 (1997) 117-124
Space group: P 1 21/n 1
Cell volume: 252.5
Cell parameters: 5.5944; 5.6879; 7.9351; 90; 90; 90;  

COD ID: 1001826
CIF file Formula: - Co La2 O6 Pt -
Comments: Ouchetto, K; Archaimbault, F; Choisnet, J; Et-Tabirou, M New ordered and distorted perovskites: the mixed platinates Ln2 M Pt O6 (Ln = La, Pr, Nd, Sm, Eu, Gd; M = Mg, Co, Ni, Zn) Materials Chemistry and Physics 51 (1997) 117-124
Space group: P 1 21/n 1
Cell volume: 248.2
Cell parameters: 5.5722; 5.6459; 7.8906; 90; 90; 90;  

COD ID: 1001827
CIF file Formula: - Co O6 Pr2 Pt -
Comments: Ouchetto, K; Archaimbault, F; Choisnet, J; Et-Tabirou, M New ordered and distorted perovskites: the mixed platinates Ln2 M Pt O6 (Ln = La, Pr, Nd, Sm, Eu, Gd; M = Mg, Co, Ni, Zn) Materials Chemistry and Physics 51 (1997) 117-124
Space group: P 1 21/n 1
Cell volume: 243.5
Cell parameters: 5.4833; 5.7043; 7.7842; 90; 90; 90;  

COD ID: 1001828
CIF file Formula: - Co Nd2 O6 Pt -
Comments: Ouchetto, K; Archaimbault, F; Choisnet, J; Et-Tabirou, M New ordered and distorted perovskites: the mixed platinates Ln2 M Pt O6 (Ln = La, Pr, Nd, Sm, Eu, Gd; M = Mg, Co, Ni, Zn) Materials Chemistry and Physics 51 (1997) 117-124
Space group: P 1 21/n 1
Cell volume: 240.3
Cell parameters: 5.4416; 5.6975; 7.7495; 90; 90; 90;  

COD ID: 1004033
CIF file Formula: - C6 H18 N2 O12 P3 Zn2 -
Comments: Josien, L.; Simon-Masseron, A.; Fleith, S.; Gramlich, V.; Patarin, J. Hydrothermal synthesis and characterization of new phosphate-based materials prepared in the presence of 1,4-dimethylpiperazine Impact of Zeolites and other Porous Materials on the new Technologies at the Beginning of the New Millennium Proceedings of the 2nd International FEZA (Federation of the European Zeolite Associations) Conference 142 (2002) 415-422
Space group: P 1 21/n 1
Cell volume: 1551.8
Cell parameters: 8.641; 14.364; 12.581; 90; 96.39; 90;  

COD ID: 1004106
CIF file Formula: - Ba2 Ni O8 P2 -
Comments: Elbali, B; Boukhari, A; Aride, J; Belaiche, M; Abraham, F; Drillon, M Crystal structure and magnetic properties of Ba2 Ni (P O4)2 European Journal of Solid State Inorganic Chemistry 31 (1994) 61-73
Space group: P 1 21/n 1
Cell volume: 750.1
Cell parameters: 5.312; 8.789; 16.06699; 90; 90.72; 90;  

COD ID: 1004108
CIF file Formula: - Bi Ni O5 P -
Comments: Abraham, F; Ketatni, M Crystal structure of a new bismuth nickel oxophosphate: Bi Ni O P O4 European Journal of Solid State Inorganic Chemistry 32 (1995) 429-437
Space group: P 1 21/n 1
Cell volume: 396.7
Cell parameters: 7.1664; 11.206; 5.1732; 90; 107.28; 90;  

COD ID: 1004112
CIF file Formula: - Cu Na2 O7 P2 -
Comments: Erragh, F; Boukhari, A; Abraham, F; Elouadi, B The crystal structure of $-alpha- and $-beta- Na2 Cu P2 O7 Journal of Solid State Chemistry 120 (1995) 23-31
Space group: P 1 21/n 1
Cell volume: 607.4
Cell parameters: 8.823; 13.494; 5.108; 90; 92.77; 90;  

COD ID: 1006046
CIF file Formula: - La2 Li O6 Sb -
Comments: Lopez, M L; Veiga, M L; Rodriguez-Carvajal, J; Fernandez, F; Jerez, A; Pico, C The monoclinic perovskite La~2~LiSbO~6~. A Rietveld refinement of neutron powder diffraction data Materials Research Bulletin 27 (1992) 647-654
Space group: P 1 21/n 1
Cell volume: 256.3
Cell parameters: 5.6226; 5.7199; 7.9689; 90; 89.796; 90;  

COD ID: 1007002
CIF file Formula: - K3 O9 P3 -
Comments: Bagieu-Beucher, M; Tordjman, I; Durif, A; Guitel, J C Structure cristalline du trimetaphosphate de potassium K~3~ P~3~ O~9~ Acta Crystallographica B (24,1968-38,1982) 32 (1976) 1427-1430
Space group: P 1 21/n 1
Cell volume: 952
Cell parameters: 11.074; 11.965; 7.35; 90; 102.18; 90;  

COD ID: 1007007
CIF file Formula: - Cd3 H20 O28 P6 -
Comments: Averbuch-Pouchot, M T; Durif, A; Guitel, J C Trimetaphosphate de cadmium decahydrate Acta Crystallographica B (24,1968-38,1982) 32 (1976) 1894-1896
Space group: P 1 21/n 1
Cell volume: 1245.2
Cell parameters: 9.424; 17.87; 7.762; 90; 107.72; 90;  

COD ID: 1007017
CIF file Formula: - Be O6 P2 -
Comments: Averbuch-Pouchot, M T; Durif, A; Tordjman, I Structure cristalline du polyphosphate de beryllium: Be (P O~3~)~2~ (II) Acta Crystallographica B (24,1968-38,1982) 33 (1977) 3462-3464
Space group: P 1 21/n 1
Cell volume: 414.4
Cell parameters: 6.959; 12.853; 4.839; 90; 106.79; 90;  

COD ID: 1007019
CIF file Formula: - H16 Na2 Ni O20 P4 -
Comments: Boudjada, A; Durif, A; Guitel, J C Structure cristalline d'un monophosphate acide mixte de nickel-sodium tetrahydrate Na~2~ Ni H~8~ (P O~4~)~4~ (H~2~ O)~4~ Acta Crystallographica B (24,1968-38,1982) 34 (1978) 17-20
Space group: P 1 21/n 1
Cell volume: 845.2
Cell parameters: 11.1; 10.71; 7.224; 90; 100.2; 90;  

COD ID: 1007021
CIF file Formula: - H2 Hg4 N O8 P -
Comments: Durif, A; Tordjman, I; Masse, R; Guitel, J C Structure cristalline du nitro-phosphate mercureux: Hg~4~ P O~4~ N O~3~ (H~2~ O) Journal of Solid State Chemistry 24 (1978) 101-105
Space group: P 1 21/n 1
Cell volume: 903.2
Cell parameters: 18.38; 8.258; 5.952; 90; 91.2; 90;  

COD ID: 1007022
CIF file Formula: - Ba H2 K O10 P3 -
Comments: Seethanen, D; Durif, A Structure cristalline du trimetaphosphate de baryum-potassium monohydrate: Ba K P~3~ O~9~ (H~2~ O) Acta Crystallographica B (24,1968-38,1982) 34 (1978) 1091-1093
Space group: P 1 21/n 1
Cell volume: 932.6
Cell parameters: 7.34; 17.77; 7.18; 90; 95.24; 90;  

COD ID: 1007032
CIF file Formula: - Ca H4 N O9 P3 -
Comments: Masse, R; Durif, A; Guitel, J C Structure cristalline du trimetaphosphates Ca N H~4~ P~3~ O~9~, Ca K P~3~ O~9~, Ca Cs P~3~ O~9~ et Ca N H~4~ P~3~ O9 (H~2~ O)~3~ Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 141 (1975) 113-125
Space group: P 1 21/n 1
Cell volume: 932.5
Cell parameters: 7.446; 12.461; 10.05; 90; 90.11; 90;  

COD ID: 1007034
CIF file Formula: - Ba H6 N O10 P3 -
Comments: Durif, A; Marin, C; Bassi, G Donnees cristallographiques sur Ba (N H~4~) P~3~ O~9~ (H~2~ O) et Ba Tl P~3~ O~9~ (H~2~ O). Structure cristalline de Ba (N H~4~) P~3~ O~9~ (H~2~ O) Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977) 98 (1975) 19-24
Space group: P 1 21/n 1
Cell volume: 1052
Cell parameters: 11.7; 12.12; 7.559; 90; 101.05; 90;  

COD ID: 1007045
CIF file Formula: - Ag4 H8 O14 P2 Te -
Comments: Durif, A; Averbuch-Pouchot, M T Crystal structure of a silver phosphate-tellurate: Te (O H)~6~ (Ag~2~ H P O~4~)~2~ Zeitschrift fuer Anorganische und Allgemeine Chemie 472 (1981) 129-132
Space group: P 1 21/n 1
Cell volume: 617
Cell parameters: 5.95; 20.52; 5.829; 90; 119.89; 90;  

COD ID: 1007055
CIF file Formula: - Cd H8 O10 P2 -
Comments: Averbuch-Pouchot, M T; Durif, A; Guitel, J C; Tordjman, I; Laugt, M Structure cristalline de Cd (H~2~ P O~4~)~2~ (H~2~ O)~2~ Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977) 96 (1973) 278-280
Space group: P 1 21/n 1
Cell volume: 413.4
Cell parameters: 7.352; 10.425; 5.406; 90; 93.79; 90;  

COD ID: 1007088
CIF file Formula: - H Mn O7 P2 -
Comments: Durif, A; Averbuch-Pouchot, M T Structure du Diphosphate Acide de Manganese(III): Mn H P~2~ O~7~ Acta Crystallographica B (24,1968-38,1982) 38 (1982) 2883-2885
Space group: P 1 21/n 1
Cell volume: 485.9
Cell parameters: 7.951; 12.645; 4.922; 90; 100.92; 90;  

COD ID: 1007135
CIF file Formula: - Cu H24 Na3 O22 P3 -
Comments: Jouini, O; Dabbabi, M; Averbuch-Pouchot, MT; Guitel, J C; Durif, A Structure du Phosphate de Cuivre(II) et de Trisodium Dodecahydrate, Cu Na~3~ P~3~ O~10~ (H~2~ O)~12~ Acta Crystallographica C (39,1983-) 40 (1984) 728-730
Space group: P 1 21/n 1
Cell volume: 2052.5
Cell parameters: 15.052; 9.234; 14.767; 90; 90.03; 90;  

COD ID: 1007136
CIF file Formula: - H10 O14 P2 Te Tl2 -
Comments: Averbuch-Pouchot, M T; Durif, A Crystal data for two new phosphate-tellurates: Te (O H)~6~ (Tl (H~2~ P O~4~))~2~ (Tl~2~ (H P O~4~)) and Te (O H)~6~ (Tl (H~2~ P O~4~))~2~. Crystal structure of Te (O H)~6~ (Tl (H~2~ P O~4~))~2~. Materials Research Bulletin 16 (1981) 71-76
Space group: P 1 21/n 1
Cell volume: 667
Cell parameters: 6.285; 14.74; 7.844; 90; 113.38; 90;  

COD ID: 1007139
CIF file Formula: - Cs2 H7 O10 P Te -
Comments: Averbuch-Pouchot, M T; Durif, A; Guitel, J C Crystal structures of two cesium phosphate-tellurates: (Te(O H)~6~) (Cs~2~ H P O~4~) and (Te(O H)~6~) (Cs~2~ H P O~4~) (Cs H~2~ P O~4~)~2~ Materials Research Bulletin 15 (1980) 387-395
Space group: P 1 21/n 1
Cell volume: 1056.8
Cell parameters: 8.204; 18.416; 6.995; 90; 89.89; 90;  

COD ID: 1007141
CIF file Formula: - H3 K2 O8 P S -
Comments: Averbuch-Pouchot, M T; Durif, A Crystal structure of (K H SO~4~)(K H~2~ P O~4~) Materials Research Bulletin 15 (1980) 427-430
Space group: P 1 21/n 1
Cell volume: 384.7
Cell parameters: 7.434; 7.341; 7.148; 90; 99.56; 90;  

COD ID: 1007177
CIF file Formula: - Cu H16 I2 K4 O20 -
Comments: Masse, R; Durif, A A Copper(III) Periodate Peroxo Complex K~4~H~4~Cu(IO~6~)~2~O~2~ 6H~2~O Journal of Solid State Chemistry 73 (1988) 206-210
Space group: P 1 21/n 1
Cell volume: 949.9
Cell parameters: 12.65; 9.78; 7.71; 90; 95.2; 90;  

COD ID: 1007181
CIF file Formula: - Co Nb2 O21 P6 -
Comments: Averbuch-Pouchot, M T; Durif, A Crystal data and structure of Nb~2~Co(P~2~O~7~)~3~ and Nb~2~Mg(P~2~O~7~)~3~ Zeitschrift fuer Kristallographie (149,1979-) 180 (1987) 195-202
Space group: P 1 21/n 1
Cell volume: 784.4
Cell parameters: 15.32; 7.89; 6.49; 90; 90.76; 90;  

COD ID: 1007184
CIF file Formula: - Cu H16 I2 K4 O20 -
Comments: Masse, R; Durif, A A Copper(III) Periodate Peroxo Complex: K~4~ H~4~ Cu (I O~6~)~2~ O~2~ 6(H~2~ O) Journal of Solid State Chemistry 73 (1988) 206-210
Space group: P 1 21/n 1
Cell volume: 949.9
Cell parameters: 12.65; 9.78; 7.71; 90; 95.2; 90;  

COD ID: 1007193
CIF file Formula: - H20 N4 Na2 O20 P6 -
Comments: Averbuch-Pouchot, M T; Durif, A Crystal chemistry of cyclo-hexaphosphates. XV.Structures of sodium ammonium cyclo-hexaphosphate dihydrate and sodium rubidium cyclo- hexaphosphate hexahydrate Acta Crystallographica C (39,1983-) 47 (1991) 932-936
Space group: P 1 21/n 1
Cell volume: 1031.1
Cell parameters: 13.363; 11.58; 6.809; 90; 101.87; 90;  

COD ID: 1007202
CIF file Formula: - H30 I N7 O19 P6 -
Comments: Averbuch-Pouchot, M T; Durif, A (NH~4~)~6~P~6~O~18~.NH~4~X.H~2~O (X=Cl,Br,I). The first examples of cyclohexaphosphate-halides European Journal of Solid State Inorganic Chemistry 30 (1993) 447-459
Space group: P 1 21/n 1
Cell volume: 2490.1
Cell parameters: 14.96; 24.819; 6.71; 90; 91.86; 90;  

COD ID: 1007203
CIF file Formula: - C3 H22 N9 O11 P3 -
Comments: Averbuch-Pouchot, M T; Durif, A (Tris)guanidinium cyclotriphosphate and (tetra)guanidinium cyclotetraphosphate: two new examples of organic-cation cyclophosphates European Journal of Solid State Inorganic Chemistry 30 (1993) 471-482
Space group: P 1 21/n 1
Cell volume: 1956.5
Cell parameters: 12.14; 15.183; 10.706; 90; 97.49; 90;  

COD ID: 1007217
CIF file Formula: - C8 H52 N24 O26 P8 -
Comments: Averbuch, - Pouchot M T; Durif, A; Schuelke, U Guanidinium cyclooctaphosphate dihydrate elaboration and crystal structure European Journal of Solid State Inorganic Chemistry 30 (1993) 741-750
Space group: P 1 21/n 1
Cell volume: 2260.3
Cell parameters: 12.621; 20.41; 9.365; 90; 110.45; 90;  

COD ID: 1007225
CIF file Formula: - H13 N2 O10 P2 Te0.5 -
Comments: Averbuch-Pouchot, M. T.; Durif, A. Structure of an adduct between diammonium dihydrogendiphoshate and telluric acid: (NH~4~)~2~H~2~P~2~O~7~ . Te(OH)~6~ Acta Crystallographica, Section C: Crystal Structure Communications 48(6) (1992) 973-975
Space group: P 1 21/n 1
Cell volume: 1019.9
Cell parameters: 7.651; 21.78999; 6.689; 90; 113.85; 90;  

COD ID: 1007228
CIF file Formula: - O9 P3 Pb Rb -
Comments: Prisset, J - L; Averbuch-Pouchot, M - T; Durif, A The Pb (P O3)2-Rb (P O3) phase-equilibrium crystal structure of Pb Rb (P O3)3 European Journal of Solid State Inorganic Chemistry 31 (1994) 37-46
Space group: P 1 21/n 1
Cell volume: 1685.1
Cell parameters: 14.05; 17.09; 7.228; 90; 103.85; 90;  

COD ID: 1007251
CIF file Formula: - Ba Cd O12 P4 -
Comments: Averbuch-Pouchot, M T; Durif, A; Guitel, J C Structure cristalline du polyphophate de cadmium-baryum: Cd Ba (P O3)4 Acta Crystallographica B (24,1968-38,1982) 31 (1975) 2453-2456
Space group: P 1 21/n 1
Cell volume: 991.3
Cell parameters: 14.94; 9.192; 7.219; 90; 90.79; 90;  

COD ID: 1007262
CIF file Formula: - Mg0.98 Nb2.02 O21 P6 -
Comments: Averbuch-Pouchot, M T; Durif, A Crystal data and structure of Nb2 Co (P2 O7)3 and Nb2 Mg (P2 O7)3 Zeitschrift fuer Kristallographie (149,1979-) 180 (1987) 195-202
Space group: P 1 21/n 1
Cell volume: 790.1
Cell parameters: 15.36; 7.93; 6.487; 90; 90.51; 90;  

COD ID: 1008028
CIF file Formula: - Ba Cl2 H4 O2 -
Comments: Padmanabhan, V M; Busing, W R; Levy, H A Barium chloride dihydrate by neutron diffraction Acta Crystallographica B (24,1968-38,1982) 34 (1978) 2290-2292
Space group: P 1 21/n 1
Cell volume: 522.8
Cell parameters: 6.7215; 10.908; 7.1316; 90; 91.104; 90;  

COD ID: 1008030
CIF file Formula: - Ba O6 P2 -
Comments: Coing-Boyat, J.; Averbuch-Pouchot, M. T.; Guitel, J. C. Structure cristalline du polyphosphate de Baryum γ: Ba(PO~3~)~2~γ Acta Crystallographica B (24,1968-38,1982) 34(9) (1978) 2689-2692
Space group: P 1 21/n 1
Cell volume: 501.9
Cell parameters: 9.695; 6.906; 7.522; 90; 94.75; 90;  

COD ID: 1008040
CIF file Formula: - Cr3 K2 O10 -
Comments: Blum, D; Averbuch-Pouchot, M T; Guitel, J C Structure du tripolychromate de potassium K~2~ Cr~3~ O~10~ Acta Crystallographica B (24,1968-38,1982) 35 (1979) 454-456
Space group: P 1 21/n 1
Cell volume: 983.9
Cell parameters: 7.618; 17.791; 7.354; 90; 99.2; 90;  

COD ID: 1008108
CIF file Formula: - H8 Mn N2 O12 P4 -
Comments: Duc Tran Qui; Tordjman, I; Averbuch, M T; Bassi, G Structure cristalline du polyphosphate de manganese-ammonium Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977) 93 (1970) 413-420
Space group: P 1 21/n 1
Cell volume: 1127.5
Cell parameters: 11.297; 12.993; 7.839; 90; 101.5; 90;  

COD ID: 1008184
CIF file Formula: - H2 I2 K4 O14 S2 -
Comments: Averbuch-Pouchot, M T Structure cristalline d'un Dihydrogeno-sulphato-iodate de Potassium Journal of Solid State Chemistry 41 (1982) 262-265
Space group: P 1 21/n 1
Cell volume: 737.8
Cell parameters: 13.84; 7.173; 7.443; 90; 93.16; 90;  

COD ID: 1008240
CIF file Formula: - Cl2 Cr2 Hg K2 O7 -
Comments: Averbuch-Pouchot, M T; El-Horr, N; Guitel, J C Structures of Mercury Dichloride - Dipotassium Dichromate (1/1), Hg Cl~2~ K~2~ Cr~2~ O~7~, and Mercury Dichloride - Diammonium Dichromate (1/1), Hg Cl~2~ ((N H~4~)~2~ Cr~2~ O~7~) Acta Crystallographica C (39,1983-) 40 (1984) 725-728
Space group: P 1 21/n 1
Cell volume: 1056.9
Cell parameters: 12.372; 10.438; 8.191; 90; 92.32; 90;  

COD ID: 1008248
CIF file Formula: - H11 N2 O8 P S -
Comments: Averbuch-Pouchot, M T Hydrogen bonding in (N H~4~) (H S O~4~) (N H~4~) (H~2~ P O~4~) Materials Research Bulletin 16 (1981) 407-411
Space group: P 1 21/n 1
Cell volume: 427.2
Cell parameters: 7.723; 7.54; 7.482; 90; 101.32; 90;  

COD ID: 1008344
CIF file Formula: - Bi H4 N O12 P4 -
Comments: Averbuch-Pouchot, M T; Bagieu-Beucher, M Structural investigations of two bismuth-ammonium condensed phosphates: Bi H N H~4~ P~3~ O~10~ and Bi N H~4~ (P O~3~)~4~ Zeitschrift fuer Anorganische und Allgemeine Chemie 552 (1987) 171-180
Space group: P 1 21/n 1
Cell volume: 989.4
Cell parameters: 10.925; 9.034; 10.438; 90; 106.18; 90;  

COD ID: 1008462
CIF file Formula: - As6 Na10 Si2 -
Comments: Eisenmann, B.; Klein, J.; Somer, M. Crystal structure of decasodium di-μ-arsenidobis(diarsenidosilicate), Na~10~Si~2~As~6~ Zeitschrift für Kristallographie 197(1-4) (1991) 267-268
Space group: P 1 21/n 1
Cell volume: 829
Cell parameters: 13.466; 7.529; 8.177; 90; 90.5; 90;  

COD ID: 1008463
CIF file Formula: - Na10 P6 Sn2 -
Comments: Eisenmann, B.; Klein, J.; Somer, M. Crystal structure of decasodium di-μ-phosphidobis(diphosphidostannate(IV)), Na~10~Sn~2~P~6~ Zeitschrift für Kristallographie 197(3-4) (1991) 269-270
Space group: P 1 21/n 1
Cell volume: 828.2
Cell parameters: 13.4; 7.456; 8.289; 90; 90.2; 90;  

COD ID: 1008726
CIF file Formula: - C2 H6 Cu Na2 O9 -
Comments: Mosset, A; Bonnet, J J; Galy, J Structure cristalline de la Chalconatronite synthetique. Na2 Cu (C O3)2 (H2 O)3 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (145,1977-148,1979) 148 (1978) 165-177
Space group: P 1 21/n 1
Cell volume: 814.7
Cell parameters: 9.696; 6.101; 13.779; 90; 91.83; 90;  

COD ID: 1008747
CIF file Formula: - As3 Fe H16 O17 -
Comments: Boudjada, A; Guitel, J C Ytructure cristalline d'un orthoarseniate acide de fer(III) pentahydrate: Fe (H2 As O4)3 (H2 O)5 Acta Crystallographica B (24,1968-38,1982) 37 (1981) 1402-1405
Space group: P 1 21/n 1
Cell volume: 1410.1
Cell parameters: 15.25; 19.59999; 4.72; 90; 91.8; 90;  

COD ID: 1008815
CIF file Formula: - Bi O3 Sr -
Comments: Kazakov, S M; Chaillout, C; Bordet, P; Capponi, J J; Nunez-Regueiro, M; Rysak, A; Tholence, J L; Radaelli, P G; Putilin, S N; Antipov, E V Discovery of a second family of bismuth-oxide-based superconductors Nature (London) 390 (1997) 148-150
Space group: P 1 21/n 1
Cell volume: 307.6
Cell parameters: 5.948; 6.0951; 8.4854; 90; 90.063; 90;  

COD ID: 1008840
CIF file Formula: - Ag4 As4 H4 O14 -
Comments: Boudjada, A; Averbuch-Pouchot, M T Structure cristalline de Ag4 H4 As4 O14: Un nouvel exemple d'anion As4 O14 Journal of Solid State Chemistry 51 (1984) 76-82
Space group: P 1 21/n 1
Cell volume: 602.8
Cell parameters: 7.839; 12.428; 6.556; 90; 109.3; 90;  

COD ID: 1008847
CIF file Formula: - Br2 Re6 Se8 -
Comments: Speziali, N L; Berger, H; Leicht, G; Sanjines, R; Chapius, G; Levy, F Single crystal growth, structure and characterization of the octahedral cluster compound Re6 Se8 Br2 Materials Research Bulletin 23 (1988) 1597-1604
Space group: P 1 21/n 1
Cell volume: 785.6
Cell parameters: 6.572; 11.851; 10.253; 90; 100.33; 90;  

COD ID: 1008852
CIF file Formula: - As6 Ge2 Na10 -
Comments: Eisenmann, B.; Klein, J.; Somer, M. Crystal structure of decasodium di-μ-arsenido-bis(diarsenidogermanate), Na~10~Ge~2~As~6~ Zeitschrift für Kristallographie 197(3-4) (1991) 265-266
Space group: P 1 21/n 1
Cell volume: 847
Cell parameters: 13.531; 7.544; 8.298; 90; 90.2; 90;  

COD ID: 1008872
CIF file Formula: - As6 Na10 Sn2 -
Comments: Eisenmann, B; Klein, J Dimere Zintl-Anionen (Sn2 As6)10- und (Sn2 Sb6)10- in Alkaliverbindungen Zeitschrift fuer Kristallographie (149,1979-) 196 (1991) 213-229
Space group: P 1 21/n 1
Cell volume: 893.8
Cell parameters: 13.716; 7.642; 8.527; 90; 90.3; 90;  

COD ID: 1010247
CIF file Formula: - H8 N2 O8 S2 -
Comments: Zachariasen, W H; Mooney, R C L The Atomic Arrangement in Ammonium and Caesium Persulphate (N H~4~)~2~ S~2~ O~8~ and Cs~2~ S~2~ O~8~, and the Structure of the Persulphate Group. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 88 (1934) 63-81
Space group: P 1 21/n 1
Cell volume: 384.3
Cell parameters: 7.83; 8.04; 6.13; 90; 95.15; 90;  

COD ID: 1010248
CIF file Formula: - Cs2 O8 S2 -
Comments: Zachariasen, W H; Mooney, G C L The Atomic Arrangement in Ammonium and Caesium Persulphate (N H~4~)~2~ S~2~ O~8~ and Cs~2~ S~2~ O~8~, and the Structure of the Persulphate Group. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 88 (1934) 63-81
Space group: P 1 21/n 1
Cell volume: 435.6
Cell parameters: 8.13; 8.33; 6.46; 90; 95.32; 90;  

COD ID: 1010440
CIF file Formula: - Ag Mn O4 -
Comments: Sasvári, K. Die Struktur des Silberpermanganats AgMnO~4~ Zeitschrift für Kristallographie - Crystalline Materials 99(1-6) (1938) 9-15
Space group: P 1 21/n 1
Cell volume: 333.7
Cell parameters: 5.665; 8.27; 7.127; 90; 92; 90;  

COD ID: 1010442
CIF file Formula: - Cl4 I K -
Comments: Mooney, R. C. L. The Configuration of the Pentahalogen Anion Group from the X-ray Structure Determination of Potassium Tetra-Chloroiodide Crystals Zeitschrift für Kristallographie - Crystalline Materials 98(1-6) (1938) 377-393
Space group: P 1 21/n 1
Cell volume: 776.5
Cell parameters: 13.09; 14.18; 4.2; 90; 95.116; 90;  

COD ID: 1010762
CIF file Formula: - As18 Pb13 S40 -
Comments: Peacock, M A; Berry, L G Roentgenographic observations on ore minerals University of Toronto Studies, Geological Series 44 (1940) 47-69
Space group: P 1 21/n 1
Cell volume: 1644.6
Cell parameters: 25; 7.91; 8.42; 90; 99; 90;  

COD ID: 1010932
CIF file Formula: - Al F6 Na3 -
Comments: Náray-Szabó, St. v.; Sasvári, K. Die Struktur des Kryoliths Na~3~AlF~6~ Zeitschrift für Kristallographie - Crystalline Materials 99(1-6) (1938) 27-31
Space group: P 1 21/n 1
Cell volume: 238.9
Cell parameters: 5.46; 5.61; 7.8; 90; 90.18; 90;  

COD ID: 1011016
CIF file Formula: - C H Na O3 -
Comments: Zachariasen, W. H. The Crystal Lattice of Sodium Bicarbonate, Na H C O3 Journal of Chemical Physics 1 (1933) 634-639
Space group: P 1 21/n 1
Cell volume: 256.7
Cell parameters: 7.51; 9.7; 3.53; 90; 93.32; 90;  

COD ID: 1011081
CIF file Formula: - Al H3 O3 -
Comments: Megaw, H D The crystal structure of Hydrargillite Al (O H)3 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 87 (1934) 185-204
Space group: P 1 21/n 1
Cell volume: 424.5
Cell parameters: 8.641; 5.07; 9.72; 90; 85.43; 90;  

COD ID: 1100084
CIF file Formula: - H2 Mg O8 S2 -
Comments: Simonov, M A; Troyanov, S I; Kemnitz, E; Haas, D; Kammler, M Crystal structure of Mg (H S O~4~)~2~ Kristallografiya 31 (1986) 1220-1221
Space group: P 1 21/n 1
Cell volume: 293.9
Cell parameters: 7.299; 8.273; 4.94; 90; 99.9; 90;  

COD ID: 1100086
CIF file Formula: - H4 Mg O9 S2 -
Comments: Worzala, H; Schneider, M; Kemnitz, E; Trojanov, S I Ueber die Bildung und Kristallstruktur von Mg(HSO~4~)~2~ * H~2~O Zeitschrift fuer Anorganische und Allgemeine Chemie 596 (1991) 167-171
Space group: P 1 21/n 1
Cell volume: 654
Cell parameters: 8.623; 5.014; 15.428; 90; 101.33; 90;  

COD ID: 1100090
CIF file Formula: - H8 Mg O8 S -
Comments: Baur, W. H. On the crystal chemistry of salt hydrates. II. A neutron diffraction study of MgSO~4~.4H~2~O Acta Crystallographica 17(7) (1964) 863-869
Space group: P 1 21/n 1
Cell volume: 636.8
Cell parameters: 5.922; 13.604; 7.905; 90; 90.85; 90;  

COD ID: 1100097
CIF file Formula: - H8 Mg O8 S -
Comments: Baur, W. H. Zur Kristallchemie der Salzhydrate. Die Kristallstrukturen von MgSO~4~.4H~2~O (leonhardtit) und FeSO~4~.4H~2~O (rozenit) Acta Crystallographica 15(9) (1962) 815-826
Space group: P 1 21/n 1
Cell volume: 636.8
Cell parameters: 5.922; 13.604; 7.905; 90; 90.85; 90;  

COD ID: 1100102
CIF file Formula: - H2 Mg O4 S -
Comments: Buchmeier, W.; Engelen, B.; Müller, H. Kristallstruktur von MgSO~3~ * H~2~O Zeitschrift für Naturforschung B 53(2) (1998) 131-134
Space group: P 1 21/n 1
Cell volume: 336.6
Cell parameters: 4.699; 12.751; 5.618; 90; 90.49; 90;  

COD ID: 1100109
CIF file Formula: ?
Comments: ()
Space group: P 1 21/n 1
Cell volume: 565.55
Cell parameters: 8.21338; 8.26806; 8.32806; 90; 90.1443; 90;  

COD ID: 1100111
CIF file Formula: - B12 H12 N2 O12 -
Comments: Daniel J. Stasko; Kevin J. Perzynski; Mark A. Wasil; Julia K. Brodbeck; Kristin Kirschbaum; Yong Wah Kim; Cora Lind An Addition to the Oxoacid Family: H2B12(OH)12 Inorganic Chemistry 43 (2004) 3786-3788
Space group: P 1 21/n 1
Cell volume: 684.85
Cell parameters: 7.13566; 10.3924; 9.24771; 90; 92.9905; 90;  

COD ID: 1100118
CIF file Formula: - C10 H36 Al2 F10 N4 O4 -
Comments: E. Goreshnik; M. Leblanc; V. Maisonneuve 1,4,8,11-Tetraazacyclodecane-1,4,8,11-tetraium bis(aquapentafluoroaluminate) dihydrate Acta Crystallographica, Section E 59(11) (2003) m1059-m1061
Space group: P 1 21/n 1
Cell volume: 1011.2
Cell parameters: 8.493; 8.932; 13.434; 90; 97.141; 90;  

COD ID: 1100146
CIF file Formula: - C9 H12 Cl2 Cu N4 O3 -
Comments: Esther R. Acuna-Cueva; Rene Faure; Nuria A. Illan-Cabeza; Sonia B. Jimenez-Pulido; Miguel N. Moreno-Carretero; Miguel Quiros Inorganica Chimica Acta 351 (2003) 356-362
Space group: P 1 21/n 1
Cell volume: 1359.3
Cell parameters: 8.8152; 10.0526; 15.344; 90; 91.521; 90;  

COD ID: 1100157
CIF file Formula: - C37 H34 N6 Ni O6 -
Comments: Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron 23 (2004) 1505-1518
Space group: P 1 21/n 1
Cell volume: 3461.3
Cell parameters: 9.2191; 29.972; 12.5644; 90; 94.428; 90;  

COD ID: 1100160
CIF file Formula: - C11 H18 Cu N2 O6 -
Comments: Carballo, Rosa; Vazquez-Lopez, Ezequiel M.; Covelo, Berta; Garcia-Martinez, Emilia; Castineiras, Alfonso; Niclos, Juan 'Solid state coordination chemistry of mononuclear mixed-ligand complexes of Ni(II), Cu(II) and Zn(II) with α-hydroxycarboxylic acids and imidazole' Polyhedron 23 (2004) 1505-1518
Space group: P 1 21/n 1
Cell volume: 1463.3
Cell parameters: 9.6623; 17.63; 9.7978; 90; 118.748; 90;  

COD ID: 1100193
CIF file Formula: - C20 H26 N2 -
Comments: K.Harms; M.Marsch Private Communication (2000)
Space group: P 1 21/n 1
Cell volume: 892.122
Cell parameters: 6.3611; 16.313; 8.646; 90; 96.089; 90;  

COD ID: 1100197
CIF file Formula: - C6 H18 Br N Sb2 -
Comments: U.Muller; K.Dehnicke; R.Hillwig; K.Harms; J.Pebler; A.Pilz Private Communication (2000)
Space group: P 1 21/n 1
Cell volume: 1318.71
Cell parameters: 7.163; 17.466; 10.565; 90; 93.9; 90;  

COD ID: 1100199
CIF file Formula: - C20 H52 Cu Li O6 Si2 -
Comments: John, Michael; Auel, Carsten; Behrens, Christoph; Marsch, Michael; Harms, Klaus; Bosold, Ferdinand; Gschwind, Ruth M.; Rajamohanan, Pattuparambil R.; Boche, Gernot The Relation between Ion Pair Structures and Reactivities of Lithium Cuprates Chemistry - A European Journal 6(16) (2000) 3060-3068
Space group: P 1 21/n 1
Cell volume: 3108.14
Cell parameters: 10.2161; 19.2676; 15.792; 90; 90.858; 90;  

COD ID: 1100206
CIF file Formula: - C12 H44 B10 N2 P2 -
Comments: Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K. Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^ Zeitschrift für Anorganische und Allgemeine Chemie 626(3) (2000) 775-783
Space group: P 1 21/n 1
Cell volume: 2466.66
Cell parameters: 8.093; 17.036; 18.001; 90; 96.34; 90;  

COD ID: 1100209
CIF file Formula: - C9 H25 I N P Si -
Comments: Chitsaz, S.; Folkerts, H.; Grebe, J.; Gröb, T.; Harms, K.; Hiller, W.; Krieger, M.; Massa, W.; Merle, J.; Möhlen, M.; Neumüller, B.; Dehnicke, K. Die Kristallstrukturen einer Serie von Verbindungen mit Kationen des Typs [R~3~PNH~2~]^+^, [R3PN(H)SiMe~3~]^+^ und [R3PN(SiMe~3~)~2~]^+^ Zeitschrift für Anorganische und Allgemeine Chemie 626(3) (2000) 775-783
Space group: P 1 21/n 1
Cell volume: 1573.23
Cell parameters: 13.602; 8.742; 14.621; 90; 115.19; 90;  

COD ID: 1100216
CIF file Formula: - C16 H36 F12 N4 Ni4 O12 P4 S4 -
Comments: Krieger, Matthias; Gould, Robert O.; Harms, Klaus; Greiner, Andreas; Dehnicke, Kurt Phosphaniminato- und Phosphanimin-Komplexe von Nickel(II). Die Kristallstrukturen von [Ni(O~3~SCF~3~)(NPMe~3~)]~4~, [Ni~4~Br~5~{NP(NMe~2~)~3~}~3~], [NiBr~2~{HNP(NMe~2~)~3~}~2~] und [Ni(PMePh~2~)~4~] Zeitschrift fuer Anorganische und Allgemeine Chemie 627(4) (2001) 747-754
Space group: P 1 21/n 1
Cell volume: 4371.72
Cell parameters: 15.6666; 14.7993; 19.6063; 90; 105.908; 90;  

COD ID: 1100222
CIF file Formula: - C9 H12 Cl N O2 -
Comments: Bach, Thorsten; Schlummer, Björn; Harms, Klaus Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones Chemistry - A European Journal 7(12) (2001) 2581-2594
Space group: P 1 21/n 1
Cell volume: 965.77
Cell parameters: 9.9246; 6.8908; 14.1918; 90; 95.692; 90;  

COD ID: 1100223
CIF file Formula: - C9 H12 Cl N O2 -
Comments: Bach, Thorsten; Schlummer, Björn; Harms, Klaus Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones Chemistry - A European Journal 7(12) (2001) 2581-2594
Space group: P 1 21/n 1
Cell volume: 950.748
Cell parameters: 11.9678; 6.2949; 13.7472; 90; 113.363; 90;  

COD ID: 1100225
CIF file Formula: - C13 H14 Cl N O2 -
Comments: Bach, Thorsten; Schlummer, Björn; Harms, Klaus Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones Chemistry - A European Journal 7(12) (2001) 2581-2594
Space group: P 1 21/n 1
Cell volume: 1272.63
Cell parameters: 6.9144; 9.352; 19.9486; 90; 99.398; 90;  

COD ID: 1100227
CIF file Formula: - C19 H23 N O4 -
Comments: Bach, Thorsten; Bergmann, Hermann; Brummerhop, Harm; Lewis, Warren; Harms, Klaus The [2+2]-Photocycloaddition of Aromatic Aldehydes and Ketones to 3,4-Dihydro-2-pyridones: Regioselectivity, Diastereoselectivity, and Reductive Ring Opening of the Product Oxetanes Chemistry - A European Journal 7(20) (2001) 4512-4521
Space group: P 1 21/n 1
Cell volume: 1772.13
Cell parameters: 11.818; 9.9465; 16.082; 90; 110.375; 90;  

COD ID: 1100228
CIF file Formula: - C19 H19 N O2 -
Comments: Bach, Thorsten; Bergmann, Hermann; Brummerhop, Harm; Lewis, Warren; Harms, Klaus The [2+2]-Photocycloaddition of Aromatic Aldehydes and Ketones to 3,4-Dihydro-2-pyridones: Regioselectivity, Diastereoselectivity, and Reductive Ring Opening of the Product Oxetanes Chemistry - A European Journal 7(20) (2001) 4512-4521
Space group: P 1 21/n 1
Cell volume: 1536.14
Cell parameters: 13.857; 7.9815; 15.117; 90; 113.252; 90;  

COD ID: 1100241
CIF file Formula: - C86 H76 Cs4 N4 P4 -
Comments: T.Grob; K.Harms; K.Dehnicke Z.Anorg.Allg.Chem. 626 (2000) 1065
Space group: P 1 21/n 1
Cell volume: 8003.72
Cell parameters: 14.1888; 22.5891; 24.9759; 90; 91.055; 90;  

COD ID: 1100248
CIF file Formula: - C28 H38 O8 -
Comments: K.Harms Private Communication (2001)
Space group: P 1 21/n 1
Cell volume: 1363.84
Cell parameters: 7.8808; 15.3984; 11.8722; 90; 108.801; 90;  

COD ID: 1100263
CIF file Formula: - C25 H52 B N O3 Si -
Comments: Kocienski, P.; Marsch, M.; Harms, K.; Boche, G. A vinylic α-carbamoyloxy boran with a carbenoid-type bonding situation Acta Crystallographica Section E 58(3) (2002) o336-o337
Space group: P 1 21/n 1
Cell volume: 3028.82
Cell parameters: 14.684; 9.355; 22.515; 90; 101.68; 90;  

COD ID: 1100275
CIF file Formula: - C10 H14 O4 -
Comments: Tietze, Lutz-F.; Glüsenkamp, Karl-Heinz; Harms, Klaus; Remberg, Gert; Sheldrick, George M. Diels-alder reactions of malondialdehyde derivatives with reversed electron demand; an easy approach to structurally unique carbohydrates and compounds of the thromboxane type Tetrahedron Letters 23(11) (1982) 1147-1150
Space group: P 1 21/n 1
Cell volume: 969.57
Cell parameters: 12.799; 5.977; 13.083; 90; 104.36; 90;  

COD ID: 1100287
CIF file Formula: - C34 H50 Li2 N6 -
Comments: Boche, Gernot; Marsch, Michael; Harms, Klaus [(α-Cyanobenzyllithium. Tetramethylethylenediamine)~2~. Benzene]: X-ray Structure Analysis of an α-Nitrile "Carbanion" Angewandte Chemie, International Edition in English 25(4) (1986) 373-374
Space group: P 1 21/n 1
Cell volume: 3632.91
Cell parameters: 9.68; 15.834; 24.029; 90; 99.46; 90;  

COD ID: 1100288
CIF file Formula: - C34 H50 Li2 N6 -
Comments: Boche, Gernot; Marsch, Michael; Harms, Klaus [(α-Cyanobenzyllithium. Tetramethylethylenediamine)~2~. Benzene]: X-ray Structure Analysis of an α-Nitrile "Carbanion" Angewandte Chemie, International Edition in English 25(4) (1986) 373-374
Space group: P 1 21/n 1
Cell volume: 3588.35
Cell parameters: 9.689; 15.699; 23.914; 90; 99.43; 90;  

COD ID: 1100315
CIF file Formula: - C32 H72 Li8 O4 -
Comments: Marsch, Michael; Harms, Klaus; Lochmann, Lubomir; Boche, Gernot [nBuLi · LiOtBu]~4~, Solid-State Structure of an n-Butyllithium‒Lithiumtert-Butoxide Complex Angewandte Chemie, International Edition in English 29(3) (1990) 308-309
Space group: P 1 21/n 1
Cell volume: 4180.67
Cell parameters: 11.024; 23.659; 16.377; 90; 101.83; 90;  

COD ID: 1100321
CIF file Formula: - C29 H29 Au O2 P S -
Comments: Kneuper, Heinz-Josef; Harms, Klaus; Boche, Gernot FunktionalisierteÜbergangsmetallalkyle: Synthese und Kristallstruktur von Ph~3~PAuCHPhSO~2~-t-Bu Journal of Organometallic Chemistry 364(1-2) (1989) 275-279
Space group: P 1 21/n 1
Cell volume: 2632.35
Cell parameters: 11.75; 14.001; 16.751; 90; 107.21; 90;  

COD ID: 1100325
CIF file Formula: - C23 H25 Cr N O7 -
Comments: Dötz, Karl Heinz; Grotjahn, Douglas; Harms, Klaus Reaktionen von komplexliganden XXXVIII. Bisacylierung von aminocarben-komplexen zu 2-azaallenyl-komplexen Journal of Organometallic Chemistry 375(2) (1989) C47-C50
Space group: P 1 21/n 1
Cell volume: 2486.4
Cell parameters: 11.093; 11.474; 19.574; 90; 93.63; 90;  

COD ID: 1100326
CIF file Formula: - C17 H31 Li N2 O -
Comments: Zarges, Wolfgang; Marsch, Michael; Harms, Klaus; Boche, Gernot η^1^-C~6~H~5~CH~2~Li·THF·TMEDA, Kristallstruktur eines Benzyllithium·THF·TMEDA-Komplexes mit einem pyramidalen Benzyl-C-Atom Chemische Berichte 122(12) (1989) 2303-2309
Space group: P 1 21/n 1
Cell volume: 1811.52
Cell parameters: 8.682; 15.387; 13.934; 90; 103.3; 90;  

COD ID: 1100328
CIF file Formula: - C26 H44 Li2 N2 O2 -
Comments: Boche, Gernot; Marsch, Michael; Harbach, Jürgen; Harms, Klaus; Ledig, Burkhard; Schubert, Frank; Lohrenz, John C. W.; Ahlbrecht, Hubertus [α-(Dimethylamino)benzyllithium‒Diethyl Ether]~2~, (S)-α-(Methylpivaloylamino)benzyllithium ‒ (‒)-Sparteine, and [3-Iodo-2-lithio-1-methylindole ‒ 2 Tetrahydrofuran]~2~: Crystal Structure Investigations of α-Lithiated Amines Chemische Berichte 126(8) (1993) 1887-1894
Space group: P 1 21/n 1
Cell volume: 1358.12
Cell parameters: 9.32; 12.832; 11.842; 90; 106.47; 90;  

COD ID: 1100333
CIF file Formula: - C25 H35 Li O3 S -
Comments: Zarges, Wolfgang; Marsch, Michael; Harms, Klaus; Frenking, Gernot; Boche, Gernot; Koch, Wolfram Röntgenstrukturuntersuchung von α-(Trimethylsilyl)benzyllithium·Tetramethylendiamin [C~6~H~5~CH(SiMe~3~)Li·TMEDA] und α-(Phenylthio)-benzyllithium·3 Tetrahydrofuran [C~6~H~5~CH(SPh)Li·(THF)~3~] ‒ zwei zentral-chirale Benzyllithium-Verbindungen Chemische Berichte 124(3) (1991) 543-549
Space group: P 1 21/n 1
Cell volume: 2455.06
Cell parameters: 9.106; 9.394; 28.743; 90; 93.13; 90;  

COD ID: 1100334
CIF file Formula: - C12 H22 O2 -
Comments: Wolff, J. Jens; Frenking, Gernot; Harms, Klaus The Conformational Behaviour of 10-Substituted Spiro[4.5]decanes Chemische Berichte 124(3) (1991) 551-561
Space group: P 1 21/n 1
Cell volume: 1155.17
Cell parameters: 6.326; 11.667; 15.709; 90; 94.9; 90;  

COD ID: 1100335
CIF file Formula: - C12 H21 Br O2 -
Comments: Wolff, J. Jens; Frenking, Gernot; Harms, Klaus The Conformational Behaviour of 10-Substituted Spiro[4.5]decanes Chemische Berichte 124(3) (1991) 551-561
Space group: P 1 21/n 1
Cell volume: 1271.6
Cell parameters: 6.351; 11.877; 16.86; 90; 90.92; 90;  

COD ID: 1100338
CIF file Formula: - C25 H26 Cr N2 O4 -
Comments: Dötz, Karl Heinz; Rau, Alexander; Harms, Klaus Reaktionen von komplexliganden: LII. Sechsgliedrige aminocarben-chelatkomplexe: Synthese, alkin/carben-verknüpfung und carbenanellierung Journal of Organometallic Chemistry 439(3) (1992) 263-277
Space group: P 1 21/n 1
Cell volume: 2392.19
Cell parameters: 10.796; 15.242; 14.732; 90; 99.32; 90;  

COD ID: 1100339
CIF file Formula: - C25 H35 Li3 N6 O8 -
Comments: Hiller, Wolfgang; Frey, Stephanie; Strähle, Joachim; Boche, Gernot; Zarges, Wolfgang; Harms, Klaus; Marsch, Michael; Wollert, René; Dehnicke, Kurt Die Kristallstrukturen von {Li~3~(12-Krone-4)~2~[HC(CN)~2~]~3~}, {Na(15-Krone-5)-[HC(CN)~2~]} und {Na[N(nBu)~4~][HC(CN)~2~]~2~ · THF} Chemische Berichte 125(1) (1992) 87-92
Space group: P 1 21/n 1
Cell volume: 3137.63
Cell parameters: 7.815; 14.467; 27.772; 90; 92.175; 90;  

COD ID: 1100354
CIF file Formula: - C28 H40 Cl3 Li N2 O2 -
Comments: Boche, Gernot; Marsch, Michael; Müller, Achim; Harms, Klaus 1-Chloro-2,2-bis(4-chlorophenyl)-1-lithioethene · TMEDA · 2THF: Structure of a Li‒Cl Carbenoid Angewandte Chemie, International Edition in English 32(7) (1993) 1032-1033
Space group: P 1 21/n 1
Cell volume: 3058.81
Cell parameters: 12.734; 15.16; 16.54; 90; 106.67; 90;  

COD ID: 1100356
CIF file Formula: - C34 H56 Li2 N4 O6 P2 -
Comments: Zarges, Wolfgang; Marsch, Michael; Harms, Klaus; Haller, Friederike; Frenking, Gernot; Boche, Gernot [(C~2~H~5~O)~2~P(O)CHPhLi·N(CH~2~CH~2~)~3~N]~∞~: Festkörperstruktur, Aggregation in THF-Lösung und Modellrechnungen zur Struktur eines Wadsworth-Horner-Emmons-Reagenzes Chemische Berichte 124(4) (1991) 861-866
Space group: P 1 21/n 1
Cell volume: 1881.14
Cell parameters: 12.341; 13.003; 11.733; 90; 92.4; 90;  

COD ID: 1100360
CIF file Formula: - C24 H31 B F K O8 -
Comments: Reetz, Manfred T.; Niemeyer, Christof M.; Harms, Klaus Crown Ethers with a Lewis Acidic Center: A New Class of Heterotopic Host Molecules Angewandte Chemie, International Edition in English 30(11) (1991) 1472-1474
Space group: P 1 21/n 1
Cell volume: 2525.86
Cell parameters: 10.228; 20.757; 12.38; 90; 106.05; 90;  

COD ID: 1100362
CIF file Formula: - C26 H24 Cl2 N O2 Os P -
Comments: Buth, Silke; Harms, Klaus; König, Peter; Wočadlo, Sigrid; Weller, Frank; Dehnicke, Kurt Synthese und Kristallstrukturen der Nitridodiolato-Osmate(VI) PPh~4~[OsNCl~2~(O~2~C~2~H~4~)] und PPh~4~[OsNCl~2~(O~2~C~2~Me~4~)] · 2 THF Zeitschrift fuer Anorganische und Allgemeine Chemie 619(5) (1993) 853-858
Space group: P 1 21/n 1
Cell volume: 2586.43
Cell parameters: 17.503; 8.168; 18.165; 90; 95.16; 90;  

COD ID: 1100367
CIF file Formula: - C14 H10 N2 O4 -
Comments: Reetz, Manfred T.; Höger, Sigurd; Harms, Klaus Proton-Transfer-Dependent Reversible Phase Changes in the 4,4'-Bipyridinium Salt of Squaric Acid Angewandte Chemie, International Edition in English 33(2) (1994) 181-183
Space group: P 1 21/n 1
Cell volume: 1149.26
Cell parameters: 3.758; 11.196; 27.351; 90; 92.95; 90;  

COD ID: 1100368
CIF file Formula: - C14 H10 N2 O4 -
Comments: Reetz, Manfred T.; Höger, Sigurd; Harms, Klaus Proton-Transfer-Dependent Reversible Phase Changes in the 4,4'-Bipyridinium Salt of Squaric Acid Angewandte Chemie, International Edition in English 33(2) (1994) 181-183
Space group: P 1 21/n 1
Cell volume: 1168.1
Cell parameters: 3.8; 11.208; 27.447; 90; 92.22; 90;  

COD ID: 1100370
CIF file Formula: - C14 H9 D N2 O4 -
Comments: Reetz, Manfred T.; Höger, Sigurd; Harms, Klaus Proton-Transfer-Dependent Reversible Phase Changes in the 4,4'-Bipyridinium Salt of Squaric Acid Angewandte Chemie, International Edition in English 33(2) (1994) 181-183
Space group: P 1 21/n 1
Cell volume: 1168.36
Cell parameters: 3.793; 11.175; 27.581; 90; 91.99; 90;  

COD ID: 1100376
CIF file Formula: - C16 H27 N3 O2 -
Comments: Boche, Gernot; Langlotz, Ira; Marsch, Michael; Harms, Klaus X-Ray Crystal Structures of the Enolate oftert-Butyl α-Cyanoacetate with Li^+^ or Protonated 1,8-Diazabicyclo[5.4.0]undec-7-ene (DBU-H^+^) as Gegenion. N‒H Hydrogen Bridge from DBU-H^+^ to the Enolate Oxygen Atom Chemische Berichte 127(10) (1994) 2059-2064
Space group: P 1 21/n 1
Cell volume: 1679.19
Cell parameters: 11.687; 12.462; 12.853; 90; 116.23; 90;  

COD ID: 1100381
CIF file Formula: - C22 H33 Li O3 -
Comments: Hoppe, Inga; Marsch, Michael; Harms, Klaus; Boche, Gernot; Hoppe, Dieter Generation of Enantiomerically Enriched Lithium Indenides by Means of(‒)-Sparteine: Structure, Stereoselective Substitution, and Solvent Effects Angewandte Chemie, International Edition in English 34(19) (1995) 2158-2160
Space group: P 1 21/n 1
Cell volume: 2093.6
Cell parameters: 8.951; 18.325; 12.788; 90; 93.53; 90;  

COD ID: 1100383
CIF file Formula: - C22 H37 Al Cl Li O7 -
Comments: Reetz, Manfred T.; Johnson, Barry M.; Harms, Klaus A novel receptor for ditopic binding of alkali metal halides Tetrahedron Letters 35(16) (1994) 2525-2528
Space group: P 1 21/n 1
Cell volume: 2566
Cell parameters: 9.631; 17.544; 15.187; 90; 90.48; 90;  

COD ID: 1100384
CIF file Formula: - C32 H28 Br2 Cl N2 O4 P -
Comments: Ghassemzadeh, Mitra; Harms, Klaus; Dehnicke, Kurt; Fenske, Dieter μ~2~-Halogenokomplexe von N-Bromsuccinimid und N-Bromphthalimid. Die Kristallstrukturen von PPh~4~[X(N-Bromsuccinimid)~2~] und von PPh~4~[X(N-Bromphthalimid)~2~] mit X = CI und Br / μ~2~-Halogeno Complexes of N-Bromosuccinimide and N-Bromophthalimide. The Crystal Structures of PPh~4~[X(N-Bromosuccinimide)~2~] and PPh~4~[X(N-Brom ophthalimide)~2~] with X = Cl and Br Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences 49(5) (1994) 593-601
Space group: P 1 21/n 1
Cell volume: 3110.81
Cell parameters: 17.759; 7.643; 23.417; 90; 101.84; 90;  

COD ID: 1100385
CIF file Formula: - C32 H28 Br3 N2 O4 P -
Comments: Ghassemzadeh, Mitra; Harms, Klaus; Dehnicke, Kurt; Fenske, Dieter μ~2~-Halogenokomplexe von N-Bromsuccinimid und N-Bromphthalimid. Die Kristallstrukturen von PPh~4~[X(N-Bromsuccinimid)~2~] und von PPh~4~[X(N-Bromphthalimid)~2~] mit X = CI und Br / μ~2~-Halogeno Complexes of N-Bromosuccinimide and N-Bromophthalimide. The Crystal Structures of PPh~4~[X(N-Bromosuccinimide)~2~] and PPh~4~[X(N-Brom ophthalimide)~2~] with X = Cl and Br Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences 49(5) (1994) 593-601
Space group: P 1 21/n 1
Cell volume: 3075.84
Cell parameters: 17.769; 7.622; 23.31; 90; 103.02; 90;  

COD ID: 1100390
CIF file Formula: - C32 H28 Cl3 N2 O4 P -
Comments: Ghassemzadeh, Mitra; Harms, Klaus; Dehnicke, Kurt; Magull, Jörg μ~2~-Chlorokomplexe von Succinimid und N-Chlorsuccinimid. Die Kristallstrukturen von PPh~4~[Cl(Succinimid)~2~], PPh~4~[[Cl(N-Cl-Succinimid)~2~] und N-Chlorphthalimid / μ~2~-Chloro Complexes of Succinimide and N-Chlorosuccinimide. The Crystal Structures of PPh~4~[Cl(Succinimide)~2~], PPh~4~[Cl(N-Cl-Succinimide)~2~] and N-Chlorophthalimide} Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences 49(4) (1994) 506-512
Space group: P 1 21/n 1
Cell volume: 3019.08
Cell parameters: 17.61; 7.534; 23.18; 90; 100.98; 90;  

COD ID: 1100394
CIF file Formula: - C39 H65 B Cl6 N5 P5 Ti3 -
Comments: Rübenstahl, T.; Weller, F.; Harms, K.; Dehnicke, K.; Fenske, D.; Baum, G. Phosphaniminato-Komplexe des Titans. Synthese und Kristallstrukturen von CpTiCl2(NPMe~3~), [TiCl~3~(NPMe~3~)]~2~, [Ti~2~Cl~5~(NPMe~2~Ph)~3~] und [Ti~3~Cl~6~(NPMe~3~)~5~][BPh~4~] Zeitschrift fuer Anorganische und Allgemeine Chemie 620(10) (1994) 1741-1749
Space group: P 1 21/n 1
Cell volume: 5423.78
Cell parameters: 14.952; 23.354; 15.558; 90; 93.28; 90;  

COD ID: 1100405
CIF file Formula: - C14 H22 As Nb -
Comments: Nikonov, Georgii I.; Lorberth, Jorg; Harms, Klaus; Lemenovskii, Dmitry A. The First Arsenido-Substituted Niobocene Derivative Inorganic Chemistry 34(9) (1995) 2461-2463
Space group: P 1 21/n 1
Cell volume: 1417.55
Cell parameters: 8.087; 15.071; 12.261; 90; 108.45; 90;  

COD ID: 1100413
CIF file Formula: - C14 H42 Cl2 In2 N2 Sn4 -
Comments: Hillwig, Ralf; Harms, Klaus; Dehnicke, Kurt Zur Chemie des Tris(trimethylstannyl) amins. Die Kristallstrukturen von [Me~3~In‒N(SnMe~3~)~3~] and [RClln‒N(SnMe~3~)~2~]~2~ mit R=Methyl und Ethyl Journal of Organometallic Chemistry 501(1-2) (1995) 327-332
Space group: P 1 21/n 1
Cell volume: 1535.81
Cell parameters: 10.104; 9.769; 15.603; 90; 94.28; 90;  

COD ID: 1100414
CIF file Formula: - C16 H46 Cl2 In2 N2 Sn4 -
Comments: Hillwig, Ralf; Harms, Klaus; Dehnicke, Kurt Zur Chemie des Tris(trimethylstannyl) amins. Die Kristallstrukturen von [Me~3~In‒N(SnMe~3~)~3~] and [RClln‒N(SnMe~3~)~2~]~2~ mit R=Methyl und Ethyl Journal of Organometallic Chemistry 501(1-2) (1995) 327-332
Space group: P 1 21/n 1
Cell volume: 1627.73
Cell parameters: 11.262; 9.931; 14.603; 90; 94.71; 90;  

COD ID: 1100420
CIF file Formula: - C22 H36 As2 N2 -
Comments: Avtomonov, Evgeni V.; Megges, Klaus; Li, Xiaowang; Lorberth, Jörg; Wocadlo, Sigrid; Massa, Werner; Harms, Klaus; Churakov, Andrei V.; Howard, Judith A. K Syntheses and structures of cyclopentadienyl arsenic compounds II. Pentamethyl- and tetraisopropylcyclopentadienyl arsenic amido derivatives Journal of Organometallic Chemistry 544(1) (1997) 79-89
Space group: P 1 21/n 1
Cell volume: 2333.9
Cell parameters: 8.4826; 18.0319; 15.56; 90; 101.297; 90;  

COD ID: 1100422
CIF file Formula: - C14 H25 As Cl N -
Comments: Avtomonov, Evgeni V.; Megges, Klaus; Li, Xiaowang; Lorberth, Jörg; Wocadlo, Sigrid; Massa, Werner; Harms, Klaus; Churakov, Andrei V.; Howard, Judith A. K Syntheses and structures of cyclopentadienyl arsenic compounds II. Pentamethyl- and tetraisopropylcyclopentadienyl arsenic amido derivatives Journal of Organometallic Chemistry 544(1) (1997) 79-89
Space group: P 1 21/n 1
Cell volume: 1572.84
Cell parameters: 6.466; 17.319; 14.069; 90; 93.34; 90;  

COD ID: 1100423
CIF file Formula: - C16 H33 As Cl N Si2 -
Comments: Avtomonov, Evgeni V.; Megges, Klaus; Li, Xiaowang; Lorberth, Jörg; Wocadlo, Sigrid; Massa, Werner; Harms, Klaus; Churakov, Andrei V.; Howard, Judith A. K Syntheses and structures of cyclopentadienyl arsenic compounds II. Pentamethyl- and tetraisopropylcyclopentadienyl arsenic amido derivatives Journal of Organometallic Chemistry 544(1) (1997) 79-89
Space group: P 1 21/n 1
Cell volume: 2130.99
Cell parameters: 8.69; 19.864; 12.737; 90; 104.25; 90;  

COD ID: 1100430
CIF file Formula: - C13 H11 D O2 V -
Comments: Elschenbroich, Ch.; Schiemann, O.; Burghaus, O.; Harms, K. Exchange Interaction Mediated by O‒H⋯O Hydrogen Bonds: Synthesis, Structure, and EPR Study of the Paramagnetic Organometallic Carboxylic Acid (η^7^-C~7~H~7~)V(η^5^-C~5~H~4~COOH) Journal of the American Chemical Society 119(32) (1997) 7452-7457
Space group: P 1 21/n 1
Cell volume: 1069.31
Cell parameters: 6.993; 16.539; 9.554; 90; 104.6; 90;  

COD ID: 1100431
CIF file Formula: - C13 H12 O2 V -
Comments: Elschenbroich, Ch.; Schiemann, O.; Burghaus, O.; Harms, K. Exchange Interaction Mediated by O‒H⋯O Hydrogen Bonds: Synthesis, Structure, and EPR Study of the Paramagnetic Organometallic Carboxylic Acid (η^7^-C~7~H~7~)V(η^5^-C~5~H~4~COOH) Journal of the American Chemical Society 119(32) (1997) 7452-7457
Space group: P 1 21/n 1
Cell volume: 1066.33
Cell parameters: 6.98; 16.541; 9.544; 90; 104.6; 90;  

COD ID: 1100432
CIF file Formula: - C26 H22 O3 V2 -
Comments: Elschenbroich, Ch.; Schiemann, O.; Burghaus, O.; Harms, K. Exchange Interaction Mediated by O‒H⋯O Hydrogen Bonds: Synthesis, Structure, and EPR Study of the Paramagnetic Organometallic Carboxylic Acid (η^7^-C~7~H~7~)V(η^5^-C~5~H~4~COOH) Journal of the American Chemical Society 119(32) (1997) 7452-7457
Space group: P 1 21/n 1
Cell volume: 4145.26
Cell parameters: 13.534; 23.276; 13.582; 90; 104.34; 90;  

COD ID: 1100434
CIF file Formula: - C72 H124 Li16 N16 O8 -
Comments: Hill, Christof; Bosold, Ferdinand; Harms, Klaus; Lohrenz, John C. W.; Marsch, Michael; Schmieczek, Michael; Boche, Gernot Carbene Structure of Stable Acyl (Formyl) Anion Equivalents Chemische Berichte/Recueil 130(9) (1997) 1201-1212
Space group: P 1 21/n 1
Cell volume: 4401.42
Cell parameters: 15.107; 20.419; 15.835; 90; 115.7; 90;  

COD ID: 1100458
CIF file Formula: - C80 H78 Cl8 F6 N4 P4 Ti2 -
Comments: Grün, Marion; Harms, Klaus; Köcker, Rolf Meyer Zu; Dehnicke, Kurt; Goesmann, Helmut Kristallstrukturen von [TiF~3~(NPPh~3~)(HNPPh~3~)]~2~ und von HNPPh~3~ Zeitschrift fuer Anorganische und Allgemeine Chemie 622(6) (1996) 1091-1096
Space group: P 1 21/n 1
Cell volume: 4184.6
Cell parameters: 14.175; 18.969; 15.866; 90; 101.22; 90;  

COD ID: 1100470
CIF file Formula: - C16 H16 Cl2 Li N3 -
Comments: Müller, Achim; Marsch, Michael; Harms, Klaus; Lohrenz, John C. W.; Boche, Gernot LiCHCl~2~ · 3 Pyridine, Structure of a Carbenoid with a Tetrahedral C Atom Angewandte Chemie, International Edition in English 35(1314) (1996) 1518-1520
Space group: P 1 21/n 1
Cell volume: 1735.45
Cell parameters: 12.713; 10.728; 12.731; 90; 91.81; 90;  

COD ID: 1100476
CIF file Formula: - C18 H15 N2 S2 Sb -
Comments: Kunkel, Frank; Harms, Klaus; Kang, Hak-Chul; Massa, Werner; Dehnicke, Kurt Über die Reaktion von SbPh~3~ mit S~3~N~2~Cl~2~ Kristallstrukturen von [xxx] und [(Ph~3~SbCl~2~)~2~·S~4~N~4~] / On the Reaction of SbPh~3~ with S~3~N~2~Cl~2~. Crystal Structures of [xxx] and [(Ph~3~SbCl~2~)~2~·S~4~N~4~] Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences 52(2) (1997) 193-198
Space group: P 1 21/n 1
Cell volume: 1713.04
Cell parameters: 7.594; 14.485; 15.576; 90; 91.09; 90;  

COD ID: 1100478
CIF file Formula: - C22 H52 Cl4 N2 P2 Si2 Zn2 -
Comments: Krieger, Matthias; Harms, Klaus; Magull, Jörg; Dehnicke, Kurt Phosphanimin- und Phosphaniminato-Komplexe des Zinks. Kristallstrukturen von [ZnCl~2~(Me~3~SiNP(CH~2~)~4~CMe~3~)]~2~, [ZnI~2~(Me~3~SiNPEt~3~)]~2~, [ZnI~2~{Me~2~Si(NPEt~3~)~2~}] und [ZnBr(NPMe~3~)]~4~·CH~2~Cl~2~ / Phosphaneimine and Phosphoraneiminato Complexes of Zinc. Crystal Structures of [ZnCl~2~(Me~3~SiNP(CH~2~)~4~CMe~3~)]~2~, [ZnI~2~(Me~3~SiNPEt~3~)]~2~, [Znl~2~{Me~2~Si(NPEt~3~)~2~}], and [ZnBr(NPMe~3~)]~4~·CH~2~Cl~2~ Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences 52(2) (1997) 243-250
Space group: P 1 21/n 1
Cell volume: 1746.82
Cell parameters: 9.033; 12.179; 15.916; 90; 93.943; 90;  

COD ID: 1100479
CIF file Formula: - C18 H48 I4 N2 P2 Si2 Zn2 -
Comments: Krieger, Matthias; Harms, Klaus; Magull, Jörg; Dehnicke, Kurt Phosphanimin- und Phosphaniminato-Komplexe des Zinks. Kristallstrukturen von [ZnCl~2~(Me~3~SiNP(CH~2~)~4~CMe~3~)]~2~, [ZnI~2~(Me~3~SiNPEt~3~)]~2~, [ZnI~2~{Me~2~Si(NPEt~3~)~2~}] und [ZnBr(NPMe~3~)]~4~·CH~2~Cl~2~ / Phosphaneimine and Phosphoraneiminato Complexes of Zinc. Crystal Structures of [ZnCl~2~(Me~3~SiNP(CH~2~)~4~CMe~3~)]~2~, [ZnI~2~(Me~3~SiNPEt~3~)]~2~, [Znl~2~{Me~2~Si(NPEt~3~)~2~}], and [ZnBr(NPMe~3~)]~4~·CH~2~Cl~2~ Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences 52(2) (1997) 243-250
Space group: P 1 21/n 1
Cell volume: 1764.47
Cell parameters: 9.479; 12.192; 15.271; 90; 91.17; 90;  

COD ID: 1100483
CIF file Formula: - C51 H48 Cl2 N2 O P2 -
Comments: Ghassemzadeh, Mitra; Harms, Klaus; Dehnicke, Kurt N,N'-Dim ethylharnstoff als chelatisierende Lewis-Säure: Synthese und Kristallstrukturen von PPh~4~[Cl(H~2~Me~2~N~2~CO)] und (PPh~4~)~2~[Cl(H~2~Me~2~N~2~CO)]Cl / N.N'-Dimethylurea as a Chelating Lewis Acid: Synthesis and Crystal Structures of PPh~4~[Cl(H~2~Me~2~N~2~CO)] and (PPh~4~)~2~[Cl(H~2~Me~2~N2~C~O)]Cl Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences 51(10) (1996) 1423-1427
Space group: P 1 21/n 1
Cell volume: 4530.34
Cell parameters: 11.384; 28.554; 13.94; 90; 91.19; 90;  

COD ID: 1100488
CIF file Formula: - C11 H27 N Sn3 -
Comments: Hillwig, Ralf; Harms, Klaus; Dehnicke, Kurt Die Kristallstruktur von Tris(trimethylstannyl) acetonitril / Crystal Structure of Tris(trimethylstannyl)-acetonitrile Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences 52(1) (1997) 145-148
Space group: P 1 21/n 1
Cell volume: 1885.81
Cell parameters: 9.754; 13.163; 14.853; 90; 98.55; 90;  

COD ID: 1100493
CIF file Formula: - C8 H21 As Cl5 N3 P2 Sn -
Comments: Garbe, Ralf; Wocadlo, Sigrid; Kang, Hak-Chul; Massa, Werner; Harms, Klaus; Dehnicke, Kurt Phosphaniminato-Komplexe des Arsens. Kristallstrukturen von [AsCl(NPMe~3~)]~2~Cl~2~, [AsCl(NPMe~3~)~2~SbCl~4~]SbCl~6~ und [AsCl(NPMe~3~)~2~SnCl~4~] · CH~3~CN Chemische Berichte 129(1) (1996) 109-113
Space group: P 1 21/n 1
Cell volume: 2101.97
Cell parameters: 8.895; 14.233; 17.012; 90; 102.59; 90;  

COD ID: 1100515
CIF file Formula: - C16 H38 Cu N2 O4 P2 -
Comments: Ackermann, H.; Geiseler, G.; Harms, K.; Leo, R.; Massa, W.; Weller, F.; Dehnicke, K. Triethylphosphanimin-Komplexe der Acetate von Kupfer(II) und Zink. Kristallstrukturen von [Zn(O~2~C-CH~3~)~2~(HNPEt~3~)], [Cu~5~(O~2~C-CH~3~)~10~(HNPEt~3~)~2~] und [Cu(O~2~C-CH~3~)~2~(HNPEt~3~)~2~] Zeitschrift fuer Anorganische und Allgemeine Chemie 625(9) (1999) 1500-1506
Space group: P 1 21/n 1
Cell volume: 1161.5
Cell parameters: 6.9549; 12.1785; 13.8005; 90; 96.451; 90;  

COD ID: 1100519
CIF file Formula: - C30 H77 N3 Na O3 Sc Si6 -
Comments: Karl, Marc; Harms, Klaus; Seybert, Gerd; Massa, Werner; Fau, Stefan; Frenking, Gernot; Dehnicke, Kurt Die Deprotonierung silylierter Amido-Komplexe von Seltenerdelementen Zeitschrift fuer Anorganische und Allgemeine Chemie 625(12) (1999) 2055-2063
Space group: P 1 21/n 1
Cell volume: 9603.47
Cell parameters: 29.414; 12.0546; 29.524; 90; 113.455; 90;  

COD ID: 1100520
CIF file Formula: - C30 H77 N3 Na O3 Si6 Yb -
Comments: Karl, Marc; Harms, Klaus; Seybert, Gerd; Massa, Werner; Fau, Stefan; Frenking, Gernot; Dehnicke, Kurt Die Deprotonierung silylierter Amido-Komplexe von Seltenerdelementen Zeitschrift fuer Anorganische und Allgemeine Chemie 625(12) (1999) 2055-2063
Space group: P 1 21/n 1
Cell volume: 9703.24
Cell parameters: 29.4389; 12.1954; 29.4429; 90; 113.372; 90;  

COD ID: 1100522
CIF file Formula: - C23 H42 N2 Na2 O2 Si2 -
Comments: Karl, Marc; Harms, Klaus; Seybert, Gerd; Massa, Werner; Fau, Stefan; Frenking, Gernot; Dehnicke, Kurt Die Deprotonierung silylierter Amido-Komplexe von Seltenerdelementen Zeitschrift fuer Anorganische und Allgemeine Chemie 625(12) (1999) 2055-2063
Space group: P 1 21/n 1
Cell volume: 2844.35
Cell parameters: 11.2665; 14.5925; 17.4113; 90; 96.461; 90;  

COD ID: 1100525
CIF file Formula: - C10 H10 As2 Ti -
Comments: Elschenbroich, Christoph; Kroker, Jörg; Nowotny, Mathias; Behrendt, Andreas; Metz, Bernhard; Harms, Klaus η^6^-Coordination of Arsenine to Titanium, Vanadium, and Chromium Organometallics 18(8) (1999) 1495-1503
Space group: P 1 21/n 1
Cell volume: 511.96
Cell parameters: 6.555; 7.984; 9.859; 90; 97.15; 90;  

COD ID: 1100540
CIF file Formula: - C10 H12 Cl F4 I2 N -
Comments: Grebe, Jutta; Geiseler, Gertraud; Harms, Klaus; Dehnicke, Kurt Donor-Akzeptor-Komplexe von Halogenidionen mit 1.4-Diiodtetrafluorbenzol / Donor-Acceptor Complexes of Halide Ions with 1,4-Diiodotetrafluorobenzene Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences 54(1) (1999) 77-86
Space group: P 1 21/n 1
Cell volume: 1590.69
Cell parameters: 7.148; 24.057; 9.308; 90; 96.38; 90;  

COD ID: 1100554
CIF file Formula: - C18 H15 N O3 P Re -
Comments: Schlecht, Sabine; Deubel, Dirk V.; Frenking, Gernot; Geiseler, Gertraud; Harms, Klaus; Magull, Jörg; Dehnicke, Kurt Phosphaniminato-Komplexe von Rhenium(VII). Synthesen und Kristallstrukturen von [ReO~3~(NPR~3~)] (R = Ph, Et) sowie von [ReO(OSiMe~3~)~3~(Me~3~SiNPEt~3~)] Zeitschrift für Anorganische und Allgemeine Chemie 625(6) (1999) 887-891
Space group: P 1 21/n 1
Cell volume: 1723.99
Cell parameters: 9.577; 17.991; 10.827; 90; 112.46; 90;  

COD ID: 1100555
CIF file Formula: - C6 H15 N O3 P Re -
Comments: Schlecht, Sabine; Deubel, Dirk V.; Frenking, Gernot; Geiseler, Gertraud; Harms, Klaus; Magull, Jörg; Dehnicke, Kurt Phosphaniminato-Komplexe von Rhenium(VII). Synthesen und Kristallstrukturen von [ReO~3~(NPR~3~)] (R = Ph, Et) sowie von [ReO(OSiMe~3~)~3~(Me~3~SiNPEt~3~)] Zeitschrift fuer Anorganische und Allgemeine Chemie 625(6) (1999) 887-891
Space group: P 1 21/n 1
Cell volume: 1112.54
Cell parameters: 8.3; 11.749; 11.465; 90; 95.68; 90;  

COD ID: 1100557
CIF file Formula: - C24 H62 Bi2 F4 N4 P4 -
Comments: Chitsaz, Soheila; Harms, Klaus; Neumüller, Bernhard; Dehnicke, Kurt Phosphaniminato-Komplexe von Bismut(III). Die Kristallstrukturen von [BiF~2~(NPEt~3~)(HNPEt~3~)]~2~ und [Bi~2~I(NPPh~3~)~4~]I~3~ Zeitschrift fuer Anorganische und Allgemeine Chemie 625(6) (1999) 939-944
Space group: P 1 21/n 1
Cell volume: 1831.21
Cell parameters: 21.0503; 11.958; 7.282; 90; 92.55; 90;  

COD ID: 1100558
CIF file Formula: - C74.5 H65 Bi2 Cl5 I4 N4 P4 -
Comments: Chitsaz, Soheila; Harms, Klaus; Neumüller, Bernhard; Dehnicke, Kurt Phosphaniminato-Komplexe von Bismut(III). Die Kristallstrukturen von [BiF~2~(NPEt~3~)(HNPEt~3~)]~2~ und [Bi~2~I(NPPh~3~)~4~]I~3~ Zeitschrift fuer Anorganische und Allgemeine Chemie 625(6) (1999) 939-944
Space group: P 1 21/n 1
Cell volume: 7771.38
Cell parameters: 15.426; 24.091; 21.735; 90; 105.82; 90;  

COD ID: 1100563
CIF file Formula: - C36 H54 Li2 N4 O2 Si2 -
Comments: Mommertz, Andreas; Geiseier, Gertraud; Harms, Klaus; Dehnicke, Kurt Kristallstrukturen von Me~2~Si[N(SiMe~3~)~2~]~2~ und [Me~2~Si(NPh)(NHPh)Li·OEt~2~]~2~ / Crystal Structures of Me~2~Si[N(SiMe~3~)~2~]~2~ and [Me~2~Si(NPh)(NHPh)Li·OEt~2~]~2~ Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences 53(9) (1998) 977-980
Space group: P 1 21/n 1
Cell volume: 1845.47
Cell parameters: 10.827; 10.388; 16.413; 90; 91.35; 90;  

COD ID: 1100570
CIF file Formula: - C55 H66 O5 Si2 -
Comments: Berninger, Jörn; Krauss, Rolf; Weinig, Hans-Georg; Koert, Ulrich; Ziemer, Burkhard; Harms, Klaus 2,3,6,7-Tetrasubstituted Perhydroanthracenes: Stereoselective Synthesis and Biconformationality Studies European Journal of Organic Chemistry 1999(4) (1999) 875-884
Space group: P 1 21/n 1
Cell volume: 4866.09
Cell parameters: 10.197; 35.713; 13.51; 90; 98.48; 90;  

COD ID: 1100579
CIF file Formula: - C38 H83 N3 Na O3 Si6 Sm -
Comments: Karl, M.; Seybert, G.; Massa, W.; Harms, K.; Agarwal, S.; Maleika, R.; Stelter, W.; Greiner, A.; Neumüller, W.; Heitz, B.; Dehnicke, K. Amidometallate von Seltenerdelementen. Synthese und Kristallstrukturen von [Na(12-Krone-4)~2~][M{N(SiMe~3~)~2~}~3~(OSiMe~3~)] (M = Sm, Yb), [Na(THF)~3~Sm{N(SiMe~3~)~2~}~3~(C≡C-Ph)], [Na(THF)~6~][Lu~2~(μ-NH~2~)(μ-NSiMe~3~){N(SiMe~3~)~2~}~4~] sowie von [NaN(SiMe~3~)~2~(THF)]~2~. Anwendungen der Seltenerdkomplexe als Polymerisationskatalysatoren Zeitschrift für anorganische und allgemeine Chemie 625(8) (1999) 1301-1309
Space group: P 1 21/n 1
Cell volume: 5404.84
Cell parameters: 13.4447; 23.2529; 17.3216; 90; 93.549; 90;  

COD ID: 1100585
CIF file Formula: - C21 H25 N O2 -
Comments: Bach, Thorsten; Schröder, Jürgen; Harms, Klaus Diastereoselective photocycloaddition of an axial chiral enamide Tetrahedron Letters 40(51) (1999) 9003-9004
Space group: P 1 21/n 1
Cell volume: 1802.8
Cell parameters: 10.5303; 11.7446; 14.8819; 90; 101.617; 90;  

COD ID: 1100595
CIF file Formula: - C24 H22 V2 -
Comments: Elschenbroich, Christoph; Schiemann, Olav; Burghaus, Olaf; Harms, Klaus; Pebler, Jürgen [5-5]Bitrovacene, (μ-η^5^:η^5^-Fulvalenediyl)bis[(η^7^-cycloheptatrienyl)vanadium]: Synthesis, Structure, and Intermetallic Communication Organometallics 18(17) (1999) 3273-3277
Space group: P 1 21/n 1
Cell volume: 901.05
Cell parameters: 10.447; 8.089; 10.911; 90; 102.25; 90;  

COD ID: 1100601
CIF file Formula: - C38 H76 Br4 Cd4 N4 P4 -
Comments: Harms, Klaus; Merle, Jan; Maichle-Mössmer, Cäciliä; Massa, Werner; Krieger, Matthias Heterocubane Phosphoraniminato Complexes of Cadmium Inorganic Chemistry 37(5) (1998) 1099-1104
Space group: P 1 21/n 1
Cell volume: 5429.4
Cell parameters: 21.601; 11.942; 23.55; 90; 116.654; 90;  

COD ID: 1100605
CIF file Formula: - C44 H98 Cu2 Li4 N4 O8 -
Comments: Boche, Gernot; Bosold, Ferdinand; Marsch, Michael; Harms, Klaus The Crystal Structures of a Lower Order and a "Higher Order" Cyanocuprate: [tBuCu(CN)Li(OEt~2~)~2~]~∞~ and [tBuCutBu{Li(thf)(pmdeta)}~2~CN] Angewandte Chemie, International Edition 37(12) (1998) 1684-1686
Space group: P 1 21/n 1
Cell volume: 3515.05
Cell parameters: 12.0874; 14.979; 19.4176; 90; 91.095; 90;  

COD ID: 1100610
CIF file Formula: - C128 H130 Li6 N6 O5 P6 -
Comments: Anfang, S.; Seybert, G.; Harms, K.; Geiseler, G.; Massa, W.; Dehnicke, K. Reaktionen von LiNPPh~3~ mit den Cyclooctatetraenid-Komplexen [Ln(C~8~H~8~)Cl(THF)~2~]~2~ von Cer und Samarium. Die Kristallstrukturen von [LiNPPh~3~]~6~, [Ln(C~8~H~8~)Li~3~Cl~2~(NPPh~3~)~2~(THF)~3~] (Ln = Ce, Sm) und [Li(THF)~4~][Sm(C~8~H~8~)~2~] Zeitschrift fuer Anorganische und Allgemeine Chemie 624(7) (1998) 1187-1192
Space group: P 1 21/n 1
Cell volume: 11399.3
Cell parameters: 14.194; 29.539; 27.23; 90; 93.18; 90;  

COD ID: 1100624
CIF file Formula: - C38 H30 As2 Br N -
Comments: Chitsaz, Soheila; Neumüller, Bernhard; Harms, Klaus; Dehnicke, Kurt Asymmetrisch substituierte Iminiumsalze [Et~3~PNAsPh~3~]X und ihre Reaktion mit Acetonitril. Kristallstrukturen von [Et~3~PNAsPh~3~]X (X = Cl, Br), [(Ph~3~As)~2~CCN]Br und [(Ph~3~As)~2~CCN(SnBr~5~)] Zeitschrift fuer Anorganische und Allgemeine Chemie 624(8) (1998) 1341-1346
Space group: P 1 21/n 1
Cell volume: 3152.39
Cell parameters: 10.223; 15.9892; 19.6389; 90; 100.883; 90;  

COD ID: 1100626
CIF file Formula: - C14 H39 Br4 Co4 N5 P4 -
Comments: Riese, Ulrike; Harms, Klaus; Neumüller, Bernhard; Dehnicke, Kurt Cobalt(II)-organische Phosphaniminato-Komplexe mit Heterocuban-Struktur. Kristallstrukturen von [CoBr(NPR~3~)]~4~ mit R = Me, Et, [Co(C≡C-CMe3)(NPMe3)]~4~ und [Co(C≡C-SiMe~3~)(NPEt~3~)]~4~ Zeitschrift fuer Anorganische und Allgemeine Chemie 624(8) (1998) 1279-1284
Space group: P 1 21/n 1
Cell volume: 3570.74
Cell parameters: 9.8662; 20.7898; 17.8309; 90; 102.498; 90;  

COD ID: 1100630
CIF file Formula: - C17 H34 Li N5 -
Comments: Bosold, F.; Marsch, M.; Harms, K.; Boche, G. Crystal structure of 1-lithio-1-phenyl-2,2-dimethylhydrazine-pentamethyldiethylenetriamine, [(C6H5)(CH3)2N2]Li(C9H23N3) Zeitschrift für Kristallographie - New Crystal Structures 213(1-4) (1998) 619-620
Space group: P 1 21/n 1
Cell volume: 2010.18
Cell parameters: 9.305; 15.119; 14.411; 90; 97.467; 90;  

COD ID: 1100631
CIF file Formula: - C12 H19 Li N2 O -
Comments: Bosold, F.; Marsch, M.; Harms, K.; Boche, G. Crystal structure of 1-lithio-1-phenyl-2,2-dimethylhydrazinetetrahydrofuran, [(C~6~H~5~)(CH~3~)~2~N~2~]Li·C~4~H~8~O Zeitschrift für Kristallographie 213(1-4) (1998) 621-622
Space group: P 1 21/n 1
Cell volume: 1223.87
Cell parameters: 9.81; 7.671; 16.541; 90; 100.51; 90;  

COD ID: 1100637
CIF file Formula: - C126 H118 N6 O2 P6 Si2 Y2 -
Comments: Anfang, S.; Gröb, T.; Harms, K.; Seybert, G.; Massa, W.; Greiner, A.; Dehnicke, K. Phosphaniminato-Komplexe von Seltenerdelementen. Die Kristallstrukturen von [Yb~2~Cp~3~(NPPh~3~)~3~], [YCp(NPPh~3~)(μ-OSiMe~2~NPPh~3~)]~2~ und [M(NPPh~3~)~2~(μ-OSiMe~2~NPPh~3~)]~2~ mit M = Y und Sm Zeitschrift fuer Anorganische und Allgemeine Chemie 625(11) (1999) 1853-1859
Space group: P 1 21/n 1
Cell volume: 5553.6
Cell parameters: 18.0406; 14.0182; 22.2165; 90; 98.716; 90;  

COD ID: 1100639
CIF file Formula: - C18 H15 Cl N P -
Comments: Grebe, Jutta; Schlecht, Sabine; Weller, Frank; Harms, Klaus; Geiseler, Gertraud; Dehnicke, Kurt N-Chlortriphenylphosphanimin und seine Anwendung als Edukt zur Synthese asymmetrischer PNP-Kationen. Kristallstrukturen von Ph~3~PNCl und [Ph~3~PNPEt~3~]Cl Zeitschrift fuer Anorganische und Allgemeine Chemie 625(4) (1999) 633-636
Space group: P 1 21/n 1
Cell volume: 1530.58
Cell parameters: 10.4739; 10.0858; 14.5229; 90; 93.919; 90;  

COD ID: 1100641
CIF file Formula: - C60 H44 B Cr -
Comments: Elschenbroich, Christoph; Möckel, Reinhart; Vasil'kov, Alexander; Metz, Bernhard; Harms, Klaus Chromium Sandwich Complexes of Polycyclic Aromatic Hydrocarbons: Triphenylene and Fluoranthene as η^6^ Ligands European Journal of Inorganic Chemistry 1998(10) (1998) 1391-1401
Space group: P 1 21/n 1
Cell volume: 4086.88
Cell parameters: 15.374; 16.636; 16.721; 90; 107.13; 90;  

COD ID: 1100669
CIF file Formula: - C29 H22 Cl F6 N3 O2 P2 Ru -
Comments: Ooyama, Dai; Sato, Masahito Crystal Structure of (2,2'-Bipyridine-N,N')(diphenyl-2-phosphinopyridine-P)-chloro(dicarbonyl)ruthenium(II) Hexafluorophosphate Analytical Sciences: X-ray Structure Analysis Online 19 (2003) x39-x40
Space group: P 1 21/n 1
Cell volume: 3053.3
Cell parameters: 10.237; 18.754; 16.566; 90; 106.257; 90;  

COD ID: 1100674
CIF file Formula: - C74 H74 N10 O2 P2 Zn2 -
Comments: Shen, Xuan; Sakata, Kazunori; Hashimoto, Mamoru Crystal Structure of a Dinuclear 1,2-Bis(diphenylphosphinooxide)ethane-bridged (6,8,15,17-Tetramethyldibenzo[b,i][1,4,8,11]-tetraazacyclotetradecinato) zinc(II) Complex Analytical Sciences: X-ray Structure Analysis Online 19 (2003) x49-x50
Space group: P 1 21/n 1
Cell volume: 3261
Cell parameters: 15.456; 9.993; 21.691; 90; 103.23; 90;  

COD ID: 1100686
CIF file Formula: - C3 H4 N4 -
Comments: Hwang, Long-Chih; Wu, Rang-Rong; Jane, Shin-Yi; Lee, Gene-Hsiang Crystal Structure of 3-Amino-1,2,4-triazine Analytical Sciences: X-ray Structure Analysis Online 19 (2003) x73-x74
Space group: P 1 21/n 1
Cell volume: 439.01
Cell parameters: 5.2095; 14.1845; 6.0638; 90; 101.545; 90;  

COD ID: 1100691
CIF file Formula: - C36 H48 Cd Cl2 N8 O8 S4 -
Comments: Cherni, Saoussen Namouchi; Samba, Mohamadou; Dachraoui, Mohamed Crystal Structure of Tetrakis(N,N-dimethyl, N'-phenylthiourea-S) cadmium(II) diperchlorate [Cd((CH~3~)~2~NCSNHPh)~4~](ClO~4~)~2~ Analytical Sciences: X-ray Structure Analysis Online 20 (2004) x3-x4
Space group: P 1 21/n 1
Cell volume: 4634
Cell parameters: 11.082; 35.856; 12.135; 90; 106.04; 90;  

COD ID: 1100697
CIF file Formula: - C13 H14 Cu2 I2 N2 S -
Comments: ()
Space group: P 1 21/n 1
Cell volume: 1743.5
Cell parameters: 10.354; 16.245; 10.528; 90; 100.08; 90;  

COD ID: 1100699
CIF file Formula: - C12 H12 Cl2 Cu N2 O S -
Comments: ()
Space group: P 1 21/n 1
Cell volume: 1451.6
Cell parameters: 8.077; 13.919; 12.956; 90; 94.728; 90;  

COD ID: 1100705
CIF file Formula: - C18 H18 Cu2 I2 N4 S2 -
Comments: ()
Space group: P 1 21/n 1
Cell volume: 1083.35
Cell parameters: 10.033; 8.7293; 12.3735; 90; 91.421; 90;  

COD ID: 1100707
CIF file Formula: - C16 H32 Au2 N12 Pt -
Comments: Jay R. Stork; Daniel Rios; David Pham; Vincent Bicocca; Marilyn M. Olmstead; Alan L. Balch Metal-Metal Interactions in Platinum(II)/Gold(I) or Platinum(II)/Silver(I) Salts Containing Planar Cations and Linear Anions Inorganic Chemistry 44 (2005) 3466-3472
Space group: P 1 21/n 1
Cell volume: 1325
Cell parameters: 8.919; 15.424; 10.074; 90; 107.047; 90;  

COD ID: 1100725
CIF file Formula: - C33 H24 Cl4 Hg N4 O2 -
Comments: Tara J. Burchell; Richard J. Puddephatt Self-Assembly of Chiral Coordination Polymers and Macrocycles: A Metal Template Effect on the Polymer-Macrocycle Equilibrium Inorganic Chemistry 44 (2005) 3718-3730
Space group: P 1 21/n 1
Cell volume: 3177.7
Cell parameters: 10.188; 22.928; 13.624; 90; 93.11; 90;  

COD ID: 1100766
CIF file Formula: - C19 H22 B Cl N6 S2 Zn -
Comments: Mian Ji; Boumahdi Benkmil; Heinrich Vahrenkamp Zinc-Thiolate Complexes of the Bis(pyrazolyl)(thioimidazolyl)hydroborate Tripods for the Modeling of Thiolate Alkylating Enzymes Inorganic Chemistry 44(10) (2005) 3518-3523
Space group: P 1 21/n 1
Cell volume: 2327.3
Cell parameters: 10.103; 23.398; 10.1354; 90; 103.741; 90;  

COD ID: 1100778
CIF file Formula: - K2 O8 S2 Zn -
Comments: Rolf W. Berg; Niels Thorup The Reaction between ZnO and Molten Na2S2O7 or K2S2O7 Forming Na2Zn(SO4)2 or K2Zn(SO4)2, Studied by Raman Spectroscopy and X-ray Diffraction Inorganic Chemistry 44 (2005) 3485-3493
Space group: P 1 21/n 1
Cell volume: 758.2
Cell parameters: 5.3582; 8.7653; 16.152; 90; 91.78; 90;  

COD ID: 1100798
CIF file Formula: - C18 H36 N2 Si2 Zr -
Comments: Cano, Jesús; Sudupe, María; Royo, Pascual; Mosquera, Marta E. G. Insertion Reactions into the Metal‒Alkyl and Metal‒Amido Bonds of 1,3-Di(silyl-η-amido)cyclopentadienyl Titanium and Zirconium Complexes Organometallics 24(10) (2005) 2424-2432
Space group: P 1 21/n 1
Cell volume: 2273.8
Cell parameters: 11.3691; 13.9028; 15.137; 90; 108.131; 90;  

COD ID: 1100809
CIF file Formula: - C30 H50 N4 O2 Si Ti -
Comments: Boyd, Catherine L.; Clot, Eric; Guiducci, Aldo E.; Mountford, Philip Pendant Arm Functionalized Benzamidinate Titanium Imido Compounds: Experimental and Computational Studies of Their Reactions with CO~2~ Organometallics 24(10) (2005) 2347-2367
Space group: P 1 21/n 1
Cell volume: 3214.2
Cell parameters: 9.0352; 20.1007; 18.2507; 90; 104.14; 90;  

COD ID: 1100824
CIF file Formula: - C64 H116 Al2 Si4 Y2 -
Comments: Evans, William J.; Kozimor, Stosh A.; Brady, Jason C.; Davis, Benjamin L.; Nyce, Gregory W.; Seibel, Christopher A.; Ziller, Joseph W.; Doedens, Robert J. Metallocene Allyl Reactivity in the Presence of Alkenes Tethered to Cyclopentadienyl Ligands Organometallics 24(10) (2005) 2269-2278
Space group: P 1 21/n 1
Cell volume: 3421.7
Cell parameters: 11.0875; 19.7843; 15.6311; 90; 93.695; 90;  

COD ID: 1100827
CIF file Formula: - C23 H35 Y -
Comments: Evans, William J.; Kozimor, Stosh A.; Brady, Jason C.; Davis, Benjamin L.; Nyce, Gregory W.; Seibel, Christopher A.; Ziller, Joseph W.; Doedens, Robert J. Metallocene Allyl Reactivity in the Presence of Alkenes Tethered to Cyclopentadienyl Ligands Organometallics 24(10) (2005) 2269-2278
Space group: P 1 21/n 1
Cell volume: 2142.3
Cell parameters: 8.9218; 17.632; 13.6181; 90; 90.066; 90;  

COD ID: 1100843
CIF file Formula: - C16 H38 Cl2 O P2 Ru -
Comments: Major, Quinn; Lough, Alan J.; Gusev, Dmitry G. Substituents Effects in POP Pincer Complexes of Ruthenium Organometallics 24(10) (2005) 2492-2501
Space group: P 1 21/n 1
Cell volume: 2173.03
Cell parameters: 10.7468; 16.5738; 12.9615; 90; 109.736; 90;  

COD ID: 1100846
CIF file Formula: - C73 H97 B2 Fe N3 O P4 -
Comments: Henry, Renee M.; Shoemaker, Richard K.; Newell, Rachel H.; Jacobsen, George M.; DuBois, Daniel L.; Rakowski DuBois, M. Stereochemical Control of Iron(II) Complexes Containing a Diphosphine Ligand with a Pendant Nitrogen Base Organometallics 24(10) () 2481-2491
Space group: P 1 21/n 1
Cell volume: 6942
Cell parameters: 21.873; 13.629; 24.754; 90; 109.824; 90;  

COD ID: 1100849
CIF file Formula: - C20 H35 B4 Cl3 Ru2 -
Comments: Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C. Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and closo-2,3-(η^5^-C~5~Me~5~Ru)~2~B~6~H~3~Cl~3~ Organometallics 24(10) (2005) 2473-2480
Space group: P 1 21/n 1
Cell volume: 2506.58
Cell parameters: 10.5503; 13.9118; 17.6855; 90; 105.063; 90;  

COD ID: 1100851
CIF file Formula: - C22 H38 B5 Cl3 Ru2 S -
Comments: Ghosh, Sundargopal; Fehlner, Thomas P.; Beatty, Alicia M.; Noll, Bruce C. Insertion of B-X (X = Cl, SMe~2~) Moieties into Ruthenaborane Frameworks: Synthesis and Characterization of (η^5^-C~5~Me~5~Ru)~2~(μ-H)B~4~H~m~Cl~n~, (m, n = 4, 3; 5, 2; 7, 2), closo-1-(SMe~2~)-2,3-(η^5^-C~5~Me~5~Ru)~2~(μ~3~-H)B~5~HCl~3~, and closo-2,3-(η^5^-C~5~Me~5~Ru)~2~B~6~H~3~Cl~3~ Organometallics 24(10) (2005) 2473-2480
Space group: P 1 21/n 1
Cell volume: 2832.6
Cell parameters: 8.4861; 20.9284; 15.954; 90; 91.414; 90;  

COD ID: 1100855
CIF file Formula: - C39 H40 Cl2 Fe4 N2 O8 -
Comments: Busetto, Luigi; Marchetti, Fabio; Zacchini, Stefano; Zanotti, Valerio Deprotonation of μ-Vinyliminium Ligands in Diiron Complexes: A Route for the Synthesis of Mono- and Polynuclear Species Containing Novel Multidentate Ligands Organometallics 24(10) (2005) 2297-2306
Space group: P 1 21/n 1
Cell volume: 3861.2
Cell parameters: 18.032; 10.346; 21.479; 90; 105.5; 90;  

COD ID: 1100860
CIF file Formula: - C21 H26 Au Cl N2 -
Comments: de Frémont, Pierre; Scott, Natalie M.; Stevens, Edwin D.; Nolan, Steven P. Synthesis and Structural Characterization of <i>N</i> -Heterocyclic Carbene Gold(I) Complexes Organometallics 24(10) (2005) 2411-2418
Space group: P 1 21/n 1
Cell volume: 2078.91
Cell parameters: 8.4242; 21.933; 11.2534; 90; 91.06; 90;  

COD ID: 1100863
CIF file Formula: - C7 H12 Au Cl N2 -
Comments: de Frémont, Pierre; Scott, Natalie M.; Stevens, Edwin D.; Nolan, Steven P. Synthesis and Structural Characterization of <i>N</i> -Heterocyclic Carbene Gold(I) Complexes Organometallics 24(10) (2005) 2411-2418
Space group: P 1 21/n 1
Cell volume: 968.3
Cell parameters: 10.405; 8.4073; 11.068; 90; 90; 90;  

COD ID: 1100895
CIF file Formula: - C24 H47 Cl N5 Nb O Si2 -
Comments: Ward, Benjamin D.; Orde, Gavin; Clot, Eric; Cowley, Andrew R.; Gade, Lutz H.; Mountford, Philip Reactions of Neutral and Cationic Diamide-Supported Imido Complexes with CO <sub>2</sub> and Other Heterocumulenes: Issues of Site Selectivity Organometallics 24(10) (2005) 2368-2385
Space group: P 1 21/n 1
Cell volume: 12960.8
Cell parameters: 16.8425; 21.51; 36.4135; 90; 100.741; 90;  

COD ID: 1100939
CIF file Formula: - C28 H22 Cl2 N6 O4 Ru -
Comments: Nripen Chanda; Debamita Paul; Sanjib Kar; Shaikh M. Mobin; Anindya Datta; Vedavati G. Puranik; K. Krishnamurthy Rao; Goutam Kumar Lahiri Effect of 2-(2-Pyridyl)azole-Based Ancillary Ligands (L1-4) on the Electrophilicity of the Nitrosyl Function in [RuII(trpy)(L1-4)(NO)]3+ [trpy = 2,2':6',2''-Terpyridine]. Synthesis, Structures, and Spectroscopic, Electrochemical, and Kinetic Aspects Inorganic Chemistry 44 (2005) 3499-3511
Space group: P 1 21/n 1
Cell volume: 2707.3
Cell parameters: 14.398; 12.162; 15.477; 90; 92.644; 90;  

COD ID: 1100959
CIF file Formula: - C24 H40 Fe P2 -
Comments: Eric J. Hawrelak; Wesley H. Bernskoetter; Emil Lobkovsky; Gordon T. Yee; Eckhard Bill; Paul J. Chirik Square Planar vs Tetrahedral Geometry in Four Coordinate Iron(II) Complexes Inorganic Chemistry 44 (2005) 3103-3111
Space group: P 1 21/n 1
Cell volume: 2455.4
Cell parameters: 9.4702; 13.8619; 18.8839; 90; 97.916; 90;  

COD ID: 1100960
CIF file Formula: - C38 H52 Fe P2 -
Comments: Eric J. Hawrelak; Wesley H. Bernskoetter; Emil Lobkovsky; Gordon T. Yee; Eckhard Bill; Paul J. Chirik Square Planar vs Tetrahedral Geometry in Four Coordinate Iron(II) Complexes Inorganic Chemistry 44 (2005) 3103-3111
Space group: P 1 21/n 1
Cell volume: 1709.74
Cell parameters: 10.6501; 9.2391; 18.165; 90; 106.95; 90;  

COD ID: 1100963
CIF file Formula: - C32 H30 Cl10 Fe P2 -
Comments: Eric J. Hawrelak; Wesley H. Bernskoetter; Emil Lobkovsky; Gordon T. Yee; Eckhard Bill; Paul J. Chirik Square Planar vs Tetrahedral Geometry in Four Coordinate Iron(II) Complexes Inorganic Chemistry 44 (2005) 3103-3111
Space group: P 1 21/n 1
Cell volume: 1753.2
Cell parameters: 10.6719; 14.4951; 11.6623; 90; 103.629; 90;  

COD ID: 1100966
CIF file Formula: - C31 H66 Cu4 N8 S8 W2 -
Comments: Jian-Ping Lang; Chang-Mei Jiao; Shan-Bao Qiao; Wen-Hua Zhang; Brendan F. Abrahams Acetic Acid Induced Self-Assembly of Supramolecular Compounds [Et4N]3[(WS4Cu2)2(μ-CN)3].2MeCN and [PPh4][WS4Cu3(μ-CN)2].MeCN from Preformed Clusters [A]2[WS4(CuCN)2] (A = Et4N, PPh4) Inorganic Chemistry 44 (2005) 3664-3668
Space group: P 1 21/n 1
Cell volume: 2531.5
Cell parameters: 10.078; 18.958; 13.535; 90; 101.785; 90;  

COD ID: 1100969
CIF file Formula: - C12 H28 Cl2 O7 Sn2 -
Comments: Corrado Di Nicola; Agustin Galindo; John V. Hanna; Fabio Marchetti; Claudio Pettinari; Riccardo Pettinari; Eleonora Rivarola; Brian W. Skelton; Allan H. White Synthesis and Spectroscopic and X-ray Structural Characterization of R2SnIV-Oxydiacetate and -Iminodiacetate Complexes Inorganic Chemistry 44 (2005) 3094-3102
Space group: P 1 21/n 1
Cell volume: 2001.5
Cell parameters: 8.137; 17.648; 14.085; 90; 98.296; 90;  

COD ID: 1100984
CIF file Formula: - C44 H52 Cl6 F6 N2 Ni O10 -
Comments: Swarnalatha Kokatam; Thomas Weyhermüller; Eberhard Bothe; Phalguni Chaudhuri; Karl Wieghardt Structural Characterization of Four Members of the Electron-Transfer Series [PdII(L)2)2]n (L = o-Iminophenolate Derivative; n= 2-, 1-, 0, 1+, 2+). Ligand Mixed Valency in the Monocation and Monoanion with S=1/2 Ground States Inorganic Chemistry 44 (2005) 3709-3717
Space group: P 1 21/n 1
Cell volume: 2549.18
Cell parameters: 12.8217; 15.1119; 13.2926; 90; 98.21; 90;  

COD ID: 1101057
CIF file Formula: - C10 H12 Cl2 N8 O4 Pt -
Comments: Salas, Juan M.; Quirós, Miguel; Abul Haj, Mohammad; Magán, Rosa; Marín, Clotilde; Sáchez-Moreno, Manuel; Faure, René Activity of Pt(II) and Ru(III) Triazolopyrimidine Complexes Against Parasites of the Genus Leishmania, Trypanosomas and Phytomonas Metal-Based Drugs 8(3) (2001) 119-124
Space group: P 1 21/n 1
Cell volume: 1631.9
Cell parameters: 10.046; 13.354; 13.128; 90; 112.08; 90;  

COD ID: 1101089
CIF file Formula: - C12 H12 Cl2 N8 O V -
Comments: Juan Cancela; María J. González Garmendia; Miguel Quirós Inorganica Chimica Acta 313 (2001) 156-159
Space group: P 1 21/n 1
Cell volume: 1695.6
Cell parameters: 11.4188; 10.5354; 14.2058; 90; 97.179; 90;  

COD ID: 1101103
CIF file Formula: - C32 H52 Cl2 N20 Ni O16 -
Comments: Ángel García Raso; Juan J. Fiol; Ferran Bádenas; Rosa Cons; Ángel Terrón; Miguel Quirós Synthesis and structural studies of metal-acyclovir (ACV) complexes: [Ni(or Co)(ACV)~2~(H~2~O)~4~]Cl~2~.2ACV, [Zn(ACV)Cl~2~(H~2~O)], [Cd(ACV)Cl~2~].H~2~O and [{Hg(ACV)Cl~2~}~x~]. Recognition of acyclovir by Ni-ACV Journal of the Chemical Society, Dalton Transactions (1999) 167-173
Space group: P 1 21/n 1
Cell volume: 2294.5
Cell parameters: 12.6672; 15.134; 12.8273; 90; 111.077; 90;  

COD ID: 1101118
CIF file Formula: - C42 H55 Cd Cl2 N18 O18.5 -
Comments: Nuria A. Illán-Cabeza; Rosario A. Vilaplana; Ysmael Álvarez; Khalid Akdi; Sanae Kamah; Francisco Hueso-Ureña; Miguel Quirós; Francisco González-Vílchez; Miguel N. Moreno-Carretero Synthesis, structure and biological activity of a new and efficient Cd(II)-uracil derivative complex system for cleavage of DNA JBIC Journal of Biological Inorganic Chemistry 10(8) (2005) 924-934
Space group: P 1 21/n 1
Cell volume: 5447.5
Cell parameters: 14.4479; 22.195; 17.12; 90; 97.126; 90;  

COD ID: 1101122
CIF file Formula: - C16 H24 Co N10 O14 -
Comments: Francisco Hueso-Ureña; Sonia B. Jiménez-Pulido; Miguel N. Moreno-Carretero; Miguel Quirós; Juan M. Salas Synthesis and structural studies on metal nitrate complexes with 1,3-dimethyllumazine and 1,3,6,7-tetramethyllumazine: crystal structure of two new cobalt(II) and copper(II) three-dimensionally hydrogen-bonded complexes and a cadmium(II) complex with unusual geometry Inorganica Chimica Acta 277 (1998) 103-110
Space group: P 1 21/n 1
Cell volume: 1301.8
Cell parameters: 8.746; 13.584; 10.997; 90; 94.89; 90;  

COD ID: 1101124
CIF file Formula: - C20 H32 Cu N10 O14 -
Comments: Francisco Hueso-Ureña; Sonia B. Jiménez-Pulido; Miguel N. Moreno-Carretero; Miguel Quirós; Juan M. Salas Synthesis and structural studies on metal nitrate complexes with 1,3-dimethyllumazine and 1,3,6,7-tetramethyllumazine: crystal structure of two new cobalt(II) and copper(II) three-dimensionally hydrogen-bonded complexes and a cadmium(II) complex with unusual geometry Inorganica Chimica Acta 277 (1998) 103-110
Space group: P 1 21/n 1
Cell volume: 1492.3
Cell parameters: 8.9929; 14.0574; 11.9242; 90; 98.124; 90;  

COD ID: 1101126
CIF file Formula: - C6 H9 N5 O3 -
Comments: M. Purificación Sánchez; M. Angustias Romero; Juan M. Salas; Diego J. Cárdenas; José Molina; Miguel Quirós Molecular orbital study of 8-azaxanthine derivatives and crystal structure of 1,3-dimethyl-8-azaxanthine monohydrate Journal of Molecular Structure 344 (1995) 257-264
Space group: P 1 21/n 1
Cell volume: 849.5
Cell parameters: 10.679; 5.814; 13.794; 90; 97.31; 90;  

COD ID: 1101128
CIF file Formula: - C10 H12 Cl Hg N5 O5 -
Comments: Francisco Hueso-Ureña; Sonia B. Jiménez-Pulido; Miguel N. Moreno-Carretero; Miguel Quirós; Juan M. Salas Synthesis and structural studies on 1:1 metal complexes with 1,3-dimethyllumazine and 1,3,6,7-tetramethyllumazine. Crystal structure of two dichloro copper(II) and mercury(II) compounds and a polymeric chloro-nitrato bridged-mercury(II) complex. Polyhedron 17 (1998) 3409-3418
Space group: P 1 21/n 1
Cell volume: 1500.2
Cell parameters: 13.315; 8.539; 13.932; 90; 108.728; 90;  

COD ID: 1101138
CIF file Formula: - C16 H24 Cu N10 O14 -
Comments: Francisco Hueso-Ureña; Sonia B. Jiménez-Pulido; Miguel N. Moreno-Carretero; Miguel Quirós; Juan M. Salas A new three-dimensional, hydrogen-bonded metal-pteridine complex: synthesis, characterization and crystal structure of diaqua bis(1,3-dimethylpteridine-2,4(1H,3H)-dione-O^4^,N^5^) copper(II) nitrate dihydrate Polyhedron 16 (1997) 607-612
Space group: P 1 21/n 1
Cell volume: 1294.4
Cell parameters: 8.746; 13.874; 10.678; 90; 92.64; 90;  

COD ID: 1101143
CIF file Formula: - C20 H17 Fe N S -
Comments: ()
Space group: P 1 21/n 1
Cell volume: 1676.6
Cell parameters: 7.721; 25.495; 8.566; 90; 96.12; 90;  

COD ID: 1101151
CIF file Formula: - C44 H88 Mn12 O42 -
Comments: Yangguang Li; Wolfgang Wernsdorfer; Rodolphe Clerac; Ian J. Hewitt; Christopher E. Anson; Annie K. Powell New Valence-Sandwich [MnII4MnIII4MnII4] Aggregate Showing Single-Molecule Magnet Behavior Inorganic Chemistry 45(6) (2006) 2376-2378
Space group: P 1 21/n 1
Cell volume: 3458.5
Cell parameters: 11.8465; 14.2914; 20.564; 90; 96.596; 90;  

COD ID: 1200016
CIF file Formula: - Al H3 O3 -
Comments: Saalfeld, H; Wedde, M Refinement of the crystal structure of gibbsite, Al (O H)3 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 139 (1974) 129-135
Space group: P 1 21/n 1
Cell volume: 428
Cell parameters: 8.684; 5.078; 9.736; 90; 94.54; 90;  

COD ID: 1500024
CIF file Formula: - C7 H17 Cl N2 O2 -
Comments: Armel Le Bail <i>Ab initio</i> structure determination of bethanechol chloride Powder Diffraction 25 (2010)
Space group: P 1 21/n 1
Cell volume: 1037.28
Cell parameters: 8.8749; 16.4118; 7.1373; 90; 93.8031; 90;  

COD ID: 1501458
CIF file Formula: - C32 H26 K N2 O4 S4 -
Comments: Theivanayagam C. Deivaraj; Wei Hoon Lye; Jagadese J. Vittal New Metalloligands [M(SC{O}Ph)4]-: Synthesis and Characterization of Polymeric [A(MeCN)x{M(SC{O}Ph)4}] Compounds (A = Li, Na and K; M = Ga and In; x= 0-2) Inorganic Chemistry 41 (2002) 3755-3760
Space group: P 1 21/n 1
Cell volume: 3459
Cell parameters: 12.307; 13.672; 20.575; 90; 92.356; 90;  

COD ID: 1501471
CIF file Formula: - C45 H35 Cd Cl N4 O7 -
Comments: Katarzyna Grubel; Brynna J. Laughlin; Thora R. Maltais; Rhett C. Smith; Atta M. Arif; Lisa M. Berreau Photochemically-induced dioxygenase-type CO-release reactivity of Group 12 metal flavonolate complexes Chemical Communications 47(37) (2011) 10431-10433
Space group: P 1 21/n 1
Cell volume: 3905.89
Cell parameters: 11.4616; 16.3861; 20.877; 90; 95.0205; 90;  

COD ID: 1501472
CIF file Formula: - C45 H35 Cl Hg N4 O7 -
Comments: Katarzyna Grubel; Brynna J. Laughlin; Thora R. Maltais; Rhett C. Smith; Atta M. Arif; Lisa M. Berreau Photochemically-induced dioxygenase-type CO-release reactivity of Group 12 metal flavonolate complexes Chemical Communications 47(37) (2011) 10431-10433
Space group: P 1 21/n 1
Cell volume: 3905.65
Cell parameters: 11.4117; 16.3761; 20.9794; 90; 95.007; 90;  

COD ID: 1501564
CIF file Formula: - C56 H56 Ag10 N10 O30 S8 -
Comments: Mohamed Osman Awaleh; Francois Brisse; Youssouf Djibril Soubaneh; Thierry Maris; Elias Said Dirieh Four New Ag(I) Coordination Polymers: Synthesis, Crystal Structures and Thermal Stability J. Inorg. Organomet. Polym. 20 (2010) 816-824
Space group: P 1 21/n 1
Cell volume: 7797.7
Cell parameters: 9.6877; 25.1542; 32.2345; 90; 96.929; 90;  

COD ID: 1501607
CIF file Formula: - C14 H16 Cl N5 -
Comments: Olivier LeBel; Thierry Maris; Hugues Duval; James D. Wuest A practical guide to arylbiguanides — Synthesis and structural characterization Can. J. Chem. 83 (2005) 615-625
Space group: P 1 21/n 1
Cell volume: 1679.9
Cell parameters: 9.627; 4.9751; 35.2533; 90; 95.79; 90;  

COD ID: 1501609
CIF file Formula: - C29 H16 N4 S4 -
Comments: Dominic Laliberté; Thierry Maris; James D. Wuest Molecular tectonics - Use of urethanes and ureas derived from tetraphenylmethane and tetraphenylsilane to build porous chiral hydrogenbonded networks Can. J. Chem. 82 (2004) 386-398
Space group: P 1 21/n 1
Cell volume: 2722.74
Cell parameters: 11.649; 11.4547; 20.5132; 90; 95.89; 90;  

COD ID: 1501615
CIF file Formula: - C21 H13 Cu F3 O6 -
Comments: Fedor Valach; Miroslav Tokarčík; Thierry Maris; David J. Watkin; Keith Prout Bond-valence approach to the copper-copper and copper-oxygen bonding in binuclear copper(II) complexes: Structure of tetrakis(2-fluorobenzoato-O,O')-bis (2-fluorobenzoate-O) dicopper(II) Zeitschrift für Kristallographie - Crystalline Materials 215(1) (2000) 56-60
Space group: P 1 21/n 1
Cell volume: 1961.3
Cell parameters: 10.633; 12.528; 14.729; 90; 91.62; 90;  

COD ID: 1501620
CIF file Formula: - C46 H36 N6 O14 -
Comments: Eric Gagnon; Thierry Maris; Kenneth E. Maly; James D. Wuest The potential of intermolecular N/O interactions of nitro groups in crystal engineering, as revealed by structures of hexakis(4-nitrophenyl)benzene Tetrahedron 63 (2007) 6603-6613
Space group: P 1 21/n 1
Cell volume: 2090.4
Cell parameters: 10.7355; 13.931; 14.1161; 90; 98.039; 90;  

COD ID: 1501634
CIF file Formula: - C26 H26 N2 O2 S -
Comments: M. Amine Fourati; Thierry Maris; William G. Skene; C. Géraldine Bazuin; Robert E. Prud'homme Photophysical, Electrochemical and Crystallographic Investigations of the Fluorophore 2,5-Bis(5-tert-butyl-benzoxazol-2-yl)thiophene The Journal of Physical Chemistry B 115 (2011) 12362-12369
Space group: P 1 21/n 1
Cell volume: 2264.84
Cell parameters: 17.9167; 6.2563; 21.1871; 90; 107.512; 90;  

COD ID: 1501637
CIF file Formula: - C27 H18 Br6 -
Comments: Ulrich Darbost; Janie Cabana; Eric Demers; Thierry Maris; James D. Wuest Molecular Tectonics. Use of Br...aryl Supramolecular Interactions for the construction of Organized Networks from 9,9'-spirobifluorene in the Crystalline State. CheM 1 (2011) 52-12369
Space group: P 1 21/n 1
Cell volume: 5344.9
Cell parameters: 19.2957; 13.8813; 20.0269; 90; 94.857; 90;  

COD ID: 1501638
CIF file Formula: - C26 H18 Br2 -
Comments: Ulrich Darbost; Janie Cabana; Eric Demers; Thierry Maris; James D. Wuest Molecular Tectonics. Use of Br...aryl Supramolecular Interactions for the construction of Organized Networks from 9,9'-spirobifluorene in the Crystalline State. CheM 1 (2011) 52-12369
Space group: P 1 21/n 1
Cell volume: 2087.52
Cell parameters: 10.384; 17.969; 11.188; 90; 90.38; 90;  

COD ID: 1501639
CIF file Formula: - C27 H21 Br -
Comments: Ulrich Darbost; Janie Cabana; Eric Demers; Thierry Maris; James D. Wuest Molecular Tectonics. Use of Br...aryl Supramolecular Interactions for the construction of Organized Networks from 9,9'-spirobifluorene in the Crystalline State. CheM 1 (2011) 52-12369
Space group: P 1 21/n 1
Cell volume: 2059.18
Cell parameters: 10.4523; 17.8465; 11.039; 90; 90.004; 90;  

COD ID: 1501642
CIF file Formula: - C16 H24 Ag2 F10 O4 S4 -
Comments: Mohamed Osman Awaleh; Idriss Guirreh Farah; Elias Said Dirieh; Thierry Maris; Samatar Mohamed Bouh Synthesis, crystal structures and thermal analysis of two new coordination polymers. Comptes Rendus Chimie 14 (2011) 991-996
Space group: P 1 21/n 1
Cell volume: 2599.43
Cell parameters: 8.003; 20.5242; 15.8557; 90; 93.532; 90;  

COD ID: 1501645
CIF file Formula: - C17 H28 Cl Co N5 O7 P -
Comments: Lakadamyali, Fezile; Kato, Masaru; Reisner, Erwin Colloidal metal oxide particles loaded with synthetic catalysts for solar H2 production Faraday Discussions 155 (2012) 191
Space group: P 1 21/n 1
Cell volume: 2276.8
Cell parameters: 8.2787; 12.8802; 21.4315; 90; 94.937; 90;  

COD ID: 1501649
CIF file Formula: - C44 H72 Eu K N12 O12 Ru2 -
Comments: Chow, Cheuk-Fai; Kong, Hoi-Kuan; Leung, Shu-Wai; Chiu, Brenda K. W.; Koo, Chi-Kin; Lei, Elva N. Y.; Lam, Michael H. W.; Wong, Wing-Tak; Wong, Wai-Yeung Heterobimetallic Ru(II)-Eu(III) complex as chemodosimeter for selective biogenic amine odorants detection in fish sample. Analytical chemistry 83(1) (2011) 289-296
Space group: P 1 21/n 1
Cell volume: 5890
Cell parameters: 10.516; 13.136; 42.764; 90; 94.45; 90;  

COD ID: 1501650
CIF file Formula: - C23 H13 N3 O4 -
Comments: Vaiyapuri, Rajendran; Greenland, Barnaby W.; Elliott, Joanne M.; Hayes, Wayne; Bennett, Roger A.; Cardin, Christine J.; Colquhoun, Howard M.; Etman, Haitham; Murray, Claire A. Pyrene-modified quartz crystal microbalance for the detection of polynitroaromatic compounds. Analytical chemistry 83(16) (2011) 6208-6214
Space group: P 1 21/n 1
Cell volume: 1789.23
Cell parameters: 10.8636; 14.0746; 12.4274; 90; 109.674; 90;  

COD ID: 1501662
CIF file Formula: - C18 H18 N4 O4 S -
Comments: Hall, Matthew D.; Brimacombe, Kyle R.; Varonka, Matthew S.; Pluchino, Kristen M.; Monda, Julie K.; Li, Jiayang; Walsh, Martin J.; Boxer, Matthew B.; Warren, Timothy H.; Fales, Henry M.; Gottesman, Michael M. Synthesis and structure-activity evaluation of isatin-β-thiosemicarbazones with improved selective activity toward multidrug-resistant cells expressing P-glycoprotein. Journal of medicinal chemistry 54(16) (2011) 5878-5889
Space group: P 1 21/n 1
Cell volume: 3498.5
Cell parameters: 13.6739; 17.3161; 14.9225; 90; 98.051; 90;  

COD ID: 1501669
CIF file Formula: - C97 H69 Cl5 N4 O4 Sn -
Comments: Yokoyama, Atsutoshi; Kojima, Takahiko; Ohkubo, Kei; Shiro, Motoo; Fukuzumi, Shunichi Formation of a hybrid compound composed of a saddle-distorted Tin(IV)-porphyrin and a Keggin-type heteropolyoxometalate to undergo intramolecular photoinduced electron transfer. The journal of physical chemistry. A 115(6) (2011) 986-997
Space group: P 1 21/n 1
Cell volume: 15786
Cell parameters: 25.106; 16.854; 37.347; 90; 92.653; 90;  

COD ID: 1501672
CIF file Formula: - C22 H32 N4 O15 S6 -
Comments: Shi, Zheng; Lu, Zhe-Jun; Zhu, Qin-Yu; Huo, Li-Bin; Han, Qiong-Hua; Bian, Guo-Qing; Dai, Jie Diamino-diamido tetrathiafulvalene for the sensing of anions and cations: a view in electrochemistry and structure. The journal of physical chemistry. B 115(12) (2011) 3020-3026
Space group: P 1 21/n 1
Cell volume: 3410
Cell parameters: 8.261; 43.783; 9.625; 90; 101.617; 90;  

COD ID: 1501675
CIF file Formula: - C5 H12 F4 N2 -
Comments: Enomoto, Takeshi; Nakamori, Yoji; Matsumoto, Kazuhiko; Hagiwara, Rika Ion−Ion Interactions and Conduction Mechanism of Highly Conductive Fluorohydrogenate Ionic Liquids The Journal of Physical Chemistry C 115(10) (2011) 4324
Space group: P 1 21/n 1
Cell volume: 863.17
Cell parameters: 5.598; 10.6076; 14.5523; 90; 92.713; 90;  

COD ID: 1501677
CIF file Formula: - C57 H86 Cl2 N2 O8 P2 S2 -
Comments: de Namor, Angela F Danil; Aparicio-Aragon, Walther; Nwogu, Nwanyinnaya; El Gamouz, Abdelaziz; Piro, Oscar E.; Castellano, Eduardo E. Calixarene and resorcarene based receptors: from structural and thermodynamic studies to the synthesis of a new mercury(II) selective material. The journal of physical chemistry. B 115(21) (2011) 6922-6934
Space group: P 1 21/n 1
Cell volume: 5866.2
Cell parameters: 12.773; 19.556; 23.982; 90; 101.691; 90;  

COD ID: 1501699
CIF file Formula: - C36 H42 N O4 Sb -
Comments: Fukin, Georgy K.; Baranov, Evgenii V.; Jelsch, Christian; Guillot, Benoît; Poddel'sky, Andrey I.; Cherkasov, Vladimir K.; Abakumov, Gleb A. Experimental and theoretical investigation of topological and energetic characteristics of Sb complexes reversibly binding molecular oxygen. The journal of physical chemistry. A 115(29) (2011) 8271-8281
Space group: P 1 21/n 1
Cell volume: 3235.8
Cell parameters: 13.5746; 15.9506; 15.0855; 90; 97.841; 90;  

COD ID: 1501701
CIF file Formula: - C46 H58 N8 O6 Si7 -
Comments: Yang, Yang; Samas, Brian; Kennedy, Vance O.; Macikenas, Dainius; Chaloux, Brian L.; Miller, Jacob A.; Speer, Jr, Richard L; Protasiewicz, John; Pinkerton, A. Alan; Kenney, Malcolm E. Long, directional interactions in cofacial silicon phthalocyanine oligomers. The journal of physical chemistry. A 115(45) (2011) 12474-12485
Space group: P 1 21/n 1
Cell volume: 2630.5
Cell parameters: 9.3149; 26.6012; 11.3777; 90; 111.083; 90;  

COD ID: 1501702
CIF file Formula: - C78 H74 N16 O7 Si8 -
Comments: Yang, Yang; Samas, Brian; Kennedy, Vance O.; Macikenas, Dainius; Chaloux, Brian L.; Miller, Jacob A.; Speer, Jr, Richard L; Protasiewicz, John; Pinkerton, A. Alan; Kenney, Malcolm E. Long, directional interactions in cofacial silicon phthalocyanine oligomers. The journal of physical chemistry. A 115(45) (2011) 12474-12485
Space group: P 1 21/n 1
Cell volume: 8018.4
Cell parameters: 13.1488; 22.8889; 27.0083; 90; 99.438; 90;  

COD ID: 1501704
CIF file Formula: - C149 H114 N32 O9 Si10 -
Comments: Yang, Yang; Samas, Brian; Kennedy, Vance O.; Macikenas, Dainius; Chaloux, Brian L.; Miller, Jacob A.; Speer, Jr, Richard L; Protasiewicz, John; Pinkerton, A. Alan; Kenney, Malcolm E. Long, directional interactions in cofacial silicon phthalocyanine oligomers. The journal of physical chemistry. A 115(45) (2011) 12474-12485
Space group: P 1 21/n 1
Cell volume: 13131.1
Cell parameters: 13.6979; 26.0454; 36.932; 90; 94.737; 90;  

COD ID: 1501710
CIF file Formula: - C11 H11 F6 N3 O4 S2 -
Comments: Lethesh, Kallidanthiyil Chellappan; Van Hecke, Kristof; Van Meervelt, Luc; Nockemann, Peter; Kirchner, Barbara; Zahn, Stefan; Parac-Vogt, Tatjana N; Dehaen, Wim; Binnemans, Koen Nitrile-functionalized pyridinium, pyrrolidinium, and piperidinium ionic liquids. The journal of physical chemistry. B 115(26) (2011) 8424-8438
Space group: P 1 21/n 1
Cell volume: 1703
Cell parameters: 11.2891; 12.2491; 12.4087; 90; 97.027; 90;  

COD ID: 1501713
CIF file Formula: - C12 H13 F6 N3 O4 S2 -
Comments: Lethesh, Kallidanthiyil Chellappan; Van Hecke, Kristof; Van Meervelt, Luc; Nockemann, Peter; Kirchner, Barbara; Zahn, Stefan; Parac-Vogt, Tatjana N; Dehaen, Wim; Binnemans, Koen Nitrile-functionalized pyridinium, pyrrolidinium, and piperidinium ionic liquids. The journal of physical chemistry. B 115(26) (2011) 8424-8438
Space group: P 1 21/n 1
Cell volume: 1756.17
Cell parameters: 11.5159; 12.2778; 12.5068; 90; 96.726; 90;  

COD ID: 1501714
CIF file Formula: - C10 H9 F6 N3 O4 S2 -
Comments: Lethesh, Kallidanthiyil Chellappan; Van Hecke, Kristof; Van Meervelt, Luc; Nockemann, Peter; Kirchner, Barbara; Zahn, Stefan; Parac-Vogt, Tatjana N; Dehaen, Wim; Binnemans, Koen Nitrile-functionalized pyridinium, pyrrolidinium, and piperidinium ionic liquids. The journal of physical chemistry. B 115(26) (2011) 8424-8438
Space group: P 1 21/n 1
Cell volume: 1548.3
Cell parameters: 12.687; 8.186; 15.537; 90; 106.36; 90;  

COD ID: 1501718
CIF file Formula: - C22 H30 N4 O2 -
Comments: Chen, Xiaotong; Wei, Ruirui; Xiang, Yu; Zhou, Zhaojuan; Li, Kai; Song, Panshu; Tong, Aijun Organic Crystalline Solids Response to Piezo/thermo Stimulus: Donor‒Acceptor (D‒A) Attached Salicylaldehyde Azine Derivatives The Journal of Physical Chemistry C 115(29) (2011) 14353
Space group: P 1 21/n 1
Cell volume: 1052.2
Cell parameters: 12.055; 6.5584; 13.381; 90; 95.95; 90;  

COD ID: 1501719
CIF file Formula: - C42 H23 B F24 N2 -
Comments: Kong, S.; Borissova, A. O.; Lesnichin, S. B.; Hartl, M.; Daemen, L. L.; Eckert, J.; Antipin, M. Yu; Shenderovich, I. G. Geometry and spectral properties of the protonated homodimer of pyridine in the liquid and solid states. A combined NMR, X-ray diffraction and inelastic neutron scattering study. The journal of physical chemistry. A 115(27) (2011) 8041-8048
Space group: P 1 21/n 1
Cell volume: 4347.8
Cell parameters: 13.1238; 18.615; 18.123; 90; 100.884; 90;  

COD ID: 1501728
CIF file Formula: - C20 H32 Cl N O -
Comments: Naumov, Panče; Topcu, Yildiray; Eckert-Maksić, Mirjana; Glasovac, Zoran; Pavošević, Fabijan; Kochunnoonny, Manoj; Hara, Hideyuki Photoinduced rearrangement of aromatic N-chloroamides to chloroaromatic amides in the solid state: inverted Π(N)-Σ(N) occupational stability of amidyl radicals. The journal of physical chemistry. A 115(26) (2011) 7834-7848
Space group: P 1 21/n 1
Cell volume: 2019.1
Cell parameters: 6.1089; 9.7134; 34.042; 90; 91.716; 90;  

COD ID: 1501731
CIF file Formula: - C22 H12 O2 S -
Comments: Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A 115(30) (2011) 8563-8570
Space group: P 1 21/n 1
Cell volume: 1577.6
Cell parameters: 9.3541; 7.8376; 21.571; 90; 93.994; 90;  

COD ID: 1501732
CIF file Formula: - C22 H12 O2 S -
Comments: Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A 115(30) (2011) 8563-8570
Space group: P 1 21/n 1
Cell volume: 1623.77
Cell parameters: 9.4963; 8.0181; 21.3804; 90; 94.107; 90;  

COD ID: 1501733
CIF file Formula: - C22 H12 O2 S -
Comments: Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A 115(30) (2011) 8563-8570
Space group: P 1 21/n 1
Cell volume: 1623.77
Cell parameters: 9.4963; 8.0181; 21.3804; 90; 94.107; 90;  

COD ID: 1501734
CIF file Formula: - C22 H12 O2 S -
Comments: Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A 115(30) (2011) 8563-8570
Space group: P 1 21/n 1
Cell volume: 1653.24
Cell parameters: 9.5862; 8.1401; 21.2445; 90; 94.236; 90;  

COD ID: 1501735
CIF file Formula: - C22 H12 O2 S -
Comments: Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A 115(30) (2011) 8563-8570
Space group: P 1 21/n 1
Cell volume: 1670.7
Cell parameters: 9.6404; 8.2037; 21.187; 90; 94.384; 90;  

COD ID: 1501736
CIF file Formula: - C22 H12 O2 S -
Comments: Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A 115(30) (2011) 8563-8570
Space group: P 1 21/n 1
Cell volume: 1673.1
Cell parameters: 9.6444; 8.216; 21.172; 90; 94.206; 90;  

COD ID: 1501737
CIF file Formula: - C22 H12 O2 S -
Comments: Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A 115(30) (2011) 8563-8570
Space group: P 1 21/n 1
Cell volume: 1679.3
Cell parameters: 9.656; 8.247; 21.156; 90; 94.6; 90;  

COD ID: 1501738
CIF file Formula: - C28 H16 O2 -
Comments: Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A 115(30) (2011) 8563-8570
Space group: P 1 21/n 1
Cell volume: 920.2
Cell parameters: 10.1199; 8.2949; 11.6257; 90; 109.455; 90;  

COD ID: 1501739
CIF file Formula: - C28 H16 O2 -
Comments: Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A 115(30) (2011) 8563-8570
Space group: P 1 21/n 1
Cell volume: 943.03
Cell parameters: 10.1822; 8.4359; 11.6494; 90; 109.537; 90;  

COD ID: 1501740
CIF file Formula: - C28 H16 O2 -
Comments: Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A 115(30) (2011) 8563-8570
Space group: P 1 21/n 1
Cell volume: 962.67
Cell parameters: 10.2391; 8.5602; 11.6621; 90; 109.646; 90;  

COD ID: 1501741
CIF file Formula: - C28 H16 O2 -
Comments: Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A 115(30) (2011) 8563-8570
Space group: P 1 21/n 1
Cell volume: 973.31
Cell parameters: 10.2759; 8.6249; 11.6667; 90; 109.729; 90;  

COD ID: 1501742
CIF file Formula: - C28 H16 O2 -
Comments: Naumov, Panče; Ishizawa, Nobuo; Wang, Jun; Pejov, Ljupčo; Pumera, Martin; Lee, Sang Cheol On the origin of the solid-state thermochromism and thermal fatigue of polycyclic overcrowded enes. The journal of physical chemistry. A 115(30) (2011) 8563-8570
Space group: P 1 21/n 1
Cell volume: 974.35
Cell parameters: 10.2832; 8.6313; 11.6644; 90; 109.758; 90;  

COD ID: 1501754
CIF file Formula: - C12 H13 N3 -
Comments: Galievsky, Victor A.; Druzhinin, Sergey I.; Demeter, Attila; Kovalenko, Sergey A.; Senyushkina, Tamara; Mayer, Peter; Zachariasse, Klaas A. Presence and absence of excited state intramolecular charge transfer with the six isomers of dicyano-N,N-dimethylaniline and dicyano-(N-methyl-N-isopropyl)aniline. The journal of physical chemistry. A 115(40) (2011) 10823-10845
Space group: P 1 21/n 1
Cell volume: 1097.25
Cell parameters: 8.9832; 12.6212; 9.6863; 90; 92.414; 90;  

COD ID: 1501761
CIF file Formula: - C18 H14 N4 O4 -
Comments: Lee, Jong Hoon; Naumov, Pance; Chung, Ihn Hee; Lee, Sang Cheol Solid-state thermochromism and phase transitions of charge transfer 1,3-diamino-4,6-dinitrobenzene dyes. The journal of physical chemistry. A 115(35) (2011) 10087-10096
Space group: P 1 21/n 1
Cell volume: 1715.82
Cell parameters: 9.2057; 9.0165; 21.1691; 90; 102.445; 90;  

COD ID: 1501767
CIF file Formula: - C10 H12 Cl2 N4 O6 -
Comments: Lee, Jong Hoon; Naumov, Pance; Chung, Ihn Hee; Lee, Sang Cheol Solid-state thermochromism and phase transitions of charge transfer 1,3-diamino-4,6-dinitrobenzene dyes. The journal of physical chemistry. A 115(35) (2011) 10087-10096
Space group: P 1 21/n 1
Cell volume: 1477.89
Cell parameters: 10.3054; 4.4342; 32.6413; 90; 97.77; 90;  

COD ID: 1501783
CIF file Formula: - C20 H32 N5 Ti -
Comments: Annunziata, Liana; Pragliola, Stefania; Pappalardo, Daniela; Tedesco, Consiglia; Pellecchia, Claudio New (Anilidomethyl)pyridine Titanium(IV) and Zirconium(IV) Catalyst Precursors for the Highly Chemo- and Stereoselectivecis-1,4-Polymerization of 1,3-Butadiene Macromolecules 44(7) (2011) 1934
Space group: P 1 21/n 1
Cell volume: 2151.2
Cell parameters: 13.614; 10.374; 15.394; 90; 98.326; 90;  

COD ID: 1501817
CIF file Formula: - C16 H13 N3 O3 -
Comments: Li, Chun-Shun; An, Chun-Yan; Li, Xiao-Ming; Gao, Shu-Shan; Cui, Chuan-Ming; Sun, Hao-Fen; Wang, Bin-Gui Triazole and dihydroimidazole alkaloids from the marine sediment-derived fungus Penicillium paneum SD-44. Journal of natural products 74(5) (2011) 1331-1334
Space group: P 1 21/n 1
Cell volume: 2867.5
Cell parameters: 15.595; 11.656; 17.393; 90; 114.91; 90;  

COD ID: 1501841
CIF file Formula: - C18 H18 Br2 O4 -
Comments: Barrett, Tim N.; Braddock, D. Christopher; Monta, Anna; Webb, Michael R.; White, Andrew J. P. Total synthesis of the marine metabolite (±)-polysiphenol via highly regioselective intramolecular oxidative coupling. Journal of natural products 74(9) (2011) 1980-1984
Space group: P 1 21/n 1
Cell volume: 869.68
Cell parameters: 4.39738; 13.7231; 14.4505; 90; 94.203; 90;  

COD ID: 1501849
CIF file Formula: - C44 H42 N4 -
Comments: Sarma, Tridib; Panda, Pradeepta K.; Anusha, P. T.; Rao, S. Venugopal Dinaphthoporphycenes: synthesis and nonlinear optical studies. Organic letters 13(2) (2011) 188-191
Space group: P 1 21/n 1
Cell volume: 1627
Cell parameters: 15.429; 6.4378; 16.994; 90; 105.454; 90;  

COD ID: 1501863
CIF file Formula: - C24 H10 B F15 -
Comments: Chen, Chao; Voss, Tanja; Fröhlich, Roland; Kehr, Gerald; Erker, Gerhard 1,1-carboboration of 1-alkynes: a conceptual alternative to the hydroboration reaction. Organic letters 13(1) (2011) 62-65
Space group: P 1 21/n 1
Cell volume: 2314.12
Cell parameters: 12.6904; 10.1992; 18.6406; 90; 106.434; 90;  

COD ID: 1501890
CIF file Formula: - C21 H20 N4 O5 -
Comments: Yao, Zhong-Ke; Li, Jianjun; Yu, Zhi-Xiang Rh-catalyzed [7 + 1] cycloaddition of buta-1,3-dienylcyclopropanes and CO for the synthesis of cyclooctadienones. Organic letters 13(1) (2011) 134-137
Space group: P 1 21/n 1
Cell volume: 1932.1
Cell parameters: 11.864; 8.768; 18.696; 90; 96.548; 90;  

COD ID: 1501898
CIF file Formula: - C18 H19 Cl N2 O -
Comments: Lefranc, Julien; Tetlow, Daniel J.; Donnard, Morgan; Minassi, Alberto; Gálvez, Erik; Clayden, Jonathan Geometry-selective synthesis of E or Z N-vinyl ureas (N-carbamoyl enamines). Organic letters 13(2) (2011) 296-299
Space group: P 1 21/n 1
Cell volume: 1618.2
Cell parameters: 7.9594; 11.7961; 17.4102; 90; 98.137; 90;  

COD ID: 1501899
CIF file Formula: - C18 H19 F N2 O -
Comments: Lefranc, Julien; Tetlow, Daniel J.; Donnard, Morgan; Minassi, Alberto; Gálvez, Erik; Clayden, Jonathan Geometry-selective synthesis of E or Z N-vinyl ureas (N-carbamoyl enamines). Organic letters 13(2) (2011) 296-299
Space group: P 1 21/n 1
Cell volume: 1542.5
Cell parameters: 9.0491; 18.07; 9.4597; 90; 94.301; 90;  

COD ID: 1501905
CIF file Formula: - C26 H25 N3 O6 S -
Comments: Chen, Zhiyuan; Zheng, Danqing; Wu, Jie A facile route to polysubstituted indoles via three-component reaction of 2-ethynylaniline, sulfonyl azide, and nitroolefin. Organic letters 13(5) (2011) 848-851
Space group: P 1 21/n 1
Cell volume: 2484
Cell parameters: 9.146; 10.974; 24.749; 90; 90.258; 90;  

COD ID: 1501918
CIF file Formula: - C44 H60 N4 O4 -
Comments: Tsue, Hirohito; Ono, Kohei; Tokita, Satoshi; Ishibashi, Koichi; Matsui, Kazuhiro; Takahashi, Hiroki; Miyata, Kazuyuki; Takahashi, Daisuke; Tamura, Rui Spontaneous and selective CO2 sorption under ambient conditions in seemingly nonporous molecular crystal of azacalix[5]arene pentamethyl ether. Organic letters 13(3) (2011) 490-493
Space group: P 1 21/n 1
Cell volume: 4288.4
Cell parameters: 12.7494; 16.1119; 21.2918; 90; 101.332; 90;  

COD ID: 1501921
CIF file Formula: - C23 H29 Cl Cu N3 -
Comments: Nakamura, Tatsuhito; Terashima, Takahiro; Ogata, Kenichi; Fukuzawa, Shin-ichi Copper(I) 1,2,3-triazol-5-ylidene complexes as efficient catalysts for click reactions of azides with alkynes. Organic letters 13(4) (2011) 620-623
Space group: P 1 21/n 1
Cell volume: 2315.87
Cell parameters: 10.3024; 16.7569; 13.4574; 90; 94.5651; 90;  

COD ID: 1501924
CIF file Formula: - C10 H10 O4 -
Comments: Šebej, Peter; Lim, Bum Hee; Park, Bong Ser; Givens, Richard S.; Klán, Petr The power of solvent in altering the course of photorearrangements. Organic letters 13(4) (2011) 644-647
Space group: P 1 21/n 1
Cell volume: 878.5
Cell parameters: 6.764; 4.4614; 29.113; 90; 90.547; 90;  

COD ID: 1501925
CIF file Formula: - C14 H12 O2 -
Comments: Michaelides, Iacovos N.; Darses, Benjamin; Dixon, Darren J. Acid-catalyzed synthesis of bicyclo[3.n.1]alkenediones. Organic letters 13(4) (2011) 664-667
Space group: P 1 21/n 1
Cell volume: 1051.39
Cell parameters: 9.3644; 11.7016; 9.7246; 90; 99.3685; 90;  

COD ID: 1501927
CIF file Formula: - C33 H25 N O8 -
Comments: Zhao, Wanxiang; Zhang, Junliang Rhodium-catalyzed tandem heterocyclization and carbonylative [(3+2)+1] cyclization of diyne-enones. Organic letters 13(4) (2011) 688-691
Space group: P 1 21/n 1
Cell volume: 2755.9
Cell parameters: 11.4787; 9.9688; 24.0837; 90; 90.213; 90;  

COD ID: 1501931
CIF file Formula: - C11 H9 Cl N2 O2 -
Comments: Zhou, Quan; Snider, Barry B. Synthesis of phantasmidine. Organic letters 13(3) (2011) 526-529
Space group: P 1 21/n 1
Cell volume: 1031.25
Cell parameters: 5.6626; 9.637; 18.9453; 90; 94.067; 90;  

COD ID: 1501939
CIF file Formula: - C12 H17 N O2 -
Comments: Chen, Zhi-Hua; Tu, Yong-Qiang; Zhang, Shu-Yu; Zhang, Fu-Min Development of the intramolecular Prins cyclization/Schmidt reaction for the construction of the azaspiro[4,4]nonane: application to the formal synthesis of (±)-stemonamine. Organic letters 13(4) (2011) 724-727
Space group: P 1 21/n 1
Cell volume: 1111.7
Cell parameters: 6.2; 11.695; 15.337; 90; 91.527; 90;  

COD ID: 1501945
CIF file Formula: - C32 H32 N O3 P -
Comments: Yin, Guangwei; Zhu, Yuanxun; Zhang, Li; Lu, Ping; Wang, Yanguang Preparation of allenephosphoramide and its utility in the preparation of 4,9-dihydro-2h-benzo[f]isoindoles. Organic letters 13(5) (2011) 940-943
Space group: P 1 21/n 1
Cell volume: 2691.7
Cell parameters: 8.0069; 15.2932; 22.1829; 90; 97.728; 90;  

COD ID: 1501975
CIF file Formula: - C28 H26 N2 O7 S -
Comments: Kislukhin, Alexander A.; Higginson, Cody J.; Finn, M. G. Aqueous-phase deactivation and intramolecular [2 + 2 + 2] cycloaddition of oxanorbornadiene esters. Organic letters 13(7) (2011) 1832-1835
Space group: P 1 21/n 1
Cell volume: 2494.59
Cell parameters: 15.8048; 8.9561; 18.1279; 90; 103.548; 90;  

COD ID: 1502006
CIF file Formula: - C14 H17 N5 O3 S -
Comments: Bhandari, Manojkumar R.; Yousufuddin, Muhammed; Lovely, Carl J. Diversity-oriented approach to pyrrole-imidazole alkaloid frameworks. Organic letters 13(6) (2011) 1382-1385
Space group: P 1 21/n 1
Cell volume: 1491.8
Cell parameters: 14.707; 5.2984; 19.177; 90; 93.359; 90;  

COD ID: 1502012
CIF file Formula: - C30 H26 -
Comments: Navale, Tushar S.; Thakur, Khushabu; Rathore, Rajendra Sequential oxidative transformation of tetraarylethylenes to 9,10-diarylphenanthrenes and dibenzo[g,p]chrysenes using DDQ as an oxidant. Organic letters 13(7) (2011) 1634-1637
Space group: P 1 21/n 1
Cell volume: 2165.4
Cell parameters: 10.9572; 10.3404; 19.78; 90; 104.931; 90;  

COD ID: 1502019
CIF file Formula: - C25 H36 N2 O9 S -
Comments: Witek, Jason A.; Weinreb, Steven M. Investigation of the stereochemistry of intermolecular conjugate additions of nucleophiles to acyclic nitrosoalkenes. Organic letters 13(5) (2011) 1258-1260
Space group: P 1 21/n 1
Cell volume: 2787.3
Cell parameters: 10.4925; 15.2878; 17.4611; 90; 95.649; 90;  

COD ID: 1502035
CIF file Formula: - C17 H15 N O2 -
Comments: Mulzer, Michael; Coates, Geoffrey W. A catalytic route to ampakines and their derivatives. Organic letters 13(6) (2011) 1426-1428
Space group: P 1 21/n 1
Cell volume: 1302.28
Cell parameters: 8.4225; 13.77; 11.5762; 90; 104.075; 90;  


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