Crystallography Open Database

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1508470 CIFC18 H16 As Pd2 S20C 1 2/c 114.495; 6.4; 37.816
90; 96.388; 90		3486.3Kato, Reizo; Hengbo, Cui
Cation Dependence of Crystal Structure and Band Parameters in a Series of Molecular Conductors, beta'-(Cation)[Pd(dmit)2]2 (dmit = 1,3-dithiole-2-thione-4,5-dithiolate)
Crystals, 2012, 2, 861-874
1508471 CIFC8 H10 Br3 F6 N2 PP 1 21/n 17.5434; 15.5493; 12.7552
90; 90.198; 90		1496.11Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig
Halogen Interactions in 2,4,5-Tribromoimidazolium Salts
Crystals, 2012, 2, 1017-1033
1508472 CIFC7 H8 B Br3 F4 N2I 41/a :223.6138; 23.6138; 18.8371
90; 90; 90		10503.8Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig
Halogen Interactions in 2,4,5-Tribromoimidazolium Salts
Crystals, 2012, 2, 1017-1033
1508473 CIFC6 H3 Br3 N2P b c 217.1109; 7.8014; 15.6397
90; 90; 90		867.61Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig
Halogen Interactions in 2,4,5-Tribromoimidazolium Salts
Crystals, 2012, 2, 1017-1033
1508474 CIFC8 H8 Br3 F6 N2 PP -18.2368; 13.4522; 13.6605
92.476; 100.965; 92.884		1481.96Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig
Halogen Interactions in 2,4,5-Tribromoimidazolium Salts
Crystals, 2012, 2, 1017-1033
1508475 CIFC7 H6 B Br3 F4 N2I 41/a :223.4674; 23.4674; 18.6531
90; 90; 90		10272.6Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig
Halogen Interactions in 2,4,5-Tribromoimidazolium Salts
Crystals, 2012, 2, 1017-1033
1508476 CIFC9 H6 Br3 F6 N3 O4 S2P -17.5438; 8.6311; 15.9716
75.02; 87.083; 66.58		920.25Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig
Halogen Interactions in 2,4,5-Tribromoimidazolium Salts
Crystals, 2012, 2, 1017-1033
1508477 CIFC8 H8 Br5 F6 N2 PP -17.6729; 7.8858; 15.8383
90.001; 88.104; 62.169		846.88Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig
Halogen Interactions in 2,4,5-Tribromoimidazolium Salts
Crystals, 2012, 2, 1017-1033
1508478 CIFC8 H8 Br6 N2P -17.32; 11.5867; 18.1972
87.611; 81.121; 86.375		1521Froschauer, Carmen; Kahlenberg, Volker; Laus, Gerhard; Schottenberger, Herwig
Halogen Interactions in 2,4,5-Tribromoimidazolium Salts
Crystals, 2012, 2, 1017-1033
1508479 CIFC15 H15 N O SP n a 219.208; 14.0485; 10.3826
90; 90; 90		1343.08Open; Access; Kubicki, Maciej; Dutkiewicz, Grzegorz; Yathirajan, Hemmige S.; Dawar, Pankaj; Ramesha, Andagar R.; Dayananda, Alaloor S.
Crystal and Molecular Structures of Two 2-Aminothiophene Derivatives
Crystals, 2012, 2, 1058-1066
1508480 CIFC13 H12 Cl N O SP 1 21/c 110.6092; 10.8355; 11.1346
90; 98.643; 90		1265.45Open; Access; Kubicki, Maciej; Dutkiewicz, Grzegorz; Yathirajan, Hemmige S.; Dawar, Pankaj; Ramesha, Andagar R.; Dayananda, Alaloor S.
Crystal and Molecular Structures of Two 2-Aminothiophene Derivatives
Crystals, 2012, 2, 1058-1066
1508481 CIFC13 H12 Cl N O SP 1 21/c 110.3738; 10.8501; 11.8301
90; 98.615; 90		1316.53Open; Access; Kubicki, Maciej; Dutkiewicz, Grzegorz; Yathirajan, Hemmige S.; Dawar, Pankaj; Ramesha, Andagar R.; Dayananda, Alaloor S.
Crystal and Molecular Structures of Two 2-Aminothiophene Derivatives
Crystals, 2012, 2, 1058-1066
1508482 CIFC14 H10 O S4 Se4P 1 21/n 15.2296; 11.006; 31.718
90; 93.903; 90		1821.4Ishidzu, Ken-ichi; Ashizawa, Minoru; Watanabe, Masaki; Shirahata, Takashi; Misaki, Yohji
Synthesis, Structures and Properties of Molecular Conductors Based on Bis-Fused Donors Composed of (Thio)Pyran-4-ylidene-1,3-dithiole and Tetraselenafulvalene
Crystals, 2012, 2, 1092-1107
1508483 CIFC17 H12.5 Cl0.5 F6 O P S4 Se4P -17.917; 10.582; 15.979
76.666; 89.916; 89.124		1302.4Ishidzu, Ken-ichi; Ashizawa, Minoru; Watanabe, Masaki; Shirahata, Takashi; Misaki, Yohji
Synthesis, Structures and Properties of Molecular Conductors Based on Bis-Fused Donors Composed of (Thio)Pyran-4-ylidene-1,3-dithiole and Tetraselenafulvalene
Crystals, 2012, 2, 1092-1107
1508484 CIFC40 H30 Cl2 F12 P2 S10 Se8P -112.666; 14.299; 16.289
85.39; 88.219; 79.788		2893.6Ishidzu, Ken-ichi; Ashizawa, Minoru; Watanabe, Masaki; Shirahata, Takashi; Misaki, Yohji
Synthesis, Structures and Properties of Molecular Conductors Based on Bis-Fused Donors Composed of (Thio)Pyran-4-ylidene-1,3-dithiole and Tetraselenafulvalene
Crystals, 2012, 2, 1092-1107
1508485 CIFC16 H13 F2 N3 OC 1 2/c 117.6219; 10.8735; 15.3216
90; 102.864; 90		2862.11Jasinski, Jerry P.; Golen, James A.; Samshuddin, Seranthimata; Narayana, Badiadka; Yathirajan, Hemmige S.
Synthesis, Characterization and Crystal Structures of 3,5-Bis(4-fluorophenyl)-4,5-dihydro-1H-pyrazole-1-carboxamide and 3,5-Bis(4-fluorophenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide
Crystals, 2012, 2, 1108-1115
1508486 CIFC16 H13 F2 N3 SP 1 21/c 114.339; 11.1478; 9.541
90; 107.007; 90		1458.4Jasinski, Jerry P.; Golen, James A.; Samshuddin, Seranthimata; Narayana, Badiadka; Yathirajan, Hemmige S.
Synthesis, Characterization and Crystal Structures of 3,5-Bis(4-fluorophenyl)-4,5-dihydro-1H-pyrazole-1-carboxamide and 3,5-Bis(4-fluorophenyl)-4,5-dihydro-1H-pyrazole-1-carbothioamide
Crystals, 2012, 2, 1108-1115
1508487 CIFCe10 O Se14I 41/a c d :215.7896; 15.7896; 20.8659
90; 90; 90		5202.1Weber, Frank A.; Schurz, Christian M.; Frunder, Susanne; Kuhn, Charlotte F.; Schleid, Thomas
The Short Series of the Oxygen-Poor Lanthanide Oxide Selenides M10OSe14 with M = La-Nd
Crystals, 2012, 2, 1136-1145
1508488 CIFLa10 O Se14I 41/a c d :215.9204; 15.9204; 21.0648
90; 90; 90		5339.1Weber, Frank A.; Schurz, Christian M.; Frunder, Susanne; Kuhn, Charlotte F.; Schleid, Thomas
The Short Series of the Oxygen-Poor Lanthanide Oxide Selenides M10OSe14 with M = La-Nd
Crystals, 2012, 2, 1136-1145
1508489 CIFNd10 O Se14I 41/a c d :215.5983; 15.5983; 20.6291
90; 90; 90		5019.2Weber, Frank A.; Schurz, Christian M.; Frunder, Susanne; Kuhn, Charlotte F.; Schleid, Thomas
The Short Series of the Oxygen-Poor Lanthanide Oxide Selenides M10OSe14 with M = La-Nd
Crystals, 2012, 2, 1136-1145
1508490 CIFO Pr10 Se14I 41/a c d :215.6874; 15.6874; 20.7342
90; 90; 90		5102.6Weber, Frank A.; Schurz, Christian M.; Frunder, Susanne; Kuhn, Charlotte F.; Schleid, Thomas
The Short Series of the Oxygen-Poor Lanthanide Oxide Selenides M10OSe14 with M = La-Nd
Crystals, 2012, 2, 1136-1145
1508491 CIFC12 H10 Au0.94 Cl1.88 N2 S6I -4 2 d7.3259; 7.3259; 67.5487
90; 90; 90		3625.26Psycharis, Vassilis; Mousdis, George A.; Murata, Keizo; Papavassiliou, George C.
Structural and Electrical Properties of the tau-(P-S,S-DMEDT-TTF)2 (AuCl2) (AuCl2)y Compound with (y <> 0.9)
Crystals, 2012, 2, 1283-1290
1508492 CIFC12 H10 Au0.94 Cl1.88 N2 S6I -4 2 d7.3066; 7.3066; 67.3719
90; 90; 90		3596.74Psycharis, Vassilis; Mousdis, George A.; Murata, Keizo; Papavassiliou, George C.
Structural and Electrical Properties of the tau-(P-S,S-DMEDT-TTF)2 (AuCl2) (AuCl2)y Compound with (y <> 0.9)
Crystals, 2012, 2, 1283-1290
1508493 CIFC15 H13 Cl N2 O SP 1 21/c 115.6941; 10.7909; 8.6586
90; 102.184; 90		1433.33Dutkiewicz, Grzegorz; Kubicki, Maciej; Dayananda, Alaloor S.; Yathirajan, Hemmige S.; Ramesha, Andagar R.
Temperature-Dependent Ordering of the Methyl Group in the Crystal Structure of 5-(2-Chlorophenyl)-7-ethyl-1H-thieno [2,3-E][1,4]diazepin-2(3H)-one
Crystals, 2012, 2, 1347-1356
1508494 CIFC15 H13 Cl N2 O SP 1 21/c 115.5187; 10.9358; 8.8141
90; 101.245; 90		1467.12Dutkiewicz, Grzegorz; Kubicki, Maciej; Dayananda, Alaloor S.; Yathirajan, Hemmige S.; Ramesha, Andagar R.
Temperature-Dependent Ordering of the Methyl Group in the Crystal Structure of 5-(2-Chlorophenyl)-7-ethyl-1H-thieno [2,3-E][1,4]diazepin-2(3H)-one
Crystals, 2012, 2, 1347-1356
1508495 CIFC15 H13 Cl N2 O SP 1 21/c 115.1766; 11.2809; 8.9334
90; 98.726; 90		1511.7Dutkiewicz, Grzegorz; Kubicki, Maciej; Dayananda, Alaloor S.; Yathirajan, Hemmige S.; Ramesha, Andagar R.
Temperature-Dependent Ordering of the Methyl Group in the Crystal Structure of 5-(2-Chlorophenyl)-7-ethyl-1H-thieno [2,3-E][1,4]diazepin-2(3H)-one
Crystals, 2012, 2, 1347-1356
1508496 CIFC3 H4 N2 OP 21 21 215.1024; 8.2922; 9.3064
90; 90; 90		393.75Laus, Gerhard; Kahlenberg, Volker
Crystal Structures of 1-Hydroxyimidazole and Its Salts
Crystals, 2012, 2, 1492-1501
1508497 CIFC3 H5 Cl N2 OP 1 21/n 14.2693; 10.7541; 10.9756
90; 93.535; 90		502.96Laus, Gerhard; Kahlenberg, Volker
Crystal Structures of 1-Hydroxyimidazole and Its Salts
Crystals, 2012, 2, 1492-1501
1508498 CIFC3 H5 Br N2 OP 1 21/n 14.4182; 11.0416; 11.2015
90; 94.081; 90		545.07Laus, Gerhard; Kahlenberg, Volker
Crystal Structures of 1-Hydroxyimidazole and Its Salts
Crystals, 2012, 2, 1492-1501
1508499 CIFC6 H10 N4 O6 SP -16.5611; 7.7322; 12.1134
97.82; 91.912; 113.295		556.62Laus, Gerhard; Kahlenberg, Volker
Crystal Structures of 1-Hydroxyimidazole and Its Salts
Crystals, 2012, 2, 1492-1501
1508500 CIFC3 H5 N3 O4C 1 c 13.6216; 17.385; 9.0259
90; 90.499; 90		568.26Laus, Gerhard; Kahlenberg, Volker
Crystal Structures of 1-Hydroxyimidazole and Its Salts
Crystals, 2012, 2, 1492-1501
1508501 CIFC3 H10 Bi O11 S3P 1 21/c 111.601; 10.39; 10.498
90; 115.15; 90		1145.4Gschwind, Fabienne; Jansen, Martin
An Unusual Bismuth Ethanedisulfonate Network
Crystals, 2012, 2, 1374-1381
1509187 CIFAg Al11 O17P 63/m m c5.6169; 5.6169; 22.5973
90; 90; 120		617.42Cheetham, A.K.; Tofield, B.C.; Newsam, J.M.
Stoichiometric silver beta alumina studied at 25,300 and 500C by powder neutron diffraction
Journal of Physics: Condensed Matter, 1990, 2, 2335-2344
1509195 CIFAg As F6F m -3 m7.7548; 7.7548; 7.7548
90; 90; 90		466.35Ito, Y.; Kitashita, K.; Tamada, O.; Hagiwara, R.
Crystal structure of Ag P F6 and Ag As F6 at ambient temperatures
Solid State Sciences, 2000, 2, 237-241
1509327 CIFAg F6 PF m -3 m7.5508; 7.5508; 7.5508
90; 90; 90		430.506Hagiwara, R.; Kitashita, K.; Tamada, O.; Ito, Y.
Crystal structure of Ag P F6 and Ag As F6 at ambient temperatures
Solid State Sciences, 2000, 2, 237-241
1510273 CIFAu Pb3I -4 2 m11.959; 11.959; 5.877
90; 90; 90		840.515Wang, R.; Giessen, B.C.
A B-element-rich representative of the alpha - V3 S type: Au Pb3
Metallurgical Transactions, 1971, 2, 2195-2197
1510279 CIFAu Pt Ti6P m -3 n5.062; 5.062; 5.062
90; 90; 90		129.708Pietrokowsky, P.
Phase relationships in the system Ti3 Au - Ti3 Pt
Scripta Metallurgica, 1968, 2, 379-383
1510436 CIFAu2 In YF m -3 m6.905; 6.905; 6.905
90; 90; 90		329.224Wernick, J.H.; Bernardini, J.E.; Hull, G.W.; Geballe, T.H.; Waszczak, J.V.
Superconductivity in ternary Heusler intermetallic compounds
Materials Letters, 1983, 2, 90-92
1510502 CIFAu0.12 Cu3.88F m -3 m3.633; 3.633; 3.633
90; 90; 90		47.951Brockhouse, B.N.; Hallman, E.D.; Ng, S.C.
Characterization of large alloy single crystals by neutron diffraction
Materials Research Bulletin, 1967, 2, 69-73
1510635 CIFB2 Cr0.5 Mo0.5P 6/m m m3.01; 3.01; 3.12
90; 90; 120		24.48Post, B.; Moskowitz, D.; Glaser, F.W.
Transition metal diborides
Acta Metallurgica, 1954, 2, 20-25
1510636 CIFB2 Cr0.5 Ta0.5P 6/m m m3.025; 3.025; 3.21
90; 90; 120		25.438Post, B.; Glaser, F.W.; Moskowitz, D.
Transition metal diborides
Acta Metallurgica, 1954, 2, 20-25
1510638 CIFB2 Cr0.5 Ti0.5P 6/m m m2.99; 2.99; 3.14
90; 90; 120		24.311Glaser, F.W.; Post, B.; Moskowitz, D.
Transition metal diborides
Acta Metallurgica, 1954, 2, 20-25
1510639 CIFB2 Cr0.5 V0.5P 6/m m m2.99; 2.99; 3.045
90; 90; 120		23.575Moskowitz, D.; Glaser, F.W.; Post, B.
Transition metal diborides
Acta Metallurgica, 1954, 2, 20-25
1510641 CIFB2 CrP 6/m m m2.97; 2.97; 3.07
90; 90; 120		23.452Moskowitz, D.; Glaser, F.W.; Post, B.
Transition metal diborides
Acta Metallurgica, 1954, 2, 20-25
1510710 CIFB2 Hf0.5 Ti0.5P 6/m m m3.085; 3.085; 3.368
90; 90; 120		27.76Moskowitz, D.; Glaser, F.W.; Post, B.
Transition metal diborides
Acta Metallurgica, 1954, 2, 20-25
1510760 CIFB2 Mo0.5 Ti0.5P 6/m m m3.035; 3.035; 3.206
90; 90; 120		25.575Glaser, F.W.; Post, B.; Moskowitz, D.
Transition metal diborides
Acta Metallurgica, 1954, 2, 20-25
1510761 CIFB2 Mo0.5 Zr0.5P 6/m m m3.085; 3.085; 3.4
90; 90; 120		28.023Post, B.; Glaser, F.W.; Moskowitz, D.
Transition metal diborides
Acta Metallurgica, 1954, 2, 20-25
1510775 CIFB2 Nb0.5 Ti0.5P 6/m m m3.06; 3.06; 3.264
90; 90; 120		26.468Glaser, F.W.; Moskowitz, D.; Post, B.
Transition metal diborides
Acta Metallurgica, 1954, 2, 20-25
1510777 CIFB2 Nb0.5 Zr0.5P 6/m m m3.128; 3.128; 3.42
90; 90; 120		28.979Post, B.; Moskowitz, D.; Glaser, F.W.
Transition metal diborides
Acta Metallurgica, 1954, 2, 20-25
1510835 CIFB2 Ta0.5 Ti0.5P 6/m m m3.05; 3.05; 3.246
90; 90; 120		26.15Moskowitz, D.; Glaser, F.W.; Post, B.
Transition metal diborides
Acta Metallurgica, 1954, 2, 20-25

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