Crystallography Open Database

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

COD ID: 1000003
CIF file Formula: - C3 O6 Sr -
Comments: G. Vanhoyland; M.K. Van Bael; J. Mullens; L.C. Van Poucke Structure determination of anhydrous acid strontium oxalate by conventional X-ray powder diffraction Powder Diffraction 16(4) (2001) 224-226
Space group: P 1 21/c 1
Cell volume: 524.8
Cell parameters: 7.9661; 9.205; 7.3198; 90; 102.104; 90;  

COD ID: 1000083
CIF file Formula: - H5 O7 P V -
Comments: Le Bail, A.; Ferey, G.; Amoros, P.; Beltran-Portier, D. Structure of vanadyl hydrogenphosphate dihydrate α-VO(HPO~4~) 2H~2~O solved from X-ray and neutron powder diffraction European Journal of Solid State and Inorganic Chemistry 26 (1989) 419-426
Space group: P 1 21/c 1
Cell volume: 534
Cell parameters: 7.613; 7.431; 9.482; 90; 95.44; 90;  

COD ID: 1000084
CIF file Formula: - H5 O7 P V -
Comments: Le Bail, A.; Ferey, G.; Amoros, P.; Beltran-Portier, D. Structure of vanadyl hydrogenphosphate dihydrate α-VO(HPO~4~) 2H~2~O solved from X-ray and neutron powder diffraction European Journal of Solid State and Inorganic Chemistry 26 (1989) 419-426
Space group: P 1 21/c 1
Cell volume: 532.4
Cell parameters: 7.61; 7.42; 9.47; 90; 95.4; 90;  

COD ID: 1000088
CIF file Formula: - F6 Li2 Tb -
Comments: Laligant, Y; Le Bail, A; Ferey, G; Avignant, D; Cousseins, J C Determination of the crystal structure of Li~2~ Tb F~6~ from X-ray and neutron powder diffraction. An example of lithium in five-fold coordination. European Journal of Solid State Inorganic Chemistry 25 (1988) 551-563
Space group: P 1 21/c 1
Cell volume: 400.4
Cell parameters: 7.585; 4.965; 11.116; 90; 106.96; 90;  

COD ID: 1000089
CIF file Formula: - F6 Li2 Tb -
Comments: Laligant, Y; Le Bail, A; Ferey, G; Avignant, D; Cousseins, J C Determination of the crystal structure of Li~2~ Tb F~6~ from X-ray and neutron powder diffraction. An example of lithium in five-fold coordination. European Journal of Solid State Inorganic Chemistry 25 (1988) 551-563
Space group: P 1 21/c 1
Cell volume: 394.7
Cell parameters: 7.56; 4.934; 11.066; 90; 107.02; 90;  

COD ID: 1000128
CIF file Formula: - Cr2 H12 N4 O7 Pd -
Comments: Laligant, Y; Le Bail, A Structure of (Pd (N H3)4) Cr2 O7 Powder Diffraction 10(3) (1995) 159-164
Space group: P 1 21/c 1
Cell volume: 1027.6
Cell parameters: 7.771; 11.578; 11.852; 90; 105.5; 90;  

COD ID: 1000149
CIF file Formula: - Al Ca F6 Na -
Comments: Le Bail, A.; Hemon-Ribaud, A.; Courbion, G. Structure of α-NaCaAlF~6~ determined ab initio from conventional powder diffraction data European Journal of Solid State and Inorganic Chemistry 35(3) (1998) 265-272
Space group: P 1 21/c 1
Cell volume: 923.6
Cell parameters: 8.7423; 5.1927; 20.35139; 90; 91.499; 90;  

COD ID: 1000260
CIF file Formula: - Co F4 Li -
Comments: Lacorre, P; Pannetier, J; Averdunk, F; Hoppe, R; Ferey, G Crystal and Magnetic Structures of Li Co F~4~: The First Compound with a Dirutile Structure Journal of Solid State Chemistry 79 (1989) 1-11
Space group: P 1 21/c 1
Cell volume: 127.9
Cell parameters: 5.4354; 4.6527; 5.5392; 90; 114.117; 90;  

COD ID: 1000261
CIF file Formula: - Co F4 Li -
Comments: Lacorre, P; Pannetier, J; Averdunk, F; Hoppe, R; Ferey, G Crystal and Magnetic Structures of Li Co F~4~: The First Compound with a Dirutile Structure Journal of Solid State Chemistry 79 (1989) 1-11
Space group: P 1 21/c 1
Cell volume: 127.4
Cell parameters: 5.4296; 4.6462; 5.5371; 90; 114.244; 90;  

COD ID: 1000286
CIF file Formula: - O8 P2 Sr Zn2 -
Comments: Hemon, A; Courbion, G The crystal structure of $-alpha-SrZn~2~(PO~4~)~2~: a hurlbutite type Journal of Solid State Chemistry 85 (1990) 164-168
Space group: P 1 21/c 1
Cell volume: 714.3
Cell parameters: 8.3232; 9.5101; 9.0317; 90; 92.293; 90;  

COD ID: 1000289
CIF file Formula: - Cr F8 Na Sr2 -
Comments: Hemon, A; Courbion, G NaSr~2~CrF~8~: a new structure with two "independent F^-^" Journal of Solid State Chemistry 87 (1990) 344-349
Space group: P 1 21/c 1
Cell volume: 667.5
Cell parameters: 7.7388; 6.2756; 14.827; 90; 112.03; 90;  

COD ID: 1000305
CIF file Formula: - Cr F6 Na Sr -
Comments: Hemon, A.; Courbion, G. Synthesis and crystal structures of β-NaSrCrF~6~ and NaSrFeF~6~. Structural correlations with A~2~MF~6~ compounds European Journal of Solid State and Inorganic Chemistry 29 (1992) 519-531
Space group: P 1 21/c 1
Cell volume: 495.2
Cell parameters: 5.5676; 9.2937; 9.5858; 90; 93.201; 90;  

COD ID: 1000364
CIF file Formula: - Cu F4 H9 Nb O6 -
Comments: Crosnier-Lopez, M P; Duroy, H; Fourquet, J L About the crystal structure of CuNb(OH, F)~7~.3H~2~O Journal of Solid State Chemistry 108 (1994) 398-401
Space group: P 1 21/c 1
Cell volume: 409.4
Cell parameters: 5.59; 9.978; 7.544; 90; 103.36; 90;  

COD ID: 1000371
CIF file Formula: - H45 Mo7 N15 O24 Pd3 -
Comments: Laligant, Y Crystal structure of the heptamolybdate(VI) (paramolybdate) (N H3)3 (Pd (N H3)4)3 Mo7 O24 European Journal of Solid State Inorganic Chemistry 31 (1994) 211-222
Space group: P 1 21/c 1
Cell volume: 3550.9
Cell parameters: 10.658; 20.62799; 17.55099; 90; 113.038; 90;  

COD ID: 1000431
CIF file Formula: - Fe2 O13 V4 -
Comments: Permer, L; Laligant, Y Crystal structure of the tetrapolyvanadate Fe2 V4 O13 European Journal of Solid State Inorganic Chemistry 34 (1997) 41-52
Space group: P 1 21/c 1
Cell volume: 1113.8
Cell parameters: 8.3125; 9.4055; 14.5768; 90; 102.231; 90;  

COD ID: 1000498
CIF file Formula: - Ba F7 Fe Mn -
Comments: Lacorre, P; Pannetier, J; Pebler, J; Nagel, J; Babel, D; de Kozak, A; Samouel, M; Ferey, G Ordered magnetic frustration: XVII. Is Ba Mn Fe F7 frustrated? Mossbauer spectrocopy, magnetic susceptibility, and magnetic structure at 2 K Journal of Solid State Chemistry 101 (1992) 296-308
Space group: P 1 21/c 1
Cell volume: 550
Cell parameters: 5.5075; 10.9584; 9.1427; 90; 94.568; 90;  

COD ID: 1000502
CIF file Formula: - B2 Gd2 Na2 O7 -
Comments: Corbel, G; Leblanc, M; Antic-Fidancev, E; Lemaitre-Blaise, M Crystal structure of sodium rare earth oxyborates Na2 Ln2 (B O3)2 O(Ln = Sm, Eu, and Gd) and optical analysis of Na2 Gd2 (B O3)2 O:Eu(3+) Journal of Solid State Chemistry 144 (1999) 35-44
Space group: P 1 21/c 1
Cell volume: 617.5
Cell parameters: 10.695; 6.32; 10.328; 90; 117.8; 90;  

COD ID: 1000504
CIF file Formula: - F2 Gd2 Mg Na2 O12 Si4 -
Comments: Maisonneuve, V; Leblanc, M The crystal structure of Na2 Mg Gd2 (Si4 O12) F2 and its relationship with leucophanite Canadian Mineralogist 36 (1998) 1039-1043
Space group: P 1 21/c 1
Cell volume: 559.2
Cell parameters: 5.178; 7.51; 14.381; 90; 90.22; 90;  

COD ID: 1001018
CIF file Formula: - Ca Cl2 H8 O4 -
Comments: Leclaire, A.; Borel, M. M. La forme β du dichlorure de calcium tétrahydraté Acta Crystallographica, Section B: Structural Crystallography and Crystal Chemistry 34(3) (1978) 900-902
Space group: P 1 21/c 1
Cell volume: 1059.7
Cell parameters: 8.923; 10.221; 12.787; 90; 114.68; 90;  

COD ID: 1001053
CIF file Formula: - Cr O6 Ta2 -
Comments: Massard, P; Bernier, J C; Michel, A Effet Jahn-Teller dans le Systeme Ta~2~ Cr O~6~ - Ta Cr O~4~ Journal of Solid State Chemistry 4 (1972) 269-274
Space group: P 1 21/c 1
Cell volume: 209.5
Cell parameters: 4.74; 4.75; 9.305; 90; 90.95; 90;  

COD ID: 1001110
CIF file Formula: - Ca Cl2 H8 O4 -
Comments: Leclaire, A.; Borel, M. M.; Monier, J. C. La Forme γ du Dichlorure de Calcium Tetrahydrate Acta Crystallographica B (24,1968-38,1982) 36(11) (1980) 2757-2759
Space group: P 1 21/c 1
Cell volume: 391.1
Cell parameters: 6.1387; 7.6669; 8.9014; 90; 111; 90;  

COD ID: 1001161
CIF file Formula: - As Cd2 Cl2 -
Comments: Rebbah, A; Yazbeck, J; Leclaire, A; Deschanvres, A Structure du Dichlorure d'Arsenic et de Dicadmium Acta Crystallographica B (24,1968-38,1982) 36 (1980) 771-773
Space group: P 1 21/c 1
Cell volume: 512.6
Cell parameters: 7.858; 9.193; 8.189; 90; 119.95; 90;  

COD ID: 1001170
CIF file Formula: - Cd4 Cl10 H20 Ni O10 -
Comments: Leclaire, A; Borel, M M Structure du Decachlorure de Tetracadmium et de Nickel Monohydrate Acta Crystallographica B (24,1968-38,1982) 36 (1980) 3090-3093
Space group: P 1 21/c 1
Cell volume: 1213.5
Cell parameters: 6.634; 12.008; 16.08; 90; 108.68; 90;  

COD ID: 1001269
CIF file Formula: - Ba2 Nb4 O18 Ti3 -
Comments: Gasperin, M Syntheses and Structure of a New Titanoniobate: The Trititanotetraniobate of Dibarium, Ba~2~ Ti~3~ Nb~4~ O~18~ Acta Crystallographica C (39,1983-) 40 (1984) 9-11
Space group: P 1 21/c 1
Cell volume: 678.8
Cell parameters: 10; 9.959; 7.315; 90; 111.29; 90;  

COD ID: 1001326
CIF file Formula: - H2 N2 S22 -
Comments: Garcia-Fernandez, H; Gasperin, M; Freymann, R Etude chimique structurale et spectrographique du complexe par transfert de charge 2S~8~-S~6~(N H)~2~ Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-) 295 (1982) 1109-1112
Space group: P 1 21/c 1
Cell volume: 1240.4
Cell parameters: 10.883; 10.73; 10.674; 90; 95.67; 90;  

COD ID: 1001338
CIF file Formula: - Cs Nb O6 U -
Comments: Gasperin, M Synthese et structure du niobouranate de cesium:CsNbUo~6~ Acta Crystallographica C (39,1983-) 43 (1987) 404-406
Space group: P 1 21/c 1
Cell volume: 665.8
Cell parameters: 7.43; 8.7; 10.668; 90; 105.08; 90;  

COD ID: 1001369
CIF file Formula: - Mo Na O7 P2 -
Comments: Leclaire, A; Borel, M M; Grandin, A; Raveau, B A Mo(III) Phosphate with a Cage Structure: Na Mo P~2~ O~7~ Journal of Solid State Chemistry 76 (1988) 131-135
Space group: P 1 21/c 1
Cell volume: 544.9
Cell parameters: 7.4195; 8.1084; 9.7598; 90; 111.868; 90;  

COD ID: 1001384
CIF file Formula: - Na O7 P2 Ti -
Comments: Leclaire, A; Benmoussa, A; Borel, M M; Grandin, A; Raveau, B Two forms of sodium titanium(III) diphosphate: $-alpha-Na Ti P~2~ O~7~ closely related to $-beta-Cristobalite and $-beta-Na Ti P~2~ O~7~ isotypic with Na Fe P~2~ O~7~ Journal of Solid State Chemistry 77 (1988) 299-305
Space group: P 1 21/c 1
Cell volume: 541.9
Cell parameters: 8.697; 5.239; 13.293; 90; 116.54; 90;  

COD ID: 1001385
CIF file Formula: - Na O7 P2 Ti -
Comments: Leclaire, A; Benmoussa, A; Borel, M M; Grandin, A; Raveau, B Two forms of sodium titanium(III) diphosphate: $-alpha-Na Ti P~2~ O~7~ closely related to $-beta-Cristobalite and $-beta-Na Ti P~2~ O~7~ isotypic with Na Fe P~2~ O~7~ Journal of Solid State Chemistry 77 (1988) 299-305
Space group: P 1 21/c 1
Cell volume: 529.7
Cell parameters: 7.394; 7.936; 9.726; 90; 111.85; 90;  

COD ID: 1001388
CIF file Formula: - Fe K O7 P2 -
Comments: Riou, D; Labbe, Ph; Goreaud, M The diphosphate K Fe P~2~ O~7~: Structure and possibilities for insertion in the host framework European Journal of Solid State Inorganic Chemistry 25 (1988) 215-229
Space group: P 1 21/c 1
Cell volume: 576.4
Cell parameters: 7.3523; 9.9875; 8.1872; 90; 106.498; 90;  

COD ID: 1001391
CIF file Formula: - Mo O7 P2 Rb -
Comments: Riou, D; Leclaire, A; Grandin, A; Raveau, B Structure of a diphosphate of trivalent molybdenum Rb Mo P~2~ O~7~ Acta Crystallographica C (39,1983-) 45 (1989) 989-991
Space group: P 1 21/c 1
Cell volume: 629.5
Cell parameters: 7.5237; 10.3537; 8.3998; 90; 105.832; 90;  

COD ID: 1001405
CIF file Formula: - K Mo O7 P2 -
Comments: Leclaire, a; Borel, M M; Grandin, A; Raveau, B Two Molybdenum Diphosphates with a Tunnel Structure Involving Mo(III): K Mo P~2~ O~7~ and K~.17~ Mo P~2~ O~7~ Journal of Solid State Chemistry 78 (1989) 220-226
Space group: P 1 21/c 1
Cell volume: 609.9
Cell parameters: 7.3758; 10.348; 8.351; 90; 106.88; 90;  

COD ID: 1001413
CIF file Formula: - B Li O5 U -
Comments: Gasperin, M Synthese et structure du borouranate de lithium LiBUO~5~ Acta Crystallographica C (39,1983-) 46 (1990) 372-374
Space group: P 1 21/c 1
Cell volume: 402.5
Cell parameters: 5.767; 10.574; 6.835; 90; 105.04; 90;  

COD ID: 1001418
CIF file Formula: - Hg9 I6 P5 -
Comments: Ledesert, M; Rebbah, A; Labbe, P Hg~9~P~5~I~6~: a new mercury(I,II) structural determination Zeitschrift fuer Kristallographie (149,1979-) 192 (1990) 223-231
Space group: P 1 21/c 1
Cell volume: 2417.1
Cell parameters: 13.112; 12.486; 17.031; 90; 119.9; 90;  

COD ID: 1001425
CIF file Formula: - K Mo2 O13 P3 -
Comments: Leclaire, A.; Borel, M. M.; Grandin, A.; Raveau, B. Structure of a Molybdenum(V) Phosphate β-KMo~2~P~3~O~13~ Acta Crystallographica, Section C: Crystal Structure Communications 46(11) (1990) 2009-2011
Space group: P 1 21/c 1
Cell volume: 1117.4
Cell parameters: 9.701; 18.848; 6.389; 90; 106.96; 90;  

COD ID: 1001430
CIF file Formula: - K O7 P2 V -
Comments: Benhamada, L; Grandin, A; Borel, M M; Leclaire, A; Raveau, B Structure of KVP~2~O~7~ Acta Crystallographica C (39,1983-) 47 (1991) 424-425
Space group: P 1 21/c 1
Cell volume: 581.3
Cell parameters: 7.3686; 10.0527; 8.1874; 90; 106.58; 90;  

COD ID: 1001446
CIF file Formula: - Mo2 Na O13 P3 -
Comments: Costentin, G.; Borel, M. M.; Grandin, A.; Leclaire, A.; Raveau, B. ζ-NaMo~2~P~3~O~13~, a second form of pentavalent molybdenum sodium phosphate Journal of Solid State Chemistry 89 (1990) 31-38
Space group: P 1 21/c 1
Cell volume: 986.3
Cell parameters: 6.3682; 22.2546; 8.6172; 90; 126.139; 90;  

COD ID: 1001448
CIF file Formula: - Ba Mo2 O16 P4 -
Comments: Costentin, G; Borel, M M; Grandin, A; Leclaire, A; Raveau, B A molybdenum V diphosphate, BaMo~2~P~4~O~16~ Journal of Solid State Chemistry 89 (1990) 83-87
Space group: P 1 21/c 1
Cell volume: 605.9
Cell parameters: 6.4394; 12.378; 9.1613; 90; 123.92; 90;  

COD ID: 1001463
CIF file Formula: - Mo2 O13 P3 Tl -
Comments: Costentin, G.; Borel, M. M.; Grandin, A.; Leclaire, A.; Raveau, B. Stucture of β-TlMo~2~P~3~O~13~ Acta Crystallographica, Section C: Crystal Structure Communications 47(6) (1991) 1136-1138
Space group: P 1 21/c 1
Cell volume: 1136.5
Cell parameters: 9.7536; 19.064; 6.3945; 90; 107.099; 90;  

COD ID: 1001465
CIF file Formula: - Co0.92 Mg1.08 O7 P2 -
Comments: Riou, D; Leclaire, A; Raveau, B Structure of a cobalt magnesium diphosphate: (Mg~x~Co~1-x~)~2~P~2~O~7~ Acta Crystallographica C (39,1983-) 47 (1991) 1583-1585
Space group: P 1 21/c 1
Cell volume: 480.5
Cell parameters: 6.977; 8.33; 9.032; 90; 113.74; 90;  

COD ID: 1001467
CIF file Formula: - Mo2 O15 P4 -
Comments: Costentin, G; Leclaire, A; Borel, M M; Grandin, A; Raveau, B Determination of the crystal structure of Mo(V)~2~P~4~O~15~ Zeitschrift fuer Kristallographie (149,1979-) 201 (1992) 53-58
Space group: P 1 21/c 1
Cell volume: 556.5
Cell parameters: 8.3068; 6.5262; 10.7181; 90; 106.705; 90;  

COD ID: 1001477
CIF file Formula: - K6 O16 P4 V2 -
Comments: Benhamada, L; Grandin, A; Borel, M M; Leclaire, A; Raveau, B A new vanadium III potassium phosphate with a cage structure: K~6~V~2~P~4~O~16~ Journal of Solid State Chemistry 91 (1991) 264-270
Space group: P 1 21/c 1
Cell volume: 1639.8
Cell parameters: 9.578; 11.097; 18.127; 90; 121.67; 90;  

COD ID: 1001519
CIF file Formula: - Cd O10 P2 V2 -
Comments: Leclaire, A; Grandin, A; Chardon, J; Borel, M M; Raveau, B A new vanadium(IV) monophosphate Cd(VO)~2~(PO~4~)~2~ European Journal of Solid State Inorganic Chemistry 30 (1993) 393-400
Space group: P 1 21/c 1
Cell volume: 708.7
Cell parameters: 5.187; 7.959; 17.187; 90; 92.74; 90;  

COD ID: 1001534
CIF file Formula: - O10 P2 Pb V2 -
Comments: Grandin, A; Chardon, J; Borel, M M; Leclaire, A; Raveau, B Structure of PbV~2~P~2~O~1~0 Acta Crystallographica C (39,1983-) 48 (1992) 1913-1915
Space group: P 1 21/c 1
Cell volume: 753.4
Cell parameters: 5.2306; 8.5805; 16.79; 90; 91.01; 90;  

COD ID: 1001539
CIF file Formula: - Na2 O8 P2 V -
Comments: Benhamada, L; Grandin, A; Borel, M M; Leclaire, A; Raveau, B Na/2VP~2~O~8~: A Tetravalent Vanadium Diphosphate with a Layered Structure Journal of Solid State Chemistry 101 (1992) 154-160
Space group: P 1 21/c 1
Cell volume: 637.6
Cell parameters: 7.7178; 13.3233; 6.287; 90; 99.49; 90;  

COD ID: 1001542
CIF file Formula: - Ba O10 P2 V2 -
Comments: Grandin, A; Chardon, J; Borel, M M; Leclaire, A; Raveau, B BaV~2~P~2~O~10~, a new tetravalent vanadium phosphate with a tunnel structure Journal of Solid State Chemistry 99 (1992) 297-302
Space group: P 1 21/c 1
Cell volume: 780.6
Cell parameters: 5.2204; 9.1702; 16.3247; 90; 92.757; 90;  

COD ID: 1001553
CIF file Formula: - Cs Mo2 O10 P2 -
Comments: Guesdon, A.; Borel, M. M.; Leclaire, A.; Grandin, A.; Raveau, B. A series of Mixed-valent Molybdenum Monophosphates, Isotypic with Leucophosphite Represented by CsMo~2~P~2~O~10~ and K~1.5~Mo~2~P~2~O~10~ · H~2~O Zeitschrift für Anorganische und Allgemeine Chemie 619(11) (1993) 1841-1849
Space group: P 1 21/c 1
Cell volume: 919.8
Cell parameters: 9.428; 9.943; 12.348; 90; 127.38; 90;  

COD ID: 1001554
CIF file Formula: - H2 K1.5 Mo2 O11 P2 -
Comments: Guesdon, A.; Borel, M. M.; Leclaire, A.; Grandin, A.; Raveau, B. A series of Mixed-valent Molybdenum Monophosphates, Isotypic with Leucophosphite Represented by CsMo~2~P~2~O~10~ and K~1.5~Mo~2~P~2~O~10~ · H~2~O Zeitschrift für Anorganische und Allgemeine Chemie 619(11) (1993) 1841-1849
Space group: P 1 21/c 1
Cell volume: 916.7
Cell parameters: 9.721; 9.805; 12.329; 90; 128.73; 90;  

COD ID: 1001560
CIF file Formula: - As Cr3 Cs2 H O13 -
Comments: Goreaud, M Structures comparees de (NH~4~)~2~AsCr~3~O~12~(OH) et Cs~2~AsCr~3~O~12~(OH): tendance a la formation d'une charpente tridimensionelle par association d'heteropolyanions Journal of Solid State Chemistry 102 (1993) 236-241
Space group: P 1 21/c 1
Cell volume: 1308.5
Cell parameters: 10.544; 8.098; 15.362; 90; 94.006; 90;  

COD ID: 1001565
CIF file Formula: - K2 Mo2 O11 P2 -
Comments: Gueho, C; Borel, M M; Grandin, A; Leclaire, A; Raveau, B A Mo(V) monophosphate with an intersecting tunnel structure: K~2~Mo~2~P~2~O~11~ Journal of Solid State Chemistry 104 (1993) 202-208
Space group: P 1 21/c 1
Cell volume: 979.5
Cell parameters: 9.867; 10.122; 9.903; 90; 97.95; 90;  

COD ID: 1001566
CIF file Formula: - Ag O10 P2 V2 -
Comments: Grandin, A; Chardon, J; Borel, M M; Leclaire, A; Raveau, B A mixed valent vanadium phosphate closely related to BaV~2~P~2~O~10~: AgV~2~P~2~O~10~ Journal of Solid State Chemistry 104 (1993) 226-231
Space group: P 1 21/c 1
Cell volume: 723.6
Cell parameters: 5.256; 8.117; 16.966; 90; 91.46; 90;  

COD ID: 1001592
CIF file Formula: - Mo2 O11 P2 Tl2 -
Comments: Guesdon, A; Borel, M M; Grandin, A; Leclaire, A; Raveau, B Structure of Tl~2~Mo~2~P~2~O~11~ Acta Crystallographica C (39,1983-) 49 (1993) 1877-1879
Space group: P 1 21/c 1
Cell volume: 998.4
Cell parameters: 9.945; 10.156; 9.974; 90; 97.64; 90;  

COD ID: 1001604
CIF file Formula: - Cd2 O7 P V -
Comments: Boudin, S; Grandin, A; Leclaire, A; Borel, M M; Raveau, B The diphosphovanadate Cd~2~VPO~7~: a mixed framework with pseudo-close- packed octahedral layers connected through ditetrahedral VPO~7~ groups Journal of Solid State Chemistry 111 (1994) 365-369
Space group: P 1 21/c 1
Cell volume: 283.4
Cell parameters: 4.712; 10.791; 5.62; 90; 97.34; 90;  

COD ID: 1001613
CIF file Formula: - Mo2 O11 P2 Rb2 -
Comments: Guesdon, A; Leclaire, A; Borel, M M; Grandin, A; Raveau, B An Mo^V^ monophosphate, Rb~2~Mo~2~P~2~O~11~ Acta Crystallographica C (39,1983-) 50 (1994) 1852-1854
Space group: P 1 21/c 1
Cell volume: 1007.3
Cell parameters: 9.973; 10.18; 10.012; 90; 97.7; 90;  

COD ID: 1001614
CIF file Formula: - H1.8 Mo2 O10.9 P2 Rb -
Comments: Leclaire, A; Borel, M M; Grandin, A; Raveau, B The mixed valent molybdenum monophosphate RbMo~2~P~2~O~10~.(1-x)H~2~O: an intersecting tunnel structure isotypic with leucophosphite Journal of Solid State Chemistry 108 (1994) 177-183
Space group: P 1 21/c 1
Cell volume: 918.5
Cell parameters: 9.789; 9.752; 12.347; 90; 128.81; 90;  

COD ID: 1001617
CIF file Formula: - Cs1.5 Mo2 O11 P2 -
Comments: Borel, M M; Leclaire, A; Grandin, A; Raveau, B Cs~3~Mo~4~P~4~O~22~: A mixed valent monophosphate isotypic with K~2~Mo~2~P~2~O/1~1~ Journal of Solid State Chemistry 108 (1994) 336-339
Space group: P 1 21/c 1
Cell volume: 1002.2
Cell parameters: 10.134; 10.104; 9.952; 90; 100.44; 90;  

COD ID: 1001628
CIF file Formula: - Ag Mo2 O13 P3 -
Comments: Hoareau, T.; Borel, M.-M.; Grandin, A.; Leclaire, A.; Raveau, B. A new silver molybdenum(V) phosphate: ξ-Ag(MoO)~2~(P~2~O~7~)(PO~4~) Comptes Rendus de l'Academie des Sciences, Serie IIb: Mecanique, Physique, Chimie, Astronomie 319 (1994) 47-52
Space group: P 1 21/c 1
Cell volume: 995.9
Cell parameters: 6.376; 22.17299; 8.718; 90; 126.1; 90;  

COD ID: 1001655
CIF file Formula: - Cs Mo2 O11 P2 -
Comments: Hoareau, T; Leclaire, A; Borel, M M; Grandin, A; Raveau, B A mixed valent molybdenum monophosphate with a layer structure: Cs Mo2 O3 (P O4)2 Journal of Solid State Chemistry 116 (1995) 87-91
Space group: P 1 21/c 1
Cell volume: 977.3
Cell parameters: 10.047; 8.655; 11.597; 90; 104.27; 90;  

COD ID: 1001675
CIF file Formula: - Fe8 Ge3 O18 -
Comments: Agafonov, V; Kahn, A; Michel, D; Perez y Jorba, M Structural investigation of a new iron germanate Fe8 Ge3 O18 Journal of Solid State Chemistry 62 (1986) 397-401
Space group: P 1 21/c 1
Cell volume: 625.3
Cell parameters: 8.754; 5.11; 14.28; 90; 101.8; 90;  

COD ID: 1001681
CIF file Formula: - O5 P Ta -
Comments: Chahboun, H; Groult, D; Hervieu, M; Raveau, B $-beta Nb P O5 and $-beta Ta P O5: Bronzoids, second members of the monophosphate tungsten bronze series (P O2)4 (W O3)2M Journal of Solid State Chemistry 65 (1986) 331-342
Space group: P 1 21/c 1
Cell volume: 788.2
Cell parameters: 13.07; 5.281; 13.24; 90; 120.4; 90;  

COD ID: 1001726
CIF file Formula: - Cs1.5 K0.425 Mo2 O11 P2 -
Comments: Guesdon, A.; Leclaire, A.; Borel, M. M.; Raveau, B. Highly ordered distribution of the interpolated univalent cations in monophosphates with the α-K~2~Mo~2~O~3~(PO~4~)~2~ structure European Journal of Solid State and Inorganic Chemistry 33 (1996) 385-396
Space group: P 1 21/c 1
Cell volume: 1012.7
Cell parameters: 10.159; 10.103; 10.003; 90; 99.48; 90;  

COD ID: 1001727
CIF file Formula: - Cs K Mo2 O11 P2 -
Comments: Guesdon, A.; Leclaire, A.; Borel, M. M.; Raveau, B. Highly ordered distribution of the interpolated univalent cations in monophosphates with the α-K~2~Mo~2~O~3~(PO~4~)~2~ structure European Journal of Solid State and Inorganic Chemistry 33 (1996) 385-396
Space group: P 1 21/c 1
Cell volume: 992
Cell parameters: 10.121; 10.154; 9.82; 90; 100.59; 90;  

COD ID: 1001728
CIF file Formula: - Cs0.74 K1.26 Mo2 O11 P2 -
Comments: Guesdon, A.; Leclaire, A.; Borel, M. M.; Raveau, B. Highly ordered distribution of the interpolated univalent cations in monophosphates with the α-K~2~Mo~2~O~3~(PO~4~)~2~ structure European Journal of Solid State and Inorganic Chemistry 33 (1996) 385-396
Space group: P 1 21/c 1
Cell volume: 989.3
Cell parameters: 10.08; 10.146; 9.83; 90; 100.25; 90;  

COD ID: 1001729
CIF file Formula: - K0.88 Mo2 O11 P2 Rb1.12 -
Comments: Guesdon, A.; Leclaire, A.; Borel, M. M.; Raveau, B. Highly ordered distribution of the interpolated univalent cations in monophosphates with the α-K~2~Mo~2~O~3~(PO~4~)~2~ structure European Journal of Solid State and Inorganic Chemistry 33 (1996) 385-396
Space group: P 1 21/c 1
Cell volume: 985
Cell parameters: 9.961; 10.134; 9.884; 90; 99.16; 90;  

COD ID: 1001741
CIF file Formula: - Ca H8 N2 O10 -
Comments: Leclaire, A.; Monier, J. C. Liaisons hydrogene dans les cristaux de Ca(NO3)2*4H2Oalpha Locality: synthetic Acta Crystallographica, Section B 33 (1977) 1861-1866
Space group: P 1 21/c 1
Cell volume: 822.4
Cell parameters: 6.2786; 9.1551; 14.8999; 90; 106.22; 90;  

COD ID: 1001743
CIF file Formula: - Ca H8 N2 O10 -
Comments: Leclaire, A; Monier, J C Structure cristalline du nitrate de calcium tetrahydrate Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-) 271 (1970) 1555-1557
Space group: P 1 21/c 1
Cell volume: 812.5
Cell parameters: 6.268; 9.116; 14.83; 90; 106.5; 90;  

COD ID: 1001808
CIF file Formula: - Mo5 O16 Te -
Comments: Vallar, S; Goreaud, M Structure cristalline d'une forme monoclinique de Te Mo5 O16, oxyde a valence mixte conducteur bidimensionnel Journal of Solid State Chemistry 129 (1997) 303-307
Space group: P 1 21/c 1
Cell volume: 1181.4
Cell parameters: 10.0344; 14.43; 8.1599; 90; 90.78; 90;  

COD ID: 1001846
CIF file Formula: - Fe Na O7 P2 -
Comments: Gabelica-Robert, M; Goreaud, M; Labbe, P; Raveau, B The pyrophosphate Na Fe P2 O7: A cage structure Journal of Solid State Chemistry 45 (1982) 389-395
Space group: P 1 21/c 1
Cell volume: 514.5
Cell parameters: 7.3244; 7.9045; 9.5745; 90; 111.858; 90;  

COD ID: 1004023
CIF file Formula: - Cr2 K La O8 -
Comments: Bueno, I; Parada, C; Garcia, O; Puebla, E G; Monge, A; Valero, C R Crystal growth, structure, and properties of K La (Cr O~4~)~2~ Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-) 1988 (1988) 1911-1914
Space group: P 1 21/c 1
Cell volume: 720.3
Cell parameters: 8.729; 7.4752; 11.049; 90; 92.42; 90;  

COD ID: 1004036
CIF file Formula: - Al Cl4 Li -
Comments: Mairesse, G; Barbier, P; Vignacourt, J P Lithium tetrachloroaluminate, Li Al Cl~4~ Crystal Structure Communications 6 (1977) 15-18
Space group: P 1 21/c 1
Cell volume: 591.2
Cell parameters: 7.007; 6.504; 12.995; 90; 93.32; 90;  

COD ID: 1004048
CIF file Formula: - Br4 H4 In K O2 -
Comments: Wignacourt, J P; Mairesse, G; Barbier, P Potassium Diaquatetrabromoindate(III) Acta Crystallographica B (24,1968-38,1982) 36 (1980) 669-671
Space group: P 1 21/c 1
Cell volume: 527.3
Cell parameters: 6.852; 11.984; 6.996; 90; 113.38; 90;  

COD ID: 1004053
CIF file Formula: - H12 In N3 O12 S3 -
Comments: Jolibois, B; Laplace, G; Abraham, F; Nowogrocki, G The Low-Temperature Forms of some M(I)~3~ M(III) (X O~4~)~3~ Compounds: Structure of Triammonium indium(III) Trisulfate Acta Crystallographica B (24,1968-38,1982) 36 (1980) 2517-2519
Space group: P 1 21/c 1
Cell volume: 1215.7
Cell parameters: 8.963; 15.644; 9.131; 90; 108.28; 90;  

COD ID: 1004054
CIF file Formula: - B Cl4 Li O12 S4 -
Comments: Mairesse, G; Drache, M Lithium Tetrakis(chlorosulfato)borate Acta Crystallographica B (24,1968-38,1982) 36 (1980) 2767-2768
Space group: P 1 21/c 1
Cell volume: 1537.5
Cell parameters: 8.832; 8.388; 20.765; 90; 91.89; 90;  

COD ID: 1004091
CIF file Formula: - Bi Na3 O8 P2 -
Comments: Mairesse, G; Drache, M; Nowogrocki, G; Abraham, F Order-disorder transition in Na~3~Bi(PO~4~)~2~ Phase Transition 27 (1990) 91-105
Space group: P 1 21/c 1
Cell volume: 1388.8
Cell parameters: 19.86; 5.353; 13.96; 90; 110.64; 90;  

COD ID: 1004107
CIF file Formula: - O11 U2 V2 -
Comments: Tancret, N; Obbade, S; Abraham, F Ab initio structure determination of uranyl divanadate (U O2)2 V2 O7 from powder X-ray diffraction data European Journal of Solid State Inorganic Chemistry 32 (1995) 195-207
Space group: P 1 21/c 1
Cell volume: 471.1
Cell parameters: 5.6492; 13.1841; 7.2844; 90; 119.745; 90;  

COD ID: 1004114
CIF file Formula: - Ag2 O12 U2 V2 -
Comments: Abraham, F; Dion, C; Tancret, N; Saadi, M Ag2 (U O2)2 V2 O8 : a new compound with the carnotite structure. Synthesis, structure and properties Advanced Materials Research 1 (1994) 511-520
Space group: P 1 21/c 1
Cell volume: 504.2
Cell parameters: 5.8952; 8.3541; 10.4142; 90; 100.56; 90;  

COD ID: 1004144
CIF file Formula: - B4 Cs2 H10 O12 -
Comments: Touboul, M; Penin, N; Nowogrocki, G Crystal structure and thermal behavior of Cs2 (B4 O5 (O H)4)3 H2 O Journal of Solid State Chemistry 143 (1999) 260-265
Space group: P 1 21/c 1
Cell volume: 1260.5
Cell parameters: 8.424; 11.378; 13.16; 90; 92.06; 90;  

COD ID: 1005051
CIF file Formula: - Ba16 Cu13 N15 -
Comments: Niewa, R; DiSalvo, F J Breaking up chains: the nitridocuprates(I) Ba (Cu N), Ba16 ((Cu N)8)(Cu2 N3) (Cu3 N4) and Ca4 Ba (Cu N2)2 Journal of Alloys Compd. 279 (1998) 153-160
Space group: P 1 21/c 1
Cell volume: 938.9
Cell parameters: 9.5611; 7.2731; 13.5225; 90; 93.115; 90;  

COD ID: 1006090
CIF file Formula: - Cu Nb2 O6 -
Comments: Norwig, J; Weitzel, H; Paulus, H; Lautenschlaeger, G; Rodriguez-Carvajal, J; Fuess, H Structural relations in mixed oxides Cux Zn1-x Nb2 O6 Journal of Solid State Chemistry 115 (1995) 476-483
Space group: P 1 21/c 1
Cell volume: 408.6
Cell parameters: 5.0064; 14.1733; 5.7615; 90; 91.672; 90;  

COD ID: 1006091
CIF file Formula: - Cu0.85 Nb2 O6 Zn0.15 -
Comments: Norwig, J; Weitzel, H; Paulus, H; Lautenschlaeger, G; Rodriguez-Carvajal, J; Fuess, H Structural relations in mixed oxides Cux Zn1-x Nb2 O6 Journal of Solid State Chemistry 115 (1995) 476-483
Space group: P 1 21/c 1
Cell volume: 408.2
Cell parameters: 5.007; 14.1706; 5.7547; 90; 91.451; 90;  

COD ID: 1006111
CIF file Formula: - H4 O9 P2 Ti -
Comments: Salvadó, M. A.; Pertierra, P.; García-Granda, S.; García, J. R.; Rodríguez, J.; Fernández-Díaz, M. T. Neutron powder diffraction study of α-Ti(HPO~4~)~2~.(H~2~O) and α-Hf(HPO~4~)~2~.(H~2~O); H-atom positions Acta Crystallographica, Section B: Structural Science 52(5) (1996) 896-898
Space group: P 1 21/c 1
Cell volume: 651.7
Cell parameters: 8.611; 4.9933; 16.1507; 90; 110.206; 90;  

COD ID: 1006112
CIF file Formula: - H4 Hf O9 P2 -
Comments: Salvadó, M. A.; Pertierra, P.; García-Granda, S.; García, J. R.; Rodríguez, J.; Fernández-Díaz, M. T. Neutron powder diffraction study of α-Ti(HPO~4~)~2~.(H~2~O) and α-Hf(HPO~4~)~2~.(H~2~O); H-atom positions Acta Crystallographica, Section B: Structural Science 52(5) (1996) 896-898
Space group: P 1 21/c 1
Cell volume: 713.4
Cell parameters: 8.9955; 5.2439; 16.224; 90; 111.234; 90;  

COD ID: 1007001
CIF file Formula: - Mo O7 Te2 -
Comments: Arnaud, Y; Averbuch-Pouchot, M T; Durif, A; Guidot, J Structure cristalline de l'ox de mixte de molybdene-tellure: Mo Te~2~ O~7~ Acta Crystallographica B (24,1968-38,1982) 32 (1976) 1417-1420
Space group: P 1 21/c 1
Cell volume: 586.1
Cell parameters: 4.286; 8.618; 15.945; 90; 95.68; 90;  

COD ID: 1007042
CIF file Formula: - Cr2 Cu H2 K2 O14 P2 -
Comments: Coing-Boyat, J; Durif, A; Guitel, J C Structure cristalline d'un phosphochromate acide de cuivre potassium: Cu K~2~ H~2~ (P Cr O~7~)~2~ Journal of Solid State Chemistry 30 (1979) 329-334
Space group: P 1 21/c 1
Cell volume: 616.6
Cell parameters: 9.559; 7.196; 8.983; 90; 93.73; 90;  

COD ID: 1007059
CIF file Formula: - Cu H4 N O9 P3 -
Comments: Laugt, M; Durif, A Etude systematique des phosphates condenses Seminaire de Chimie de l'Etat Solide 1971-72 1972 (1972) 157-175
Space group: P 1 21/c 1
Cell volume: 775.2
Cell parameters: 5.182; 11.544; 13.06; 90; 97.16; 90;  

COD ID: 1007063
CIF file Formula: - H10 K3 O17 P3 Te -
Comments: Boudjada, N.; Averbuch-Pouchot, M. T.; Durif, A. Structure d'un Trimetaphosphate-Tellurate de Potassium Dihydrate Te (O H)~6~ K~3~ P~3~ O~9~ (H~2~ O)~2~ Acta Crystallographica B (24,1968-38,1982) 37 (1981) 647-649
Space group: P 1 21/c 1
Cell volume: 1642.6
Cell parameters: 15.61; 7.456; 14.84; 90; 108.01; 90;  

COD ID: 1007147
CIF file Formula: - As H11 N2 O8 S -
Comments: Boubia, M; Averbuch-Pouchot, M T; Durif, A Ordered As O~4~ and S O~4~ tetrahedra in diammonium trihydrogenarsenate sulfate Acta Crystallographica C (39,1983-) 41 (1985) 1562-1564
Space group: P 1 21/c 1
Cell volume: 883.3
Cell parameters: 11.95; 7.66; 9.658; 90; 92.4; 90;  

COD ID: 1007156
CIF file Formula: - Cs H6 Na3 O15 P4 -
Comments: Averbuch-Pouchot, M T; Durif, A Contribution to the crystal chemistry of tetrametaphosphate Journal of Solid State Chemistry 60 (1985) 13-19
Space group: P 1 21/c 1
Cell volume: 1462.8
Cell parameters: 11.39; 10.92; 11.81; 90; 95.24; 90;  

COD ID: 1007170
CIF file Formula: - Mo2 O12 P2 Pb -
Comments: Masse, R; Averbuch-Pouchot, M T; Durif, A Crystal structures of phosphomolybdyl salts: Pb (Mo O~2~)~2~ (P O~4~)~2~ and Ba (Mo O~2~)~2~ (P O~4~)~2~. Journal of Solid State Chemistry 58 (1985) 157-163
Space group: P 1 21/c 1
Cell volume: 920.3
Cell parameters: 6.353; 12.289; 11.8; 90; 92.56; 90;  

COD ID: 1007171
CIF file Formula: - Ba Mo2 O12 P2 -
Comments: Masse, R; Averbuch-Pouchot, M T; Durif, A Crystal structures of phosphomolybdyl salts: Pb (Mo O~2~)~2~ (P O~4~)~2~ and Ba (Mo O~2~)~2~ (P O~4~)~2~. Journal of Solid State Chemistry 58 (1985) 157-163
Space group: P 1 21/c 1
Cell volume: 451.7
Cell parameters: 6.383; 7.142; 9.953; 90; 95.46; 90;  

COD ID: 1008014
CIF file Formula: - Mo5 O16 Te -
Comments: Arnaud, Y; Guidot, J Structure cristalline de l'oxyde mixte de molybdene-tellure: Mo~5~ Te O~16~ Acta Crystallographica B (24,1968-38,1982) 33 (1977) 2151-2155
Space group: P 1 21/c 1
Cell volume: 1182.2
Cell parameters: 10.038; 14.431; 8.1617; 90; 90.85; 90;  

COD ID: 1008018
CIF file Formula: - C8 H10 Hf K4 O21 -
Comments: Tranqui, D.; Boyer, P.; Laugier, J.; Vulliet, P. Structure cristalline du tetrakisoxalatohafniate de potassium pentahydrate K~4~ Hf (C~2~ O~4~)~4~ (H~2~ O)~5~ Acta Crystallographica, Section B: Structural Crystallography and Crystal Chemistry 33 (1977) 3126-3133
Space group: P 1 21/c 1
Cell volume: 2088.8
Cell parameters: 10.64; 12.35; 15.94; 90; 94.27; 90;  

COD ID: 1008023
CIF file Formula: - N S -
Comments: Heger, G; Klein, S; Pintschovius, L; Kahlert, H Determination of the crystal structure of (S N)~x~ by neutron diffraction Journal of Solid State Chemistry 23 (1978) 341-347
Space group: P 1 21/c 1
Cell volume: 130.5
Cell parameters: 4.11; 4.43; 7.63; 90; 110; 90;  

COD ID: 1008026
CIF file Formula: - H10 Na2 O8 S2 -
Comments: Lisensky, G C; Levy, H A Sodium thiosulfate pentahydrate: a redetermination by neutron diffraction Acta Crystallographica B (24,1968-38,1982) 34 (1978) 1975-1977
Space group: P 1 21/c 1
Cell volume: 942.6
Cell parameters: 5.9522; 21.618; 7.543; 90; 103.804; 90;  

COD ID: 1008032
CIF file Formula: - As Cr3 H9 N2 O13 -
Comments: Averbuch-Pouchot, M T Structure du tris(chromato)arsenate de diammonium-hydrogene, (N H~4~)~2~ H Cr~3~ As O~13~: mise en evidence d'un nouvel anion (Cr~3~ As O~13~)^3-^ Acta Crystallographica B (24,1968-38,1982) 34 (1978) 3350-3351
Space group: P 1 21/c 1
Cell volume: 1271.4
Cell parameters: 14.02; 9.49; 9.57; 90; 93.12; 90;  

COD ID: 1008052
CIF file Formula: - Al2 Cl8 Hg3 -
Comments: Ellison, R D; Levy, H A; Fung, K W Crystal and molecular structure of trimercury chloroaluminate, Hg~3~ (Al Cl~4~)~2~ Inorganic Chemistry 11 (1972) 833-836
Space group: P 1 21/c 1
Cell volume: 1502.5
Cell parameters: 7.1321; 15.0468; 14.1771; 90; 99.05; 90;  

COD ID: 1008065
CIF file Formula: - F6 Xe2 -
Comments: Burns, J H; Ellison, R D; Levy, H A The crystal structure of the molecular addition compound xenon difluoride-xenon tetrafluoride Journal of Physical Chemistry 67 (1963) 1569-1570
Space group: P 1 21/c 1
Cell volume: 311.2
Cell parameters: 6.64; 7.33; 6.4; 90; 92.67; 90;  

COD ID: 1008087
CIF file Formula: - F6 Xe2 -
Comments: Burns, J. H.; Ellison, R. D.; Levy, H. A. The crystal structure of the molecular addition compound xenon difluoride - xenon tetrafluoride Acta Crystallographica (1,1948-23,1967) 18(1) (1965) 11-16
Space group: P 1 21/c 1
Cell volume: 311.2
Cell parameters: 6.64; 7.33; 6.4; 90; 92.67; 90;  

COD ID: 1008122
CIF file Formula: - F6 K2 O4 S Sb2 -
Comments: Bourgault, M; Ducourant, B; Bonnet, B; Fourcade, R Structure cristalline de K~2~ S O~4~ (Sb F~3~)~2~ Journal of Solid State Chemistry 36 (1981) 183-189
Space group: P 1 21/c 1
Cell volume: 980.5
Cell parameters: 9.225; 5.632; 19.379; 90; 103.14; 90;  

COD ID: 1008149
CIF file Formula: - F5 Ru -
Comments: Darriet, J; Soubeyroux, J L; Touhara, H; Tressaud, A; Hagenmueller, P Interactions magnetiques intra- et interclusters dans les pentafluorures Ru F~5~ Et Os F~5~ Materials Research Bulletin 17 (1982) 315-324
Space group: P 1 21/c 1
Cell volume: 640.6
Cell parameters: 5.385; 9.815; 12.289; 90; 99.53; 90;  

COD ID: 1008150
CIF file Formula: - F5 Os -
Comments: Darriet, J; Soubeyroux, J L; Touhara, H; Tressaud, A; Hagenmueller, P Interactions magnetiques intra- et interclusters dans les pentafluorures Ru F~5~ Et Os F~5~ Materials Research Bulletin 17 (1982) 315-324
Space group: P 1 21/c 1
Cell volume: 649.3
Cell parameters: 5.403; 9.866; 12.336; 90; 99.13; 90;  

COD ID: 1008164
CIF file Formula: - O8 Pb3 V2 -
Comments: Garnier, P.; Calvarin, G.; Berar, J. F.; Weigel, D. Etude des Phases Ferroelastiques de Pb~3~V~2~O~8~: Determination de la Maille Cristalline de la Phase α Ferroelectrique Basse Temperature Materials Research Bulletin 19(4) (1984) 407-414
Space group: P 1 21/c 1
Cell volume: 395.5
Cell parameters: 7.514; 6.107; 9.526; 90; 115.2; 90;  

COD ID: 1008236
CIF file Formula: - Ho Li O2 -
Comments: Bertaut, F; Gondrand, M Etude des combinaisons d'oxydes de terres rares et de lithium du type T Li O~2~ Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 255 (1962) 1135-1137
Space group: P 1 21/c 1
Cell volume: 206.4
Cell parameters: 6.14; 6.19; 6.23; 90; 119.33; 90;  

COD ID: 1008368
CIF file Formula: - Cs3 H8 O16 P3 Te -
Comments: Averbuch-Pouchot, M T Structure of a new adduct between telluric acid and a condensed phosphate: (Cs~3~ P~3~ O~9~) (Te (O H)~6~ (H~2~ O)). Acta Crystallographica C (39,1983-) 44 (1988) 1166-1168
Space group: P 1 21/c 1
Cell volume: 1737.6
Cell parameters: 7.279; 13.984; 17.071; 90; 90.42; 90;  

COD ID: 1008451
CIF file Formula: - Cl2 Cs2 H6 O6 Te -
Comments: Averbuch-Pouchot, M T Crystal structure of a new telluric acid adduct : Te(OH)~6~ 2CsCl Zeitschrift fuer Kristallographie (149,1979-) 182 (1988) 291-295
Space group: P 1 21/c 1
Cell volume: 522.2
Cell parameters: 6.243; 11.154; 7.862; 90; 107.48; 90;  

COD ID: 1008525
CIF file Formula: - As6 In4 K4 -
Comments: Birdwishtell, T L T; Klein, C L; Jeffries, T; Stevens, E D; O'Connor, C J Synthesis and crystal structures of the layered I-III-V Zintl phases, K~4~In~4~X~6~, where X=As, Sb Journal of Materials Chemistry 1(4) (1991) 555-558
Space group: P 1 21/c 1
Cell volume: 1607.6
Cell parameters: 14.323; 7.106; 15.795; 90; 90.3; 90;  

COD ID: 1008526
CIF file Formula: - In4 K4 Sb6 -
Comments: Birdwishtell, T L T; Klein, C L; Jeffries, T; Stevens, E D; O'Connor, C J Synthesis and crystal structures of the layered I-III-V Zintl phases, K~4~In~4~X~6~, where X=As, Sb Journal of Materials Chemistry 1(4) (1991) 555-558
Space group: P 1 21/c 1
Cell volume: 1936.3
Cell parameters: 15.288; 7.544; 16.79; 90; 90.54; 90;  

COD ID: 1008527
CIF file Formula: - F4 Mn Na -
Comments: Molinier, M; Massa, W; Khairoun, S; Tressaud, A; Soubeyroux, J L Crystal and magnetic structures of NaMnF~4~ Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 46(12) (1991) 1669-1673
Space group: P 1 21/c 1
Cell volume: 153.3
Cell parameters: 5.736; 4.892; 5.748; 90; 108.07; 90;  

COD ID: 1008528
CIF file Formula: - F4 Mn Na -
Comments: Molinier, M; Massa, W; Khairoun, S; Tressaud, A; Soubeyroux, J L Crystal and magnetic structures of NaMnF~4~ Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 46(12) (1991) 1669-1673
Space group: P 1 21/c 1
Cell volume: 153.7
Cell parameters: 5.755; 4.892; 5.76; 90; 108.62; 90;  

COD ID: 1008730
CIF file Formula: - Ca H2 O12 P4 -
Comments: Averbuch-Pouchot, M T Preparation and crystal structure of an acidic long-chain polyphosphate: Ca H2 (P O3)4 Zeitschrift fuer Anorganische und Allgemeine Chemie 621 (1995) 506-509
Space group: P 1 21/c 1
Cell volume: 486.2
Cell parameters: 5.686; 9.676; 8.844; 90; 92.35; 90;  

COD ID: 1008758
CIF file Formula: - H20 Na2 O14 S -
Comments: Levy, H. A.; Lisensky, G. C. Crystal structures of sodium sulfate decahydrate (Glauber's salt) and sodium tetraborate decahydrate (borax). Redetermination by neutron diffraction Locality: synthetic Note: anisoU's from ICSD Acta Crystallographica, Section B 34 (1978) 3502-3510
Space group: P 1 21/c 1
Cell volume: 1460.3
Cell parameters: 11.512; 10.37; 12.847; 90; 107.789; 90;  

COD ID: 1008883
CIF file Formula: - Ce K3 P2 S8 -
Comments: Gauthier, G; Jobic, S; Brec, R; Rouxel, J K3 Ce P2 S8: a new cerium thiophosphate with one-dimensional anionic chains Inorganic Chemistry 37 (1998) 2332-2333
Space group: P 1 21/c 1
Cell volume: 1473.7
Cell parameters: 9.121; 17.02399; 9.491; 90; 90.25; 90;  

COD ID: 1008941
CIF file Formula: - Li O2 Y -
Comments: Bertaut, F; Gondrand, M Etude des combinaisons d'oxydes de terres rares et de lithium du type T Li O2 Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 255 (1962) 1135-1137
Space group: P 1 21/c 1
Cell volume: 206
Cell parameters: 6.12; 6.185; 6.21; 90; 118.8; 90;  

COD ID: 1008942
CIF file Formula: - Dy Li O2 -
Comments: Bertaut, F; Gondrand, M Etude des combinaisons d'oxydes de terres rares et de lithium du type T Li O2 Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 255 (1962) 1135-1137
Space group: P 1 21/c 1
Cell volume: 210.8
Cell parameters: 6.215; 6.17; 6.3; 90; 119.22; 90;  

COD ID: 1009059
CIF file Formula: - Na5 Sb3 Sn -
Comments: Eisenmann, B; Klein, J Na5 Sn Sb3 and K8 Sn Sb4, zwei neue Zintlphasen mit tetraedrischen SnSb4-Baueinheiten Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-) 43 (1988) 1156-1160
Space group: P 1 21/c 1
Cell volume: 2110.4
Cell parameters: 18.59399; 9.181; 12.493; 90; 98.3; 90;  

COD ID: 1010004
CIF file Formula: - Bi2 O3 -
Comments: Sillén, Lars Gunnar Die Kristallstruktur des monoklinen α-Bi~2~O~3~ Naturwissenschaften 28(13) (1940) 206-207
Space group: P 1 21/c 1
Cell volume: 326.9
Cell parameters: 5.83; 8.14; 7.48; 90; 67.07; 90;  

COD ID: 1010049
CIF file Formula: - F7 K2 Nb -
Comments: Hoard, J L Structures of complex fluorides. Potassium heptafluocolumbate. The Configuration of the heptafluocolumbate and heptafluortantalate ions Journal of the American Chemical Society 61 (1939) 1252-1259
Space group: P 1 21/c 1
Cell volume: 630
Cell parameters: 5.85; 12.67; 8.5; 90; 90; 90;  

COD ID: 1010050
CIF file Formula: - F7 K2 Ta -
Comments: Hoard, J L Structures of complex fluorides. Potassium heptafluocolumbate. The Configuration of the heptafluocolumbate and heptafluortantalate ions Journal of the American Chemical Society 61 (1939) 1252-1259
Space group: P 1 21/c 1
Cell volume: 630
Cell parameters: 5.85; 12.67; 8.5; 90; 90; 90;  

COD ID: 1010804
CIF file Formula: - Cu H4 Na2 O10 S2 -
Comments: Palache, C Kroehnkite and Natrochalcite from Chile. American Journal of Science (1939-) 237 (1939) 447-455
Space group: P 1 21/c 1
Cell volume: 377.9
Cell parameters: 5.78; 12.58; 5.48; 90; 108.5; 90;  

COD ID: 1010851
CIF file Formula: - H32 Mo7 N6 O28 -
Comments: Sturdivant, J H The Formula of Ammonium Paramolybdate Journal of the American Chemical Society 59 (1937) 630-631
Space group: P 1 21/c 1
Cell volume: 2847.8
Cell parameters: 8.382; 36.125; 10.464; 90; 116; 90;  

COD ID: 1010887
CIF file Formula: - B H O2 -
Comments: Tazaki, H Single crystals of metaboric acid. Journal of Science of the Hiroshima University, Series A: Mathematics, Physics, Chemistry 10 (1940) 37-54
Space group: P 1 21/c 1
Cell volume: 424.9
Cell parameters: 6.76; 8.8; 7.15; 90; 92.7; 90;  

COD ID: 1010912
CIF file Formula: - O2 Zr -
Comments: Naray-Szabo, S Zur Struktur des Baddeleyits Zr O2 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 94 (1936) 414-416
Space group: P 1 21/c 1
Cell volume: 145.2
Cell parameters: 5.21; 5.26; 5.37; 90; 80.53; 90;  

COD ID: 1011042
CIF file Formula: - Fe S Sb -
Comments: Buerger, M J The Crystal Structure of Gudmundite (Fe Sb S) and its Bearing on the Existence Field of the Arsenopyrite Structural Type Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 101 (1939) 290-316
Space group: P 1 21/c 1
Cell volume: 199.1
Cell parameters: 6.02; 5.93; 6.02; 90; 67.87; 90;  

COD ID: 1011072
CIF file Formula: - Al Be H O5 Si -
Comments: Biscoe, J; Warren, B E The structure of Euclase H Be Al Si O5 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 86 (1933) 292-297
Space group: P 1 21/c 1
Cell volume: 307.5
Cell parameters: 4.62; 14.24; 4.75; 90; 79.73; 90;  

COD ID: 1011270
CIF file Formula: - Be Ca F2 H O5 P -
Comments: Strunz, H Datolith und Herderit Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 93 (1936) 146-150
Space group: P 1 21/c 1
Cell volume: 361.3
Cell parameters: 4.8; 7.68; 9.8; 90; 90.1; 90;  

COD ID: 1100065
CIF file Formula: - B2 Na3 O6 Y -
Comments: Zhang, Y; Chen, X; Liang, J; Xu, T Synthesis and structural study of new rarte earth sodium borates of Na~3~Ln(BO~2~)~3~(Ln=Y,Gd) Journal of Alloys and Compounds 333 (2002) 72-75
Space group: P 1 21/c 1
Cell volume: 584.1
Cell parameters: 6.505; 8.5172; 12.0213; 90; 118.72; 90;  

COD ID: 1100085
CIF file Formula: - H6 Mg O16 S4 -
Comments: Troyanov, S I; Merinov, B V; Verin, I P; Kemnitz, E; Hass, D Crystal structure of acid magnesium sulphate Mg:SO~3~(OH):~2~:SO~2~(OH)~2~:~2~ Kristallografiya 35 (1990) 852-855
Space group: P 1 21/c 1
Cell volume: 596.3
Cell parameters: 5.091; 15.329; 7.882; 90; 104.19; 90;  

COD ID: 1100129
CIF file Formula: - C4 Na5 O12 Y -
Comments: Awaleh, M.O.; Ben Ali, A.; Maisonneuve, V.; Leblanc, M. Microwave-assisted synthesis, crystal structures and thermal behaviour of Na5 Y (C O3)4 and Na5 Yb (C O3)4 * 2(H2 O) Journal of Alloys Compd. 349(1-2) (2003) 114-120
Space group: P 1 21/c 1
Cell volume: 1081.41
Cell parameters: 12.209; 10.085; 8.783; 90; 90.39; 90;  

COD ID: 1100131
CIF file Formula: - B4 H12 Na O13 Rb -
Comments: Ben Ali, A.; Smiri, L.; Maisonneuve, V. Crystal structure of Na Rb B4 O5 (O H)4 * 4(H2 O): comparison with other tetraborate hydrates Journal of Alloys and Compounds 322(1-2) (2001) 153-159
Space group: P 1 21/c 1
Cell volume: 1192.85
Cell parameters: 8.1138; 11.471; 12.8233; 90; 91.91; 90;  

COD ID: 1100137
CIF file Formula: - C10 H12 Ag2 N10 O10 -
Comments: Sawsan Salameh; Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas Inorganica Chimica Acta 358 (2005) 824-827
Space group: P 1 21/c 1
Cell volume: 924.51
Cell parameters: 10.5297; 12.6897; 6.9432; 90; 94.782; 90;  

COD ID: 1100142
CIF file Formula: - Cl Co Cr2 H20 N6 O8 -
Comments: Raj Pal Sharma; Ritu Bala; Rajni Sharma; Juan M. Salas; Miguel Quiros Journal of Coordination Chemistry 58 (2005) 217-223
Space group: P 1 21/c 1
Cell volume: 1395.2
Cell parameters: 10.0218; 9.3216; 16.2203; 90; 112.962; 90;  

COD ID: 1100143
CIF file Formula: - C5 H16 Co N11 S -
Comments: Raj Pal Sharma; Rajni Sharma; Ritu Bala; Miguel Quiros; Juan M. Salas Journal of Coordination Chemistry 56 (2003) 1581-1586
Space group: P 1 21/c 1
Cell volume: 1273.63
Cell parameters: 12.195; 9.0317; 12.6017; 90; 113.419; 90;  

COD ID: 1100144
CIF file Formula: - C18 H24 Co N10 O12 -
Comments: Esther R. Acuna-Cueva; Rene Faure; Nuria A. Illan-Cabeza; Sonia B. Jimenez-Pulido; Miguel N. Moreno-Carretero; Miguel Quiros Inorganica Chimica Acta 342 (2003) 209-218
Space group: P 1 21/c 1
Cell volume: 1316.39
Cell parameters: 13.2319; 8.1677; 12.9061; 90; 109.305; 90;  

COD ID: 1100153
CIF file Formula: - Ca4 F2 O7 Si2 -
Comments: Kruger, Hannes; Kahlenberg, Volker ()
Space group: P 1 21/c 1
Cell volume: 816.3
Cell parameters: 7.5397; 10.5338; 10.907; 90; 109.557; 90;  

COD ID: 1100155
CIF file Formula: - C35 H46 Cl2 I N3 Ni O2 -
Comments: ()
Space group: P 1 21/c 1
Cell volume: 4027.5
Cell parameters: 12.78; 17.04; 19.13; 90; 104.82; 90;  

COD ID: 1100159
CIF file Formula: - C9 H14 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/c 1
Cell volume: 1237.4
Cell parameters: 5.422; 13.436; 17; 90; 92.324; 90;  

COD ID: 1100163
CIF file Formula: - C46 H46 N12 O6 Zn -
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/c 1
Cell volume: 2251.9
Cell parameters: 12.9507; 9.0191; 22.209; 90; 119.763; 90;  

COD ID: 1100171
CIF file Formula: - C22 H40 N14 O11 Pd2 -
Comments: Mohammad Abul-Haj; Miguel Quiros; Juan M. Salas Polyhedron 23 (2004) 2373-2379
Space group: P 1 21/c 1
Cell volume: 3481.5
Cell parameters: 10.2842; 18.92; 18.45; 90; 104.117; 90;  

COD ID: 1100174
CIF file Formula: - C24 H64 I2 N4 Ni P4 -
Comments: Gröb, Thorsten; Neumüller, Bernhard; Harms, Klaus; Schmock, Fritjof; Greiner, Andreas; Dehnicke, Kurt Die Kristallstrukturen vontrans-[NiBr~2~(Pyridin)~4~] und [Ni(HNPEt~3~)~4~]I~2~ Zeitschrift fuer Anorganische und Allgemeine Chemie 627(8) (2001) 1928-1931
Space group: P 1 21/c 1
Cell volume: 3829.09
Cell parameters: 19.349; 10.7833; 19.663; 90; 111.04; 90;  

COD ID: 1100182
CIF file Formula: - C10 H10 Cl N O2 -
Comments: Bach, Thorsten; Schlummer, Björn; Harms, Klaus Iron(II)-catalyzed intramolecular aminochlorination of alkenes Chemical Communications (Cambridge, United Kingdom) (issue 4) (2000) 287-288
Space group: P 1 21/c 1
Cell volume: 944.112
Cell parameters: 7.8902; 5.8375; 20.5524; 90; 94.175; 90;  

COD ID: 1100188
CIF file Formula: - C22 H24 N2 O2 -
Comments: Bach, Thorsten; Bergmann, Hermann; Grosch, Benjamin; Harms, Klaus; Herdtweck, Eberhardt Synthesis of Enantiomerically Pure 1,5,7-Trimethyl-3-azabicyclo[3.3.1]nonan-2-ones as Chiral Host Compounds for Enantioselective Photochemical Reactions in Solution Synthesis 2001(9) (2001) 1395-1405
Space group: P 1 21/c 1
Cell volume: 1819.54
Cell parameters: 11.372; 14.9124; 11.545; 90; 111.665; 90;  

COD ID: 1100198
CIF file Formula: - C14 H36 Cu Li O6 -
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/c 1
Cell volume: 2083.3
Cell parameters: 7.7726; 17.7023; 15.1696; 90; 93.518; 90;  

COD ID: 1100205
CIF file Formula: - C7 H19 F3 N O3 P S 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/c 1
Cell volume: 3035.94
Cell parameters: 17.7708; 11.7355; 16.1137; 90; 115.389; 90;  

COD ID: 1100210
CIF file Formula: - C9 H27 I N P Si2 -
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/c 1
Cell volume: 3419.89
Cell parameters: 19.254; 12.6907; 15.073; 90; 111.79; 90;  

COD ID: 1100215
CIF file Formula: - C26 H62 Cu2 Li2 N2 O4 Si2 -
Comments: Bosold, F.; Marsch, M.; Harms, K.; Boche, G. Crystal structure of bis[bis(diethylether)lithium (trimethylsilyl)methyl-cyanocuprate], [(C~4~H~10~O)~2~Li(C~3~H~9~)SiCH~2~CuCN]~2~ Zeitschrift für Kristallographie - New Crystal Structures 216(1-4) (2001) 143-144
Space group: P 1 21/c 1
Cell volume: 1935.42
Cell parameters: 10.008; 11.1636; 18.0294; 90; 106.091; 90;  

COD ID: 1100219
CIF file Formula: - C18.75 H55.5 Br5 Cl1.5 N12 Ni4 P3 -
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/c 1
Cell volume: 4756.94
Cell parameters: 12.26; 16.14; 24.06; 90; 92.34; 90;  

COD ID: 1100221
CIF file Formula: - C7 H10 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/c 1
Cell volume: 783.802
Cell parameters: 5.3339; 12.4601; 11.8203; 90; 93.864; 90;  

COD ID: 1100233
CIF file Formula: - C18 H21 N O2 -
Comments: Harms, K.; Boche, G.; Marsch, M. Private Communication (2001)
Space group: P 1 21/c 1
Cell volume: 1461.25
Cell parameters: 8.449; 9.895; 17.837; 90; 101.507; 90;  

COD ID: 1100243
CIF file Formula: - C16 H23 N O3 -
Comments: Bach, Thorsten; Brummerhop, Harm; Harms, Klaus The Synthesis of (+)-Preussin and Related Pyrrolidinols by Diastereoselective Paternò-Büchi Reactions of Chiral 2-Substituted 2,3-Dihydropyrroles Chemistry - A European Journal 6(20) (2000) 3838-3848
Space group: P 1 21/c 1
Cell volume: 1567.91
Cell parameters: 13.318; 6.836; 17.3181; 90; 96.045; 90;  

COD ID: 1100245
CIF file Formula: - C21 H29 N O3 -
Comments: Bach, Thorsten; Schlummer, Björn; Harms, Klaus Intramolecular Iron(II)-Catalyzed Addition Reactions of Propargyloxycarbonyl Azides Synlett 2000(9) (2000) 1330-1332
Space group: P 1 21/c 1
Cell volume: 2043.19
Cell parameters: 13.514; 12.213; 12.644; 90; 101.74; 90;  

COD ID: 1100267
CIF file Formula: - C23 H38 N P -
Comments: Kotov, V. V.; Avtomonov, E. V.; Sundermeyer, J.; Harms, K.; Lemenovskii, D. A. Alkyl(amino)- and Alkyl(chloro)phosphanyl-Substituted Cyclopentadienyl Complexes of Titanium and Zirconium European Journal of Inorganic Chemistry 2002(3) (2002) 678-691
Space group: P 1 21/c 1
Cell volume: 2211.21
Cell parameters: 7.7683; 22.196; 12.8267; 90; 91.138; 90;  

COD ID: 1100268
CIF file Formula: - C17 H31 Cl3 N P Ti -
Comments: Kotov, V. V.; Avtomonov, E. V.; Sundermeyer, J.; Harms, K.; Lemenovskii, D. A. Alkyl(amino)- and Alkyl(chloro)phosphanyl-Substituted Cyclopentadienyl Complexes of Titanium and Zirconium European Journal of Inorganic Chemistry 2002(3) (2002) 678-691
Space group: P 1 21/c 1
Cell volume: 2153.48
Cell parameters: 9.351; 15.6371; 14.7317; 90; 91.387; 90;  

COD ID: 1100272
CIF file Formula: - C35 H62 Li N O3 -
Comments: Bosold, F.; Marsch, M.; Harms, K.; Boche, G. Crystal structure of (3THF)-N-lithiium-N-(2',4',6'-tris-t-butyl-phenyl)-E'pentene(1)-amide, C~35~H~62~LiNO~3~ Zeitschrift für Kristallographie - New Crystal Structures 216(1-4) (2001) 427-428
Space group: P 1 21/c 1
Cell volume: 3613.97
Cell parameters: 9.1764; 13.1644; 30.036; 90; 95.112; 90;  

COD ID: 1100274
CIF file Formula: - C28 H48 Ga2 O4 Si4 -
Comments: Uhl, W.; Prott, M.; Geiseler, G.; Harms, K. Gallium-Gallium Single Bonds Terminally Coordinated by Tropolonato Ligands Zeitschrift für Naturforschung B 57(2) (2002) 141-144
Space group: P 1 21/c 1
Cell volume: 1752.31
Cell parameters: 10.242; 13.28; 13.844; 90; 111.47; 90;  

COD ID: 1100294
CIF file Formula: - C42 H84 Li4 O8 S2 Si4 -
Comments: Hollstein, Werner; Harms, Klaus; Marsch, Michael; Boche, Gernot X-Ray Structure Analysis of the Li~2~-Compound of Bis(trimethylsilyl)metnyl Phenyl Sulfone; Structural Units of an α-Sulfonyl- and a Complex-Stabilizedortho-Sulfonyl-"Carbanion" Angewandte Chemie, International Edition in English 26(12) (1987) 1287-1288
Space group: P 1 21/c 1
Cell volume: 2786.42
Cell parameters: 11.195; 21.374; 12.619; 90; 112.66; 90;  

COD ID: 1100295
CIF file Formula: - C21 H19 Cr O5 P -
Comments: Dötz, Karl Heinz; Tiriliomis, Athanassios; Harms, Klaus; Regitz, Manfred; Annen, Ulrich Annelation of Carbene Ligands by λ^3^-Phosphaalkynes, an Entry to Functionalized Phosphaarenes Angewandte Chemie, International Edition in English 27(5) (1988) 713-714
Space group: P 1 21/c 1
Cell volume: 1964.71
Cell parameters: 10.334; 11.834; 16.445; 90; 102.33; 90;  

COD ID: 1100296
CIF file Formula: - C10 H16 Li N O -
Comments: Boche, Gernot; Harms, Klaus; Marsch, Michael X-ray structure determination of [1-cyano-2,.2-dimtheylcyclopropyllithium·tetrahydrofuran]~∞~: a tetrahedral anionic α-cyano carbon atom Journal of the American Chemical Society 110(20) (1988) 6925-6926
Space group: P 1 21/c 1
Cell volume: 2155.72
Cell parameters: 11.493; 9.567; 19.636; 90; 93.18; 90;  

COD ID: 1100298
CIF file Formula: - C17 H13 Cr N O6 -
Comments: Dötz, Karl Heinz; Erben, Hans-Georg; Staudacher, Wolfgang; Harms, Klaus; Müller, Gerhard; Riede, Jürgen Reaktionen von Komplexliganden: XXXIV. Tetracarbonyl-Carben-Chelatkomplexe des Chroms, Molybdäns und Wolframs Journal of Organometallic Chemistry 355(1-3) (1988) 177-191
Space group: P 1 21/c 1
Cell volume: 1693.45
Cell parameters: 9.786; 10.649; 16.435; 90; 98.6; 90;  

COD ID: 1100300
CIF file Formula: - C17 H25 Li N4 -
Comments: Buchholz, Stefan; Harms, Klaus; Marsch, Michael; Massa, Werner; Boche, Gernot Model of a Solvent-Shared Ion Pair with N‒H⋯C Hydrogen Bonds between Amine and Carbanion-Crystal Structure of [Fluorenyllithium·2 Ethylenediamine]~∞~ Angewandte Chemie, International Edition in English 28(1) (1989) 72-73
Space group: P 1 21/c 1
Cell volume: 1621.88
Cell parameters: 14.724; 8.561; 13.267; 90; 104.11; 90;  

COD ID: 1100317
CIF file Formula: - C16 H15 Cr N O4 -
Comments: Dötz, Karl Heinz; Schäfer, Thomas; Harms, Klaus Synthesis of Nitrogen Heterocycles by Diastereoselective Intramolecular Aminocarbene Annelation Angewandte Chemie, International Edition in English 29(2) (1990) 176-177
Space group: P 1 21/c 1
Cell volume: 3061.35
Cell parameters: 8.854; 13.399; 25.919; 90; 95.38; 90;  

COD ID: 1100320
CIF file Formula: - C9 H10 Cl4 O2 Sn -
Comments: Reetz, M. T.; Harms, K.; Reif, W. An X-ray structural analysis of a chiral α-alkoxy-ketone/SnCl~4~ chelate Tetrahedron Letters 29(46) (1988) 5881-5884
Space group: P 1 21/c 1
Cell volume: 2839.1
Cell parameters: 14.876; 13.72; 14.101; 90; 99.43; 90;  

COD ID: 1100322
CIF file Formula: - C19 H21 Cr O6 P -
Comments: Dötz, Karl Heinz; Tiriliomis, Athanassios; Harms, Klaus Synthesis of 1,3-oxaphospholes via chromium mediated cyclization of carbenes, carbon monoxide, and phospha-alkynes Journal of the Chemical Society, Chemical Communications (issue 12) (1989) 788-790
Space group: P 1 21/c 1
Cell volume: 2027.62
Cell parameters: 15.462; 6.78; 19.762; 90; 101.84; 90;  

COD ID: 1100323
CIF file Formula: - C15 H12 O4 S W -
Comments: Kneuper, Heinz-Josef; Zimmermann, Christoph; Harms, Klaus; Boche, Gernot Funktionalisierte Übergangsmetallalkyle, II. Synthese, Kristallstruktur und Reaktivität von (η~5~-C~5~H~5~)W(CO)~3~‒CH~2~‒S(O)‒C~6~H~5~, einem α-metallierten Sulfoxid Chemische Berichte 122(6) (1989) 1043-1047
Space group: P 1 21/c 1
Cell volume: 1505.3
Cell parameters: 10.093; 11.836; 13.157; 90; 106.72; 90;  

COD ID: 1100332
CIF file Formula: - C16 H31 Li N2 Si -
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/c 1
Cell volume: 1915.52
Cell parameters: 12.955; 9.721; 15.582; 90; 102.54; 90;  

COD ID: 1100337
CIF file Formula: - C14 H13 Mo N O5 -
Comments: Dötz, Karl Heinz; Larbig, Harald; Harms, Klaus Reaktionen von Komplexliganden, LI. Synthese und Reaktionen stabiler (Carben)tetracarbonyl-Chelatkomplexe des Molybdäns Chemische Berichte 125(9) (1992) 2143-2148
Space group: P 1 21/c 1
Cell volume: 1569.2
Cell parameters: 8.37; 15.438; 12.661; 90; 106.43; 90;  

COD ID: 1100346
CIF file Formula: - C8 H6 F6 O6 S2 -
Comments: Scheuplein, Stefan W.; Harms, Klaus; Brückner, Reinhard; Suffert, Jean Regiocontrol in Pd(0)-Mediated Couplings of a Bis(enol triflate) with Alkynes ‒ Stereoselective Syntheses of Monocyclic Dienediynes Related to the Neocarzinostatin Chromophore Chemische Berichte 125(1) (1992) 271-278
Space group: P 1 21/c 1
Cell volume: 1340.59
Cell parameters: 9.612; 14.335; 9.814; 90; 97.53; 90;  

COD ID: 1100350
CIF file Formula: - C36 H40 Cl3 N Na O9 Os P -
Comments: Buth, Silke; Harms, Klaus; Dehnicke, Kurt Synthese und Kristallstruktur des Nitrido-Oxalato-Osmats PPh~4~{Na(15-Krone-5)[OsNCl~3~(C~2~O~4~)]} Zeitschrift fuer Anorganische und Allgemeine Chemie 619(8) (1993) 1409-1413
Space group: P 1 21/c 1
Cell volume: 3962.23
Cell parameters: 19.314; 11.787; 17.641; 90; 99.39; 90;  

COD ID: 1100351
CIF file Formula: - C15 H14 Mo N2 O4 -
Comments: Dötz, Karl Heinz; Kroll, Friedrich; Harms, Klaus Reaktionen von Komplexliganden LVII. Amidinocarben-Chelatkomplexe des Chroms und Molybdäns: Synthese, Struktur und Cycloadditionen mit Alkinen Journal of Organometallic Chemistry 459(1-2) (1993) 169-176
Space group: P 1 21/c 1
Cell volume: 1707.61
Cell parameters: 8.456; 17.175; 12.34; 90; 107.67; 90;  

COD ID: 1100366
CIF file Formula: - C15 H19 Cr O5 P -
Comments: Dötz, K. H.; Tiriliomis, A.; Harms, K. Phosphahydroquinones and oxaphospholes via carbene annulation and cycloaddition reactions of chromium carbonyl carbene complexes and phosphaalkynes Tetrahedron 49(25) (1993) 5577-5597
Space group: P 1 21/c 1
Cell volume: 1636.11
Cell parameters: 13.098; 7.615; 17.463; 90; 110.06; 90;  

COD ID: 1100372
CIF file Formula: - C12 H17 N O5 S -
Comments: Boche, Gernot; Boie, Christiane; Bosold, Ferdinand; Harms, Klaus; Marsch, Michael [(N-Lithio-N-mesitylsulfonyloxy-tert-butylcarbamate)~2~·(thf)~3~]: Crystal Structure of a Nitrenoid Angewandte Chemie, International Edition in English 33(1) (1994) 115-117
Space group: P 1 21/c 1
Cell volume: 1453.37
Cell parameters: 9.37; 20.478; 8.103; 90; 110.81; 90;  

COD ID: 1100375
CIF file Formula: - C26 H52 Li2 N6 O4 -
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/c 1
Cell volume: 1682.86
Cell parameters: 9.058; 22.57; 8.392; 90; 101.22; 90;  

COD ID: 1100396
CIF file Formula: - C32 H36 Cr Mn2 O4 P2 -
Comments: Elschenbroich, Christoph; Isenburg, Thomas; Metz, Bernhard; Behrendt, Andreas; Harms, Klaus Metal π complexes of benzene derivatives: XLIII1. Intramolecular interactions between bis(benzene) chromium and cymantrene units in di- and tri-nuclear species containing PMe~2~ spacers, as studied by CV and EPR Journal of Organometallic Chemistry 481(2) (1994) 153-165
Space group: P 1 21/c 1
Cell volume: 1535.85
Cell parameters: 14.171; 8.407; 13.671; 90; 109.44; 90;  

COD ID: 1100408
CIF file Formula: - C6 H19 Cl4 I2 N P2 -
Comments: Grebe, J.; Harms, K.; Weller, F.; Dehnicke, K. Reaktionen silylierter Phosphanimine mit Iodmonochlorid und Iodtrichlorid. Die Kristallstrukturen von [Me~3~SiNPMe~3~ · ICl], [Ph~3~PNCl · ICl] und [Me~3~PN(H)PMe~3~] [ICl~2~]~2~ Zeitschrift fuer Anorganische und Allgemeine Chemie 621(9) (1995) 1489-1495
Space group: P 1 21/c 1
Cell volume: 1830.5
Cell parameters: 12.231; 10.902; 14.828; 90; 112.21; 90;  

COD ID: 1100433
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/c 1
Cell volume: 4457.89
Cell parameters: 12.232; 26.33; 14.157; 90; 102.12; 90;  

COD ID: 1100435
CIF file Formula: - C14 H20 Br2 N2 O2 S2 Zn2 -
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/c 1
Cell volume: 1028.77
Cell parameters: 9.485; 14.159; 8.078; 90; 108.504; 90;  

COD ID: 1100444
CIF file Formula: - C21 H24 N O3 P S Si -
Comments: Kunkel, F.; Harms, K.; Kang, H.-C.; Massa, W.; Dehnicke, K. Phosphaniminato-Komplexe des Schwefels. Kristallstrukturen von [S(NPEt~3~)~3~]Cl, [S(NPEt~3~)~2~]Cl~2~ und [Me~3~SiOSO~2~NPPh~3~] Zeitschrift fuer Anorganische und Allgemeine Chemie 623(1-6) (1997) 962-966
Space group: P 1 21/c 1
Cell volume: 2209.32
Cell parameters: 13.177; 8.48; 19.817; 90; 93.87; 90;  

COD ID: 1100445
CIF file Formula: - C18 H45 Cl N3 P3 S -
Comments: Kunkel, F.; Harms, K.; Kang, H.-C.; Massa, W.; Dehnicke, K. Phosphaniminato-Komplexe des Schwefels. Kristallstrukturen von [S(NPEt~3~)~3~]Cl, [S(NPEt~3~)~2~]Cl~2~ und [Me~3~SiOSO~2~NPPh~3~] Zeitschrift fuer Anorganische und Allgemeine Chemie 623(1-6) (1997) 962-966
Space group: P 1 21/c 1
Cell volume: 2672.3
Cell parameters: 10.854; 17.319; 15.111; 90; 109.82; 90;  

COD ID: 1100451
CIF file Formula: - C85 H73 B Cl3 F4 P4 Rh -
Comments: Breit, Bernhard; Winde, Roland; Harms, Klaus Phosphabenzene‒rhodium catalysts for the efficient hydroformylation of terminal and internal olefins Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999) (issue 18) (1997) 2681-2682
Space group: P 1 21/c 1
Cell volume: 7538.87
Cell parameters: 18.666; 19.977; 21.253; 90; 107.96; 90;  

COD ID: 1100457
CIF file Formula: - C14 H9 Cr N O6 -
Comments: ()
Space group: P 1 21/c 1
Cell volume: 2967.11
Cell parameters: 7.315; 23.991; 16.92; 90; 92.23; 90;  

COD ID: 1100459
CIF file Formula: - C18 H16 N P -
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/c 1
Cell volume: 1485.07
Cell parameters: 14.604; 9.289; 10.966; 90; 93.35; 90;  

COD ID: 1100467
CIF file Formula: - C25 H63 I N3 P3 Zn4 -
Comments: Krieger, Matthias; Gould, Robert O.; Harms, Klaus; Parsons, Simon; Dehnicke, Kurt Zinkorganische Phosphaniminato-Komplexe mit Heterocuban-Struktur Chemische Berichte 129(12) (1996) 1621-1625
Space group: P 1 21/c 1
Cell volume: 3973.84
Cell parameters: 12.4; 17.808; 18.723; 90; 106.02; 90;  

COD ID: 1100468
CIF file Formula: - C9 H12 Cl N3 O4 -
Comments: Boche, G.; Rangappa, K.; Harms, K.; Marsch, M. Crystal structure of 1-benzyl-3-methyl-1,2,3-triazolium Perchlorate, (C~6~H~5~)(N~3~C~3~H~7~)^+^ ClO~4~^-^ Zeitschrift für Kristallographie 211(8) (1996) 581-582
Space group: P 1 21/c 1
Cell volume: 1148.63
Cell parameters: 14.441; 5.973; 14.522; 90; 113.51; 90;  

COD ID: 1100469
CIF file Formula: - C16 H16 I N3 -
Comments: Boche, G.; Willeke, C.; Marsch, M.; Harms, K. Crystal structure of 1,3-dibenzyl-1,2,3-triazolium iodide, (C~6~H~5~CH~2~)~2~(C~2~H~2~N~3~)^+^I^-^ Zeitschrift für Kristallographie 211(8) (1996) 583-584
Space group: P 1 21/c 1
Cell volume: 3199.14
Cell parameters: 9.876; 11.023; 29.415; 90; 92.51; 90;  

COD ID: 1100471
CIF file Formula: - C9 H24 B F3 N P Si -
Comments: Möhlen, M.; Harms, K.; Dehnicke, K.; Magull, J.; Goesmann, H.; Fenske, D. Phosphanimin- und Phosphaniminato-Komplexe von Bor. Synthese und Kristallstrukturen von [BF~3~(Me~3~SiNPEt~3~)], [BCl~2~(NPPh~3~)]~2~, [BCl~2~(NPEt~3~)]~2~, [B~2~Cl~3~(NPEt~3~)~2~]^+^BCl~4~^-^ und [B~2~Cl~2~(NPiPr~3~)~3~]^+^BCl~4~^-^ Zeitschrift fuer Anorganische und Allgemeine Chemie 622(10) (1996) 1692-1700
Space group: P 1 21/c 1
Cell volume: 1492.33
Cell parameters: 13.61; 8.1956; 14.225; 90; 109.859; 90;  

COD ID: 1100472
CIF file Formula: - C38 H34 B2 Cl8 N2 P2 -
Comments: Möhlen, M.; Harms, K.; Dehnicke, K.; Magull, J.; Goesmann, H.; Fenske, D. Phosphanimin- und Phosphaniminato-Komplexe von Bor. Synthese und Kristallstrukturen von [BF~3~(Me~3~SiNPEt~3~)], [BCl~2~(NPPh~3~)]~2~, [BCl~2~(NPEt~3~)]~2~, [B~2~Cl~3~(NPEt~3~)~2~]^+^BCl~4~^-^ und [B~2~Cl~2~(NPiPr~3~)~3~]^+^BCl~4~^-^ Zeitschrift fuer Anorganische und Allgemeine Chemie 622(10) (1996) 1692-1700
Space group: P 1 21/c 1
Cell volume: 2068.6
Cell parameters: 11.846; 20.864; 8.43; 90; 96.86; 90;  

COD ID: 1100491
CIF file Formula: - C6 H18 As2 Cl4 N2 P2 -
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/c 1
Cell volume: 3345.92
Cell parameters: 10.689; 13.204; 23.792; 90; 94.85; 90;  

COD ID: 1100512
CIF file Formula: - C20 H58 Br5 Cl4 Co4 N12 P3 -
Comments: Riese, Ulrike; Faza, Naim; Massa, Werner; Harms, Klaus; Breyhan, Thees; Knochel, Paul; Ensling, Jürgen; Ksenofontov, Vadim; Gütlich, Philipp; Dehnicke, Kurt Phosphoraneiminato Complexes of Manganese and Cobalt with Heterocubane Structure Zeitschrift fuer Anorganische und Allgemeine Chemie 625(9) (1999) 1494-1499
Space group: P 1 21/c 1
Cell volume: 4750.33
Cell parameters: 12.1825; 16.2092; 24.0639; 90; 91.455; 90;  

COD ID: 1100514
CIF file Formula: - C36 H70 Cl8 Cu5 N2 O20 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/c 1
Cell volume: 12434.7
Cell parameters: 17.6118; 40.745; 17.3334; 90; 91.383; 90;  

COD ID: 1100531
CIF file Formula: - C16 H19 N O2 -
Comments: Bach, Thorsten; Pelkmann, Christa; Harms, Klaus Facial diastereoselectivity in the [2+2]-photocycloaddition of chiral vinylglycine-derived N,N-diallyl amines Tetrahedron Letters 40(11) (1999) 2103-2104
Space group: P 1 21/c 1
Cell volume: 1349.56
Cell parameters: 5.9874; 17.461; 12.965; 90; 95.339; 90;  

COD ID: 1100541
CIF file Formula: - C12 H15 Br F4 I2 N2 -
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/c 1
Cell volume: 1815.43
Cell parameters: 14.008; 16.699; 7.959; 90; 102.81; 90;  

COD ID: 1100564
CIF file Formula: - C27 H28 Cl4 P2 Pt -
Comments: Elschenbroich, Christoph; Voß, Steffen; Harms, Klaus Metal Complexes of Heteroarenes, X [1]. η^1^-Coordination of Phosphinine: Synthesis and Structure of cis-Dichloro-bis(2,6-dimethyl-4-phenyl-phosphinine)platinum Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences 54(2) (1999) 209-213
Space group: P 1 21/c 1
Cell volume: 2851.74
Cell parameters: 14.9985; 16.5396; 11.5064; 90; 92.466; 90;  

COD ID: 1100573
CIF file Formula: - C10 H30 Cl2 I2 N P Pt2 -
Comments: Krieger, Matthias; Schlecht, Sabine; Harms, Klaus; Dehnicke, Kurt Synthese und Kristallstrukturen der Phosphanimin-Komplexe [Cu(μ-HNPEt~3~)]~4~(O~3~S-CF~3~)~4~ und [Pt~2~Me~6~(μ-I)~2~(μ-HNPMe~3~)] Zeitschrift fuer Anorganische und Allgemeine Chemie 624(10) (1998) 1565-1567
Space group: P 1 21/c 1
Cell volume: 2121.47
Cell parameters: 10.0744; 8.818; 23.882; 90; 90.591; 90;  

COD ID: 1100586
CIF file Formula: - C49 H71 Br3 Mg2 O6 Zn -
Comments: Krieger, Matthias; Geiseler, Gertraud; Harms, Klaus; Merle, Jan; Massa, Werner; Dehnicke, Kurt Die Kristallstrukturen der Triarylzinkate [Mg~2~Br~3~(THF)~6~][ZnPh~3~] und [MgBr(THF)~5~][ZnMes~3~] Zeitschrift fuer Anorganische und Allgemeine Chemie 624(9) (1998) 1387-1388
Space group: P 1 21/c 1
Cell volume: 5173.08
Cell parameters: 18.388; 15.367; 18.609; 90; 100.33; 90;  

COD ID: 1100588
CIF file Formula: - C26 H38 S Sn -
Comments: Hoffmann, Reinhard W.; Koberstein, Ralf; Harms, Klaus Chiral organometallic reagents. Part XXIII. On the stereochemistry of the carbolithiation reaction of vinyl sulfides Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999) (issue 2) (1999) 183-192
Space group: P 1 21/c 1
Cell volume: 5037.56
Cell parameters: 10.667; 29.67; 15.9184; 90; 90.768; 90;  

COD ID: 1100604
CIF file Formula: - C23 H57 Cd4 I4 N4 O P3 Si -
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/c 1
Cell volume: 4638.5
Cell parameters: 20.111; 11.9913; 20.655; 90; 111.44; 90;  

COD ID: 1100606
CIF file Formula: - C35 H80 Cu Li2 N7 O2 -
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/c 1
Cell volume: 2241.8
Cell parameters: 9.1693; 14.9849; 16.6183; 90; 100.95; 90;  

COD ID: 1100607
CIF file Formula: - C18 H48 B3 I3 N3 P3 -
Comments: Möhlen, Michael; Neumüller, Bernhard; Harms, Klaus; Krautscheid, Harald; Fenske, Dieter; Diedenhofen, Michael; Frenking, Gernot; Dehnicke, Kurt Tri(phosphorano)borazinium-Ionen Zeitschrift fuer Anorganische und Allgemeine Chemie 624(7) (1998) 1105-1110
Space group: P 1 21/c 1
Cell volume: 6450.57
Cell parameters: 22.786; 19.874; 14.373; 90; 97.67; 90;  

COD ID: 1100608
CIF file Formula: - C18 H49 B3 I2 N3 P3 -
Comments: Möhlen, Michael; Neumüller, Bernhard; Harms, Klaus; Krautscheid, Harald; Fenske, Dieter; Diedenhofen, Michael; Frenking, Gernot; Dehnicke, Kurt Tri(phosphorano)borazinium-Ionen Zeitschrift fuer Anorganische und Allgemeine Chemie 624(7) (1998) 1105-1110
Space group: P 1 21/c 1
Cell volume: 3140.96
Cell parameters: 17.69; 7.9335; 22.382; 90; 90.671; 90;  

COD ID: 1100614
CIF file Formula: - C32 H52 Br4 N2 O5 Sm2 -
Comments: Kraut, S.; Magull, J.; Schaller, U.; Karl, M.; Harms, K.; Dehnicke, K. Amidoliganden zum Aufbau von mehrkernigen Lanthanoidkomplexen Zeitschrift fuer Anorganische und Allgemeine Chemie 624(7) (1998) 1193-1201
Space group: P 1 21/c 1
Cell volume: 3993.89
Cell parameters: 14.022; 17.683; 16.181; 90; 95.46; 90;  

COD ID: 1100617
CIF file Formula: - C32 H52 Br4 Gd2 N2 O5 -
Comments: Kraut, S.; Magull, J.; Schaller, U.; Karl, M.; Harms, K.; Dehnicke, K. Amidoliganden zum Aufbau von mehrkernigen Lanthanoidkomplexen Zeitschrift fuer Anorganische und Allgemeine Chemie 624(7) (1998) 1193-1201
Space group: P 1 21/c 1
Cell volume: 4007
Cell parameters: 14.042; 17.72; 16.159; 90; 94.74; 90;  

COD ID: 1100622
CIF file Formula: - C24 H30 As Cl N P -
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/c 1
Cell volume: 2325.87
Cell parameters: 10.202; 8.904; 25.621; 90; 92.06; 90;  

COD ID: 1100623
CIF file Formula: - C24 H30 As Br N P -
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/c 1
Cell volume: 2352.99
Cell parameters: 10.262; 8.929; 25.702; 90; 92.4; 90;  

COD ID: 1100625
CIF file Formula: - C38 H30 As2 Br5 N Sn -
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/c 1
Cell volume: 3847.36
Cell parameters: 9.676; 22.562; 17.987; 90; 101.54; 90;  

COD ID: 1100629
CIF file Formula: - C44 H96 Co4 N4 P4 Si4 -
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/c 1
Cell volume: 6400.9
Cell parameters: 10.9708; 26.193; 22.3454; 90; 94.55; 90;  

COD ID: 1100636
CIF file Formula: - C114 H114 N4 O2 P4 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/c 1
Cell volume: 4998.54
Cell parameters: 14.6903; 12.3408; 27.615; 90; 93.196; 90;  

COD ID: 1100640
CIF file Formula: - C24 H30 Cl N P2 -
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/c 1
Cell volume: 2287.87
Cell parameters: 10.035; 8.896; 25.643; 90; 91.94; 90;  

COD ID: 1100651
CIF file Formula: - C9 H6 F4 N2 -
Comments: Ryoichi, Nakagaki; Shigeru, Kohtani; Yuko, Nakamura; Michiyo, Okamura; Soh-ichi, Kitoh; Ko-Ki, Kunimoto Crystal Structure of 4-N,N-Dimethylamino-2,3,5,6-tetrafluorobenzonitrile Analytical Sciences: X-ray Structure Analysis Online 19 (2003) x5-x6
Space group: P 1 21/c 1
Cell volume: 933.2
Cell parameters: 4.373; 10.654; 20.05; 90; 92.92; 90;  

COD ID: 1100654
CIF file Formula: - C31 H44 F2 N8 O10 -
Comments: Yoon, I.; Park, K.-M.; Bark, K.-M.; Yang, M. S.; Lee, S. S. Crystal Structure of a Fluoroquinolone Antibiotic, Enoxacin Analytical Sciences: X-ray Structure Analysis Online 19 (2003) x11-x12
Space group: P 1 21/c 1
Cell volume: 3132.4
Cell parameters: 8.4053; 22.1236; 17.1548; 90; 100.903; 90;  

COD ID: 1100658
CIF file Formula: - C8 H11 Cl N2 O -
Comments: Doreswamy, Beeranahally H.; Basappa; Mahendra, Madegowda; Mantelingu, Kempegowda; Anandalwar, Sridhar M.; Prasad, Javaregowda S.; Rangappa, Kanchugarakoppal S. Microwave-Assisted Synthesis and Crystal Structure of 2-Butyl-4-chloro-1H-imidazole-5-carboxaldehyde Analytical Sciences: X-ray Structure Analysis Online 19 (2003) x31-x32
Space group: P 1 21/c 1
Cell volume: 920.62
Cell parameters: 7.251; 13.195; 9.835; 90; 101.94; 90;  

COD ID: 1100666
CIF file Formula: - C12 H10 O4 -
Comments: Mahendra, Madegowda; Doreswamy, Beeranahally H.; Sridhar, Mandayam A.; Prasad, Javaregowda S.; Narodia, Vishal P.; Naliapara, Yogesh T.; Shah, Anamik Crystal Structure of Ethyl-2H-1-benzopyran-2-oxo-3-carboxylate Analytical Sciences: X-ray Structure Analysis Online 19 (2003) x33-x34
Space group: P 1 21/c 1
Cell volume: 1034.4
Cell parameters: 7.916; 15.736; 8.737; 90; 108.11; 90;  

COD ID: 1100670
CIF file Formula: - C7 H9 N3 O3 S -
Comments: Miao, Qian; Jin, Zhi-Min; Xiong, Jing; Hu, Mao-Lin Crystal Structure of 4-(2-Aminothiazol-4-yl)-4-(hydroxyimino)acetic ester Analytical Sciences: X-ray Structure Analysis Online 19 (2003) x41-x42
Space group: P 1 21/c 1
Cell volume: 971.7
Cell parameters: 10.2822; 10.9006; 8.8072; 90; 100.148; 90;  

COD ID: 1100677
CIF file Formula: - C15 H13 N3 -
Comments: Mahendra, M.; Doreswamy, B. H.; Adlakha, Priti; Raval, Kena; Varu, Bharat; Shah, Anamik; Sridhar, M. A.; Prasad, J. S. Synthesis and Crystal Structure of 3,5-dicyano-2,6-dimethyl-4-phenyl-1,4-dihydropyridine Analytical Sciences: X-ray Structure Analysis Online 19 (2003) x55-x56
Space group: P 1 21/c 1
Cell volume: 1285.5
Cell parameters: 8.722; 11.42; 13.307; 90; 104.101; 90;  

COD ID: 1100678
CIF file Formula: - C20 H21 Cl4 Cu2 N5 S2 -
Comments: ()
Space group: P 1 21/c 1
Cell volume: 2554.4
Cell parameters: 14.363; 11.881; 15.71; 90; 107.664; 90;  

COD ID: 1100696
CIF file Formula: - C12 H12 Cu I N2 S -
Comments: ()
Space group: P 1 21/c 1
Cell volume: 1341.5
Cell parameters: 8.0239; 18.7101; 9.516; 90; 110.112; 90;  

COD ID: 1100701
CIF file Formula: - C24 H24 Ag2 N6 O6 S2 -
Comments: ()
Space group: P 1 21/c 1
Cell volume: 2800.9
Cell parameters: 13.277; 15.822; 14.031; 90; 108.144; 90;  

COD ID: 1100720
CIF file Formula: - C340.43 H348.62 B8 Cu8 N36.22 O20 -
Comments: Aaron M. Appel; Rachel Newell; Daniel L. DuBois; M. Rakowski DuBois Concentration of Carbon Dioxide by Electrochemically Modulated Complexation with a Binuclear Copper Complex Inorganic Chemistry 44 (2005) 3046-3056
Space group: P 1 21/c 1
Cell volume: 7595.9
Cell parameters: 9.4708; 25.913; 31.6182; 90; 101.79; 90;  

COD ID: 1100724
CIF file Formula: - C36 H30 N4 O3 -
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/c 1
Cell volume: 2899.5
Cell parameters: 9.5809; 18.196; 17.263; 90; 105.54; 90;  

COD ID: 1100726
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/c 1
Cell volume: 3168.3
Cell parameters: 17.124; 11.727; 16.249; 90; 103.84; 90;  

COD ID: 1100727
CIF file Formula: - C33 H24 Br2 Cl2 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/c 1
Cell volume: 3258.2
Cell parameters: 17.239; 11.94; 16.268; 90; 103.34; 90;  

COD ID: 1100730
CIF file Formula: - C33 H25.2 Cl2.8 Hg0.95 N4 O2.6 -
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/c 1
Cell volume: 3168.8
Cell parameters: 18.204; 10.865; 16.03; 90; 91.91; 90;  

COD ID: 1100731
CIF file Formula: - C33 H22 Br2 Cl2 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/c 1
Cell volume: 3303.9
Cell parameters: 18.187; 11.165; 16.286; 90; 92.5; 90;  

COD ID: 1100732
CIF file Formula: - C32.5 H24 Br3 Hg1.5 N4 O2.5 -
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/c 1
Cell volume: 3254.6
Cell parameters: 16.652; 12.318; 16.223; 90; 102.03; 90;  

COD ID: 1100741
CIF file Formula: - C58 H45 N3 Ni O4 P2 S4 -
Comments: Stéphane A. Baudron; Narcis Avarvari; Patrick Batail A Straightforward Synthesis of Diverse Nickel Dithiolene Complexes Appended with Hydrogen-Bond Donor/Acceptor Groups Inorganic Chemistry 44 (2005) 3380-3382
Space group: P 1 21/c 1
Cell volume: 5249.9
Cell parameters: 13.0034; 18.3544; 22.048; 90; 93.924; 90;  

COD ID: 1100758
CIF file Formula: - C109 H152.5 Fe3 N10.5 O10 -
Comments: Panagiotis Angaridis; Jeff W. Kampf; Vincent L. Pecoraro Multinuclear Fe(III) Complexes with Polydentate Ligands of the Family of Dicarboxyimidazoles: Nuclearity- and Topology-Controlled Syntheses and Magneto-Structural Correlations Inorganic Chemistry 44 (2005) 3626-3635
Space group: P 1 21/c 1
Cell volume: 10995
Cell parameters: 26.567; 15.983; 26.753; 90; 104.552; 90;  

COD ID: 1100764
CIF file Formula: - C60 H92 B4 N24 S8 Zn4 -
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/c 1
Cell volume: 1994
Cell parameters: 10.1; 13.8; 14.71; 90; 103.45; 90;  

COD ID: 1100773
CIF file Formula: - C53 H27 Cr F15 N5 -
Comments: Nicola Y. Edwards; Rebecca A. Eikey; Megan I. Loring; Mahdi M. Abu-Omar High-Valent Imido Complexes of Manganese and Chromium Corroles Inorganic Chemistry 44 (2005) 3700-3708
Space group: P 1 21/c 1
Cell volume: 4451.3
Cell parameters: 14.9131; 12.6146; 24.0113; 90; 99.792; 90;  

COD ID: 1100776
CIF file Formula: - C25.75 H30 N O0.25 Tl -
Comments: Robert J. Wright; Marcin Brynda; Philip P. Power A Monomeric Thallium(I) Amide in the Solid State: Synthesis and Structure of TlN(Me)Ar^Mes~2~^ (Ar^Mes~2~^= C~6~H~3~-2,6-Mes~2~) Inorganic Chemistry 44 (2005) 3368-3370
Space group: P 1 21/c 1
Cell volume: 4465.9
Cell parameters: 14.0469; 23.9451; 14.2106; 90; 110.88; 90;  

COD ID: 1100780
CIF file Formula: - C56 H78 N4 -
Comments: Chizu Shimokawa; Shinobu Itoh The First β-Diketiminate-Ag(I) Complexes. Macrocyclic Dinuclear and Tetranuclear Ag(I)-Complexes and Linear Coordination Polymer Ag(I)-Complex Inorganic Chemistry 44 (2005) 3010-3012
Space group: P 1 21/c 1
Cell volume: 2498.1
Cell parameters: 11.824; 10.358; 21.483; 90; 108.296; 90;  

COD ID: 1100799
CIF file Formula: - C33 H49 N3 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/c 1
Cell volume: 3276.4
Cell parameters: 11.119; 19.43; 15.805; 90; 106.355; 90;  

COD ID: 1100814
CIF file Formula: - C43 H46 B Cl3 O3 Ru2 -
Comments: Soleimannejad, Janet; White, Colin A Convenient One-Pot Synthesis of a Functionalized-Arene Ruthenium Half-Sandwich Compound [RuCl~2~(η^6^-C~6~H~5~OCH~2~CH~2~OH)]~2~ Organometallics 24(10) () 2538-2541
Space group: P 1 21/c 1
Cell volume: 4002.7
Cell parameters: 10.0185; 17.18; 23.544; 90; 98.977; 90;  

COD ID: 1100817
CIF file Formula: - C46 H46 N Ni O P -
Comments: Li, Xiao-Fang; Li, Yang-Guo; Li, Yue-Sheng; Chen, Yan-Xiang; Hu, Ning-Hai Copolymerization of Ethylene with Methyl Methacrylate with Neutral Nickel(II) Complexes Bearing β-Ketoiminato Chelate Ligands Organometallics 24(10) (2005) 2502-2510
Space group: P 1 21/c 1
Cell volume: 3897.5
Cell parameters: 10.782; 38.013; 10.424; 90; 114.18; 90;  

COD ID: 1100818
CIF file Formula: - C41 H41 F3 N Ni O P -
Comments: Li, Xiao-Fang; Li, Yang-Guo; Li, Yue-Sheng; Chen, Yan-Xiang; Hu, Ning-Hai Copolymerization of Ethylene with Methyl Methacrylate with Neutral Nickel(II) Complexes Bearing β-Ketoiminato Chelate Ligands Organometallics 24(10) (2005) 2502-2510
Space group: P 1 21/c 1
Cell volume: 3666
Cell parameters: 9.299; 21.609; 18.37; 90; 96.7; 90;  

COD ID: 1100830
CIF file Formula: - C28 H26 Au Cl2 P -
Comments: Schuster, Oliver; Schmidbaur, Hubert Preparative Routes to the First Tri- and Tetra(alkynyl)gold(III) Compounds: (L)Au(C⋮CR) <sub>3</sub> and [ER <sub>4</sub> ] <sup>+</sup> [Au(C⋮CR) <sub>4</sub> ] <sup>-</sup> Organometallics 24(10) (2005) 2289-2296
Space group: P 1 21/c 1
Cell volume: 2657.65
Cell parameters: 13.1163; 16.2269; 14.1022; 90; 117.693; 90;  

COD ID: 1100852
CIF file Formula: - C20 H33 B6 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/c 1
Cell volume: 2531.6
Cell parameters: 9.066; 32.7224; 9.1682; 90; 111.444; 90;  

COD ID: 1100853
CIF file Formula: - C21 H42 B6 Cl4 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/c 1
Cell volume: 2945.3
Cell parameters: 14.5799; 11.3893; 17.7889; 90; 94.371; 90;  

COD ID: 1100856
CIF file Formula: - C20 H21 Fe N O2 -
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/c 1
Cell volume: 1788.5
Cell parameters: 9.3991; 19.964; 10.132; 90; 109.83; 90;  

COD ID: 1100857
CIF file Formula: - C36 H38 Fe4 N2 O4 -
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/c 1
Cell volume: 3292.8
Cell parameters: 12.735; 27.48; 10.206; 90; 112.8; 90;  

COD ID: 1100864
CIF file Formula: - C30 H48 Au2 Cl2 N4 -
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/c 1
Cell volume: 3201.8
Cell parameters: 9.557; 19.4416; 17.6956; 90; 103.144; 90;  

COD ID: 1100865
CIF file Formula: - C23 H32 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/c 1
Cell volume: 2059.76
Cell parameters: 14.5735; 11.7626; 12.9098; 90; 111.449; 90;  

COD ID: 1100870
CIF file Formula: - C32 H26 B F4 Mn O5 P2 -
Comments: Ruiz, J.; Quesada, R.; Vivanco, M.; Castellano, E. E.; Piro, O. E. Stepwise Formation of σ-Alkynyl, Vinylidene, and Vinylphosphonium Complexes of Manganese(I) Organometallics 24(10) (2005) 2542-2545
Space group: P 1 21/c 1
Cell volume: 3118
Cell parameters: 10.2407; 16.6566; 18.3683; 90; 95.65; 90;  

COD ID: 1100887
CIF file Formula: - C26 H18 Fe -
Comments: Cuffe, Laurence; Hudson, Richard D. A.; Gallagher, John F.; Jennings, Sarah; McAdam, C. John; Connelly, Rosamond B. T.; Manning, Anthony R.; Robinson, Brian. H.; Simpson, Jim Synthesis, Structure, and Redox Chemistry of Ethenyl and Ethynyl Ferrocene Polyaromatic Dyads Organometallics 24(9) (2005) 2051-2060
Space group: P 1 21/c 1
Cell volume: 1791.2
Cell parameters: 7.265; 11.059; 22.303; 90; 91.824; 90;  

COD ID: 1100889
CIF file Formula: - C32 H20 Fe -
Comments: Cuffe, Laurence; Hudson, Richard D. A.; Gallagher, John F.; Jennings, Sarah; McAdam, C. John; Connelly, Rosamond B. T.; Manning, Anthony R.; Robinson, Brian. H.; Simpson, Jim Synthesis, Structure, and Redox Chemistry of Ethenyl and Ethynyl Ferrocene Polyaromatic Dyads Organometallics 24(9) (2005) 2051-2060
Space group: P 1 21/c 1
Cell volume: 2105.8
Cell parameters: 11.421; 10.868; 17.2066; 90; 99.609; 90;  

COD ID: 1100891
CIF file Formula: - C28 H20 Fe -
Comments: Cuffe, Laurence; Hudson, Richard D. A.; Gallagher, John F.; Jennings, Sarah; McAdam, C. John; Connelly, Rosamond B. T.; Manning, Anthony R.; Robinson, Brian. H.; Simpson, Jim Synthesis, Structure, and Redox Chemistry of Ethenyl and Ethynyl Ferrocene Polyaromatic Dyads Organometallics 24(9) (2005) 2051-2060
Space group: P 1 21/c 1
Cell volume: 1966
Cell parameters: 19.12; 7.379; 14.89; 90; 110.62; 90;  

COD ID: 1100892
CIF file Formula: - C32 H8 F20 O0.18 P2 -
Comments: Chase, Preston A.; Gagliardo, Marcella; Lutz, Martin; Spek, Anthony L.; van Klink, Gerard P. M.; van Koten, Gerard Electron-Poor Pentafluorophenyl-Substituted PCP‒Palladium Pincer Complexes Organometallics 24(9) (2005) 2016-2019
Space group: P 1 21/c 1
Cell volume: 3031.6
Cell parameters: 6.0387; 32.3369; 15.9373; 90; 103.062; 90;  

COD ID: 1100893
CIF file Formula: - C34 H10 B F24 N P2 Pd -
Comments: Chase, Preston A.; Gagliardo, Marcella; Lutz, Martin; Spek, Anthony L.; van Klink, Gerard P. M.; van Koten, Gerard Electron-Poor Pentafluorophenyl-Substituted PCP‒Palladium Pincer Complexes Organometallics 24(9) (2005) 2016-2019
Space group: P 1 21/c 1
Cell volume: 3948.77
Cell parameters: 10.1565; 25.6619; 16.1795; 90; 110.544; 90;  

COD ID: 1100894
CIF file Formula: - C46.7 H23.8 Cl F20 P2 Pd -
Comments: Chase, Preston A.; Gagliardo, Marcella; Lutz, Martin; Spek, Anthony L.; van Klink, Gerard P. M.; van Koten, Gerard Electron-Poor Pentafluorophenyl-Substituted PCP‒Palladium Pincer Complexes Organometallics 24(9) (2005) 2016-2019
Space group: P 1 21/c 1
Cell volume: 4637.39
Cell parameters: 15.4853; 13.6515; 26.0274; 90; 122.559; 90;  

COD ID: 1100903
CIF file Formula: - C20 H36 Cl2 N2 P V -
Comments: Yamada, Junji; Fujiki, Michiya; Nomura, Kotohiro A Vanadium(V) Alkylidene Complex Exhibiting Remarkable Catalytic Activity for Ring-Opening Metathesis Polymerization (ROMP) Organometallics 24(10) (2005) 2248-2250
Space group: P 1 21/c 1
Cell volume: 2521.9
Cell parameters: 9.838; 12.565; 20.509; 90; 95.857; 90;  

COD ID: 1100962
CIF file Formula: - C35 H35 Cl 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/c 1
Cell volume: 3029.5
Cell parameters: 12.114; 13.1394; 19.0367; 90; 91.137; 90;  

COD ID: 1100970
CIF file Formula: - C7 H15 N O5 Sn -
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/c 1
Cell volume: 1065.31
Cell parameters: 10.6103; 6.7816; 15.501; 90; 107.231; 90;  

COD ID: 1100989
CIF file Formula: - C3 H8 N2 O -
Comments: Hashimoto, Masao; Tajima, Fukue; Eda, Kazuo; Yamamura, Kimiaki; Okazaki, Tadashi Exploration of plastic-like phases in alkylurea systems. A thermal and X-ray study Journal of Molecular Structure 734(1-3) (2005) 23-33
Space group: P 1 21/c 1
Cell volume: 508.4
Cell parameters: 8.315; 7.046; 9.099; 90; 107.483; 90;  

COD ID: 1100992
CIF file Formula: - C5 H12 N2 O -
Comments: Hashimoto, Masao; Tajima, Fukue; Eda, Kazuo; Yamamura, Kimiaki; Okazaki, Tadashi Exploration of plastic-like phases in alkylurea systems. A thermal and X-ray study Journal of Molecular Structure 734(1-3) (2005) 23-33
Space group: P 1 21/c 1
Cell volume: 689.5
Cell parameters: 4.6629; 5.7364; 25.863; 90; 94.627; 90;  

COD ID: 1100995
CIF file Formula: - C6 H14 N2 O -
Comments: Hashimoto, Masao; Tajima, Fukue; Eda, Kazuo; Yamamura, Kimiaki; Okazaki, Tadashi Exploration of plastic-like phases in alkylurea systems. A thermal and X-ray study Journal of Molecular Structure 734(1-3) (2005) 23-33
Space group: P 1 21/c 1
Cell volume: 813.9
Cell parameters: 13.026; 7.2083; 9.277; 90; 110.861; 90;  

COD ID: 1100996
CIF file Formula: - C7 H16 N2 O -
Comments: Hashimoto, Masao; Tajima, Fukue; Eda, Kazuo; Yamamura, Kimiaki; Okazaki, Tadashi Exploration of plastic-like phases in alkylurea systems. A thermal and X-ray study Journal of Molecular Structure 734(1-3) (2005) 23-33
Space group: P 1 21/c 1
Cell volume: 894.4
Cell parameters: 12.976; 7.4298; 9.287; 90; 92.73; 90;  

COD ID: 1100998
CIF file Formula: - C8 H18 N2 O -
Comments: Hashimoto, Masao; Tajima, Fukue; Eda, Kazuo; Yamamura, Kimiaki; Okazaki, Tadashi Exploration of plastic-like phases in alkylurea systems. A thermal and X-ray study Journal of Molecular Structure 734(1-3) (2005) 23-33
Space group: P 1 21/c 1
Cell volume: 987.1
Cell parameters: 14.407; 7.529; 9.318; 90; 102.426; 90;  

COD ID: 1101000
CIF file Formula: - C9 H20 N2 O -
Comments: Hashimoto, Masao; Tajima, Fukue; Eda, Kazuo; Yamamura, Kimiaki; Okazaki, Tadashi Exploration of plastic-like phases in alkylurea systems. A thermal and X-ray study Journal of Molecular Structure 734(1-3) (2005) 23-33
Space group: P 1 21/c 1
Cell volume: 1154
Cell parameters: 16.407; 7.558; 9.321; 90; 93.17; 90;  

COD ID: 1101002
CIF file Formula: - C10 H22 N2 O -
Comments: Hashimoto, Masao; Tajima, Fukue; Eda, Kazuo; Yamamura, Kimiaki; Okazaki, Tadashi Exploration of plastic-like phases in alkylurea systems. A thermal and X-ray study Journal of Molecular Structure 734(1-3) (2005) 23-33
Space group: P 1 21/c 1
Cell volume: 1193.7
Cell parameters: 17.774; 7.4623; 9.264; 90; 103.726; 90;  

COD ID: 1101004
CIF file Formula: - C11 H24 N2 O -
Comments: Hashimoto, Masao; Tajima, Fukue; Eda, Kazuo; Yamamura, Kimiaki; Okazaki, Tadashi Exploration of plastic-like phases in alkylurea systems. A thermal and X-ray study Journal of Molecular Structure 734(1-3) (2005) 23-33
Space group: P 1 21/c 1
Cell volume: 1280.5
Cell parameters: 18.336; 7.5383; 9.2943; 90; 94.584; 90;  

COD ID: 1101005
CIF file Formula: - C11 H24 N2 O -
Comments: Hashimoto, Masao; Tajima, Fukue; Eda, Kazuo; Yamamura, Kimiaki; Okazaki, Tadashi Exploration of plastic-like phases in alkylurea systems. A thermal and X-ray study Journal of Molecular Structure 734(1-3) (2005) 23-33
Space group: P 1 21/c 1
Cell volume: 1248.5
Cell parameters: 18.007; 7.5233; 9.2731; 90; 96.371; 90;  

COD ID: 1101007
CIF file Formula: - C12 H26 N2 O -
Comments: Hashimoto, Masao; Tajima, Fukue; Eda, Kazuo; Yamamura, Kimiaki; Okazaki, Tadashi Exploration of plastic-like phases in alkylurea systems. A thermal and X-ray study Journal of Molecular Structure 734(1-3) (2005) 23-33
Space group: P 1 21/c 1
Cell volume: 1379.3
Cell parameters: 19.617; 7.5941; 9.3394; 90; 97.54; 90;  

COD ID: 1101009
CIF file Formula: - C13 H28 N2 O -
Comments: Hashimoto, Masao; Tajima, Fukue; Eda, Kazuo; Yamamura, Kimiaki; Okazaki, Tadashi Exploration of plastic-like phases in alkylurea systems. A thermal and X-ray study Journal of Molecular Structure 734(1-3) (2005) 23-33
Space group: P 1 21/c 1
Cell volume: 1423.8
Cell parameters: 21.1; 7.364; 9.2; 90; 95.085; 90;  

COD ID: 1101010
CIF file Formula: - C14 H30 N2 O -
Comments: Hashimoto, Masao; Tajima, Fukue; Eda, Kazuo; Yamamura, Kimiaki; Okazaki, Tadashi Exploration of plastic-like phases in alkylurea systems. A thermal and X-ray study Journal of Molecular Structure 734(1-3) (2005) 23-33
Space group: P 1 21/c 1
Cell volume: 1598.3
Cell parameters: 23.124; 7.542; 9.299; 90; 99.751; 90;  

COD ID: 1101011
CIF file Formula: - C14 H30 N2 O -
Comments: Hashimoto, Masao; Tajima, Fukue; Eda, Kazuo; Yamamura, Kimiaki; Okazaki, Tadashi Exploration of plastic-like phases in alkylurea systems. A thermal and X-ray study Journal of Molecular Structure 734(1-3) (2005) 23-33
Space group: P 1 21/c 1
Cell volume: 1562.8
Cell parameters: 22.936; 7.4127; 9.314; 90; 99.29; 90;  

COD ID: 1101012
CIF file Formula: - C14 H30 N2 O -
Comments: Hashimoto, Masao; Tajima, Fukue; Eda, Kazuo; Yamamura, Kimiaki; Okazaki, Tadashi Exploration of plastic-like phases in alkylurea systems. A thermal and X-ray study Journal of Molecular Structure 734(1-3) (2005) 23-33
Space group: P 1 21/c 1
Cell volume: 1512.7
Cell parameters: 21.986; 7.405; 9.313; 90; 93.909; 90;  

COD ID: 1101013
CIF file Formula: - C15 H32 N2 O -
Comments: Hashimoto, Masao; Tajima, Fukue; Eda, Kazuo; Yamamura, Kimiaki; Okazaki, Tadashi Exploration of plastic-like phases in alkylurea systems. A thermal and X-ray study Journal of Molecular Structure 734(1-3) (2005) 23-33
Space group: P 1 21/c 1
Cell volume: 1675.4
Cell parameters: 23.601; 7.639; 9.326; 90; 94.882; 90;  

COD ID: 1101014
CIF file Formula: - C15 H32 N2 O -
Comments: Hashimoto, Masao; Tajima, Fukue; Eda, Kazuo; Yamamura, Kimiaki; Okazaki, Tadashi Exploration of plastic-like phases in alkylurea systems. A thermal and X-ray study Journal of Molecular Structure 734(1-3) (2005) 23-33
Space group: P 1 21/c 1
Cell volume: 1610.8
Cell parameters: 23.257; 7.4723; 9.269; 90; 90.332; 90;  

COD ID: 1101058
CIF file Formula: - C10 H8 Ag2 N10 O8 -
Comments: Mohammad Abul Haj; Miguel Quirós; Juan M. Salas; René Faure Silver complexes with triazolopyrimidine ligands containing an exocyclic oxygen atom: X-ray evidence for an unusual tautomeric form. Dalton Transactions (2001) 1798-1801
Space group: P 1 21/c 1
Cell volume: 848.04
Cell parameters: 5.3881; 18.245; 8.71; 90; 97.946; 90;  

COD ID: 1101067
CIF file Formula: - C4 H11 N3 O3 -
Comments: Mendel, H.; Hodgkin, D. C. The crystal structure of creatine monohydrate Acta Crystallographica 7(5) (1954) 443-446
Space group: P 1 21/c 1
Cell volume: 720.031
Cell parameters: 12.5; 5.01; 12.16; 90; 109; 90;  

COD ID: 1101069
CIF file Formula: - C4 H11 N3 O3 -
Comments: Y.Kato; Y.Haimoto; K.Sakurai Bull.Chem.Soc.Jpn. 52 (1979) 233
Space group: P 1 21/c 1
Cell volume: 728.36
Cell parameters: 12.51; 5.048; 12.191; 90; 108.9; 90;  

COD ID: 1101070
CIF file Formula: - C4 H11 N3 O3 -
Comments: C.S.Frampton; C.C.Wilson; N.Shankland; A.J.Florence J.Chem.Soc.,Faraday Trans. 93 (1997) 1875
Space group: P 1 21/c 1
Cell volume: 706.574
Cell parameters: 12.492; 4.967; 12.051; 90; 109.1; 90;  

COD ID: 1101071
CIF file Formula: - C4 H11 N3 O3 -
Comments: Frampton, Christopher S.; Wilson, Chick C.; Shankland, Norman; Florence, Alastair J. Single-crystal neutron refinement of creatine monohydrate at 20 K and 123 K Journal of the Chemical Society, Faraday Transactions 93(10) (1997) 1875-1879
Space group: P 1 21/c 1
Cell volume: 711.686
Cell parameters: 12.489; 4.987; 12.075; 90; 108.86; 90;  

COD ID: 1101074
CIF file Formula: - C34 H34 Cu2 N14 O14 -
Comments: Mohammad Abul Haj; Miguel Quirós; Juan M. Salas; José A. Dobado; José Molina Molina; Manuel G. Basallote; M. Ángeles Máñez European Journal of Inorganic Chemistry (2002) 811-818
Space group: P 1 21/c 1
Cell volume: 3994.5
Cell parameters: 11.9565; 14.422; 23.888; 90; 104.132; 90;  

COD ID: 1101079
CIF file Formula: - Na6 O19 Si8 -
Comments: Kruger, Hannes; Kahlenberg, Volker; Kaindl, R. Structural studies on Na6Si8O19 - a monophyllosilicate with a new type of layered silicate anion Solid State Sciences 7 (2005) 1390-1396
Space group: P 1 21/c 1
Cell volume: 1772.3
Cell parameters: 4.9038; 23.481; 15.392; 90; 90.14; 90;  

COD ID: 1101094
CIF file Formula: - B Cl2 Co F4 H18 N6 -
Comments: Raj Pal Sharma; Ritu Bala; Rajni Sharma; Paloth Venugopalan; Juan M. Salas; Miguel Quirós Second sphere coordination in anion binding: Synthesis, spectroscopic characterization and single crystal X-ray structure determination of hexaamminecobalt(III) dichloride tetrafluoroborate Journal of Fluorine Chemistry 126 (2005) 1543-1548
Space group: P 1 21/c 1
Cell volume: 1149.92
Cell parameters: 13.4973; 7.4289; 12.1669; 90; 109.511; 90;  

COD ID: 1101095
CIF file Formula: - C8 H11 Cu N7 O5 -
Comments: Francisco Hueso-Ureña; Antonio L. Peñas-Chamorro; Miguel N. Moreno-Carretero; Miguel Quirós; Juan M. Salas Synthesis, spectral and XRD studies on three O-nitrito-complexes with new N,N,O-tridentate Schiff bases derived from 6-amino-5-formyl-1,3-dimethyluracil and semicarbazide, acetylhydrazine and benzoylhydrazine Polyhedron 18 (1999) 351-360
Space group: P 1 21/c 1
Cell volume: 1239
Cell parameters: 6.9193; 11.8361; 15.259; 90; 97.482; 90;  

COD ID: 1101096
CIF file Formula: - C9 H14 Cu N6 O6 -
Comments: Francisco Hueso-Ureña; Antonio L. Peñas-Chamorro; Miguel N. Moreno-Carretero; Miguel Quirós; Juan M. Salas Synthesis, spectral and XRD studies on three O-nitrito-complexes with new N,N,O-tridentate Schiff bases derived from 6-amino-5-formyl-1,3-dimethyluracil and semicarbazide, acetylhydrazine and benzoylhydrazine Polyhedron 18 (1999) 351-360
Space group: P 1 21/c 1
Cell volume: 1382.2
Cell parameters: 5.291; 12.0171; 21.792; 90; 93.981; 90;  

COD ID: 1101106
CIF file Formula: - C14 H16 N6 O6 Zn -
Comments: Francisco Hueso-Ureña; Antonio L. Peñas-Chamorro; Miguel N. Moreno-Carretero; Miguel Quirós; Juan M. Salas Synthesis, spectral and XRD studies on three O-nitrito-complexes with new N,N,O-tridentate Schiff bases derived from 6-amino-5-formyl-1,3-dimethyluracil and semicarbazide, acetylhydrazine and benzoylhydrazine Polyhedron 18 (1999) 351-360
Space group: P 1 21/c 1
Cell volume: 1715.9
Cell parameters: 7.3518; 21.308; 11.0976; 90; 99.245; 90;  

COD ID: 1101109
CIF file Formula: - C44 H39 Cu2 F12 N8 O4.5 P2 -
Comments: José M. Seco; Miguel Quirós; María J. González Garmendia Synthesis, X-ray crystal structure and spectroscopic, magnetic and EPR studies of copper(II) dimers with methoxy-di-(2-pyridyl)methoxide as bridging ligand Polyhedron 19 (2000) 1005-1013
Space group: P 1 21/c 1
Cell volume: 9773.1
Cell parameters: 25.197; 14.495; 29.659; 90; 115.55; 90;  

COD ID: 1101114
CIF file Formula: - C56 H48 Cu2 I2 N4 -
Comments: Kia, Reza; Mirkhani, Valiollah; Harkema, Sybolt; van Hummel, Gerrit J. Synthesis and characterization of the 1:1 adducts of copper(I) halides with bidentate N,N'-bis(benzophenone)-1,2-diiminoethane Schiff base: Crystal structures of [Cu(bz2en)2][CuX2] (X = Br, I) complexes Inorganica Chimica Acta 360(10) (2007) 3369-3375
Space group: P 1 21/c 1
Cell volume: 5007.6
Cell parameters: 12.28; 27.44; 15.13; 90; 100.82; 90;  

COD ID: 1101116
CIF file Formula: - Al Ca F5 -
Comments: Body, M.; Silly, G.; Legein, C.; Buzaré, J.-Y.; Calvayrac, F.; Blaha, P. Structural investigations of β-CaAlF5 by coupling powder XRD, NMR, EPR and spectroscopic parameter calculations Journal of Solid State Chemistry 178(12) (2005) 3655-3643
Space group: P 1 21/c 1
Cell volume: 361.4
Cell parameters: 5.3361; 9.8298; 7.3271; 90; 109.911; 90;  

COD ID: 1101117
CIF file Formula: - C20 H24 Cd N10 O10 -
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/c 1
Cell volume: 1309.62
Cell parameters: 8.5689; 18.5279; 8.6209; 90; 106.894; 90;  

COD ID: 1101125
CIF file Formula: - C20 H32 Cl2 Cu N8 O16 -
Comments: Francisco Hueso-Ureña; Sonia B. Jiménez-Pulido; Miguel N. Moreno-Carretero; Miguel Quirós; Juan M. Salas Synthesis and structural studies on three-dimensionally hydrogen-bonded metal perchlorate complexes with 1,3-dimethyllumazine and 1,3,6,7-tetramethyllumazine. Crystal structure of diaqua-bis(1,3,6,7-tetramethyl- pteridine-2,4(1H,3H)-dione-O^4^,N^5^) copper(II) perchlorate dihydrate. Inorganica Chimica Acta 268 (1998) 77-83
Space group: P 1 21/c 1
Cell volume: 1606.9
Cell parameters: 8.7639; 13.7932; 14.7922; 90; 116.016; 90;  

COD ID: 1101135
CIF file Formula: - C22 H26 N14 O9 Pd Pt -
Comments: Jorge A. R. Navarro; M. Angustias Romero; Juan M. Salas; Miguel Quirós Kinetically and thermodynamically controlled formation of homo- and heterobinuclear platinum(II) and palladium(II) complexes supported by bidentate triazolopyrimidine ligands Inorganic Chemistry 36 (1997) 3277-3283
Space group: P 1 21/c 1
Cell volume: 2929.5
Cell parameters: 13.752; 12.5658; 19.215; 90; 118.08; 90;  

COD ID: 1101142
CIF file Formula: - F2 Li5 O8 P2 V -
Comments: Yin, S.-C.; Herle, P. Subramanya; Higgins, A.; Taylor, N. J.; Makimura, Y.; Nazar, L. F. Dimensional Reduction: Synthesis and Structure of Layered Li~5~M(PO~4~)~2~F~2~ (M = V, Cr) Chemistry of Materials 18(7) (2006) 1745-1752
Space group: P 1 21/c 1
Cell volume: 711.75
Cell parameters: 6.3589; 10.7795; 10.3836; 90; 90.019; 90;  

COD ID: 1101145
CIF file Formula: - C36 H74 Ga N27 O40 -
Comments: Gerasko, Olga A.; Mainicheva, Ekaterina A.; Naumov, Dmitry Yu.; Kuratieva, Natalia V.; Sokolov, Maxim N.; Fedin, Vladimir P. Synthesis and Crystal Structure of Unprecedented Oxo/Hydroxo-Bridged Polynuclear Gallium(III) Aqua Complexes Inorganic Chemistry 44(12) (2005) 4133-4135
Space group: P 1 21/c 1
Cell volume: 6273.7
Cell parameters: 12.8081; 22.7793; 21.5383; 90; 93.278; 90;  

COD ID: 1101179
CIF file Formula: - C3 H10 O6 P V -
Comments: Ouellette, Wayne; Yu, Ming Hui; O'Connor, Charles J.; Zubieta, Jon Structural Diversity of the Oxovanadium Organodiphosphonate System: A Platform for the Design of Void Channels Inorganic Chemistry 45(8) (2006) 3224-3239
Space group: P 1 21/c 1
Cell volume: 753.32
Cell parameters: 14.0943; 5.2746; 10.166; 90; 94.606; 90;  

COD ID: 1101193
CIF file Formula: - C4 H11 N O7 P2 V -
Comments: Ouellette, Wayne; Yu, Ming Hui; O'Connor, Charles J.; Zubieta, Jon Structural Diversity of the Oxovanadium Organodiphosphonate System: A Platform for the Design of Void Channels Inorganic Chemistry 45(8) (2006) 3224-3239
Space group: P 1 21/c 1
Cell volume: 979.5
Cell parameters: 12.2895; 13.4657; 6.0846; 90; 103.401; 90;  

COD ID: 1101194
CIF file Formula: - C6 H15 N O7 P2 V -
Comments: Ouellette, Wayne; Yu, Ming Hui; O'Connor, Charles J.; Zubieta, Jon Structural Diversity of the Oxovanadium Organodiphosphonate System: A Platform for the Design of Void Channels Inorganic Chemistry 45(8) (2006) 3224-3239
Space group: P 1 21/c 1
Cell volume: 1180.82
Cell parameters: 14.6046; 13.4811; 6.0678; 90; 98.73; 90;  

COD ID: 1101195
CIF file Formula: - C8 H19 N O7 P2 V -
Comments: Ouellette, Wayne; Yu, Ming Hui; O'Connor, Charles J.; Zubieta, Jon Structural Diversity of the Oxovanadium Organodiphosphonate System: A Platform for the Design of Void Channels Inorganic Chemistry 45(8) (2006) 3224-3239
Space group: P 1 21/c 1
Cell volume: 1376.5
Cell parameters: 16.941; 13.47; 6.0553; 90; 95.026; 90;  

COD ID: 1101196
CIF file Formula: - C9 H24 N2 O15 P4 V3 -
Comments: Ouellette, Wayne; Yu, Ming Hui; O'Connor, Charles J.; Zubieta, Jon Structural Diversity of the Oxovanadium Organodiphosphonate System: A Platform for the Design of Void Channels Inorganic Chemistry 45(8) (2006) 3224-3239
Space group: P 1 21/c 1
Cell volume: 2199.3
Cell parameters: 16.3248; 13.3361; 10.1019; 90; 89.994; 90;  

COD ID: 1500003
CIF file Formula: - C14 H21 Cd N9 O9 S -
Comments: Sonia B. Jiménez-Pulido; Fátima M. Linares-Ordoñez; Miguel N. Moreno-Carretero; Miguel Quirós Versatile Coordinative Abilities of a New Hybrid Pteridine-Thiosemicarbazone Ligand: Crystal Structure, Spectroscopic Characterization, and Luminescent Properties Inorganic Chemistry 47 (2008) 1096-1106
Space group: P 1 21/c 1
Cell volume: 2221.96
Cell parameters: 12.8903; 13.1999; 14.7455; 90; 117.673; 90;  

COD ID: 1500004
CIF file Formula: - C5 H5 Cd Cl3 N4 -
Comments: Carmen R. Maldonado; Miguel Quirós; Juan M. Salas Chlorocadmate(II) salts of two 1,2,4-triazolo[1,5-a]pyrimidine derivatives Journal of Molecular Structure 882 (2008) 30-34
Space group: P 1 21/c 1
Cell volume: 989.51
Cell parameters: 11.7543; 12.6823; 6.6836; 90; 96.71; 90;  

COD ID: 1500009
CIF file Formula: - C8 H26 Co N7 O8 -
Comments: Raj Pal Sharma; Bal Krishan Vermani; Rajni Sharma; Ritu Bala; Dip Singh Gill; Juan M. Salas; Miguel Quirós Synthesis, spectroscopic characterization and X-ray structure determinations and packing of tetralkylammonium trans-diamminetetranitrocobaltate(III) complex salts where alkyl = methyl or ehtyl Journal of Molecular Structure 784 (2006) 222-227
Space group: P 1 21/c 1
Cell volume: 876.8
Cell parameters: 10.2635; 9.048; 9.752; 90; 104.493; 90;  

COD ID: 1500014
CIF file Formula: - C26 H26 Cl2 Cu N10 O9 -
Comments: Carmen R. Maldonado; Miguel Quirós; Juan M. Salas Copper(II) complexes with 1,2,4-triazolo[1,5-a]pyrimidine and its 5,7-dimethyl derivative Polyhedron 27 (2008) 2779-2784
Space group: P 1 21/c 1
Cell volume: 3041.9
Cell parameters: 12.1033; 18.1364; 14.2061; 90; 102.712; 90;  

COD ID: 1500016
CIF file Formula: - C12 H20 Cl2 Cu N10 O10 -
Comments: Carmen R. Maldonado; Miguel Quirós; Juan M. Salas Copper(II) complexes with 1,2,4-triazolo[1,5-a]pyrimidine and its 5,7-dimethyl derivative Polyhedron 27 (2008) 2779-2784
Space group: P 1 21/c 1
Cell volume: 2259.5
Cell parameters: 13.3507; 14.2757; 13.053; 90; 114.735; 90;  

COD ID: 1500017
CIF file Formula: - C16 H28 Cl2 Cu N10 O10 -
Comments: Carmen R. Maldonado; Miguel Quirós; Juan M. Salas Copper(II) complexes with 1,2,4-triazolo[1,5-a]pyrimidine and its 5,7-dimethyl derivative Polyhedron 27 (2008) 2779-2784
Space group: P 1 21/c 1
Cell volume: 2660.8
Cell parameters: 14.2694; 8.768; 23.9159; 90; 117.222; 90;  

COD ID: 1500018
CIF file Formula: - C25 H29 Cl3 Cu2 N20 O17 -
Comments: Carmen R. Maldonado; Miguel Quirós; Juan M. Salas Copper(II) complexes with 1,2,4-triazolo[1,5-a]pyrimidine and its 5,7-dimethyl derivative Polyhedron 27 (2008) 2779-2784
Space group: P 1 21/c 1
Cell volume: 4050.3
Cell parameters: 13.2076; 22.2625; 14.1257; 90; 102.797; 90;  

COD ID: 1500028
CIF file Formula: - C18 H29 Cu N13 O4 -
Comments: Carmen R. Maldonado; Miguel Quirós; Juan M. Salas Polyhedron 29 (2010) 372-378
Space group: P 1 21/c 1
Cell volume: 2276.3
Cell parameters: 8.4355; 40.985; 7.1685; 90; 113.298; 90;  

COD ID: 1500039
CIF file Formula: - C7 H7 N O -
Comments: Thun, Jürgen; Seyfarth, Lena; Senker, Jürgen; Dinnebier, Robert E.; Breu, Josef Polymorphism in benzamide: solving a 175-year-old riddle. Angewandte Chemie (International ed. in English) 46(35) (2007) 6729-6731
Space group: P 1 21/c 1
Cell volume: 627.5
Cell parameters: 5.05506; 5.51404; 22.95644; 90; 101.291; 90;  

COD ID: 1500045
CIF file Formula: - C14 H10 Br2 N2 O7 Ru -
Comments: Luukkanen, Saija; Haukka, Matti; Eskelinen, Esa; Pakkanen, Tapani A.; Lehtovuori, Viivi; Kallioinen, Jani; Myllyperkiö, Pasi; Korppi-Tommola, Jouko Photochemical reactivity of halogen-containing ruthenium‒dcbpy (dcbpy = 4,4'-dicarboxylic acid-2,2'-bipyridine) compounds, trans(Br)-[Ru(dcbpy)(CO)2Br2] and trans(I)-[Ru(dcbpy)(CO)2I2] Physical Chemistry Chemical Physics 3(11) (2001) 1992
Space group: P 1 21/c 1
Cell volume: 1729.74
Cell parameters: 6.5744; 19.604; 13.4362; 90; 92.7382; 90;  

COD ID: 1501460
CIF file Formula: - C30 H23 N Na 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/c 1
Cell volume: 3146.7
Cell parameters: 10.5774; 21.9723; 14.4196; 90; 110.121; 90;  


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