Crystallography Open Database
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COD ID ![]() |
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Cell parameters | Cell volume ![]() |
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2311995 | CIF | C6 H6 Li Na O7 | P -1 | 6.5811; 6.357; 9.9389 91.762; 104.388; 97.438 | 398.52 | Cigler, Andrew J.; Kaduk, James A. Dilithium (citrate) crystals and their relatives. Acta crystallographica. Section C, Structural chemistry, 2018, 74, 1160-1170 |
2311996 | CIF | C6 H6 K Li O7 | P -1 | 6.2771; 6.3166; 10.8323 93.054; 102.747; 96.054 | 415.28 | Cigler, Andrew J.; Kaduk, James A. Dilithium (citrate) crystals and their relatives. Acta crystallographica. Section C, Structural chemistry, 2018, 74, 1160-1170 |
2311997 | CIF | C17 H14 Cl2 N2 O2 | B -1 | 16.7989; 17.0054; 22.1341 78.897; 100.411; 90.042 | 6098.8 | Garraza, María Soledad; Gimenez, María Emilia; Vega, Daniel Roberto; Baggio, Ricardo Crystal structure and pseudosymmetry analysis of the triclinic prodrug cloxazolam (Z' = 4). Acta crystallographica. Section C, Structural chemistry, 2019, 75, 851-858 |
2311998 | CIF Paper | C63 H63 Eu O27 | R 3 :H | 27.194; 27.194; 7.6221 90; 90; 120 | 4881.5 | Han, Mei Rong; Li, Shao Dong; Ma, Ling; Yao, Bang; Feng, Si Si; Zhu, Miao Li Luminescent and magnetic bifunctional coordination complex based on a chiral tartaric acid derivative and europium. Acta crystallographica. Section C, Structural chemistry, 2019, 75, 1220-1227 |
2311999 | CIF Paper | C126 H126 N14 Nb2 | C 1 2/c 1 | 32.077; 15.83; 24.815 90; 97.655; 90 | 12488 | Kucera, Benjamin E.; Roberts, Christopher J.; Young, Jr, Victor G; Brennessel, William W.; Ellis, John E. Niobium isocyanide complexes, Nb(CNAr)<sub>6</sub>, with Ar = 2,6-dimethylphenyl (Xyl), a diamagnetic dimer containing four reductively coupled isocyanides, and Ar = 2,6-diisopropylphenyl (Dipp), a paramagnetic monomer analogous to the highly unstable hexacarbonylniobium(0). Acta crystallographica. Section C, Structural chemistry, 2019, 75, 1259-1265 |
2312000 | CIF Paper | C120 H132 N12 Nb2 O3 | P -1 | 12.2029; 12.5921; 19.676 95.62; 101.807; 113.236 | 2665.2 | Kucera, Benjamin E.; Roberts, Christopher J.; Young, Jr, Victor G; Brennessel, William W.; Ellis, John E. Niobium isocyanide complexes, Nb(CNAr)<sub>6</sub>, with Ar = 2,6-dimethylphenyl (Xyl), a diamagnetic dimer containing four reductively coupled isocyanides, and Ar = 2,6-diisopropylphenyl (Dipp), a paramagnetic monomer analogous to the highly unstable hexacarbonylniobium(0). Acta crystallographica. Section C, Structural chemistry, 2019, 75, 1259-1265 |
2312001 | CIF Paper | C78 H102 N6 Nb | R -3 :H | 15.2582; 15.2582; 26.7313 90; 90; 120 | 5389.6 | Kucera, Benjamin E.; Roberts, Christopher J.; Young, Jr, Victor G; Brennessel, William W.; Ellis, John E. Niobium isocyanide complexes, Nb(CNAr)<sub>6</sub>, with Ar = 2,6-dimethylphenyl (Xyl), a diamagnetic dimer containing four reductively coupled isocyanides, and Ar = 2,6-diisopropylphenyl (Dipp), a paramagnetic monomer analogous to the highly unstable hexacarbonylniobium(0). Acta crystallographica. Section C, Structural chemistry, 2019, 75, 1259-1265 |
2312002 | CIF Paper | C17 H13 N O4 | P 1 21/n 1 | 12.5596; 7.587; 14.3433 90; 94.66; 90 | 1362.25 | Brahmia, Ameni; Marzouki, Riadh; Rohlicek, Jan; Irfan, Ahmad; Al-Sehemi, Abdullah G; Ben Hassen, Rached Structural, spectroscopic and first-principles studies of new aminocoumarin derivatives. Acta crystallographica. Section C, Structural chemistry, 2019, 75, 1617-1627 |
2312003 | CIF Paper | C17 H13 N O4 | P 21 21 21 | 25.8641; 13.2022; 4.05295 90; 90; 90 | 1383.93 | Brahmia, Ameni; Marzouki, Riadh; Rohlicek, Jan; Irfan, Ahmad; Al-Sehemi, Abdullah G; Ben Hassen, Rached Structural, spectroscopic and first-principles studies of new aminocoumarin derivatives. Acta crystallographica. Section C, Structural chemistry, 2019, 75, 1617-1627 |
2312004 | CIF Paper | C17 H15 N O5 | P 21 21 21 | 25.2195; 12.8116; 4.54932 90; 90; 90 | 1469.9 | Brahmia, Ameni; Marzouki, Riadh; Rohlicek, Jan; Irfan, Ahmad; Al-Sehemi, Abdullah G; Ben Hassen, Rached Structural, spectroscopic and first-principles studies of new aminocoumarin derivatives. Acta crystallographica. Section C, Structural chemistry, 2019, 75, 1617-1627 |
2312027 | CIF HKL Paper | C12 H16 Ca N2 O9 | P -1 | 6.661; 9.833; 12.612 74.277; 79.224; 84.609 | 780.3 | Liu, Huang Huang; Liang, Chu Heng; Liu, Yan; Zhang, Hong Tao A two-dimensional calcium (II) coordination polymer constructed from 2,2'-[terephthaloylbis(azanediyl)]diacetate: synthesis, structure and properties. Acta crystallographica. Section C, Structural chemistry, 2021, 77, 675-682 |
2312035 | CIF Paper | C16 H10 F4 I2 N2 S2 | P 1 21/c 1 | 16.288; 5.79; 10.546 90; 104.77; 90 | 961.7 | Mosquera, Marta E. G.; Dortez, Silvia; Fernández-Palacio, Francisco; Gómez-Sal, Pilar Pyridine-4-thiol as halogen-bond (HaB) acceptor: influence of the noncovalent interaction in its reactivity. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 112-117 |
2312036 | CIF Paper | C11 H12 Cl2 N2 S2 | F 2 d d | 8.0815; 17.2161; 18.9254 90; 90; 90 | 2633.1 | Mosquera, Marta E. G.; Dortez, Silvia; Fernández-Palacio, Francisco; Gómez-Sal, Pilar Pyridine-4-thiol as halogen-bond (HaB) acceptor: influence of the noncovalent interaction in its reactivity. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 112-117 |
2312037 | CIF HKL Paper | C14 H23 F I Nb Si2 | C 1 2/c 1 | 15.1427; 8.9369; 26.143 90; 98.304; 90 | 3500.8 | Rodriguez, Sara M.; Motta, Ysidro N.; Hill, Michael R.; Oelke, Laura M.; Carter, Carly C.; Cundari, Thomas R.; Yousufuddin, Muhammed Crystal structure and DFT calculations of Cp<sub>2</sub>NbH(SiIMe<sub>2</sub>)(SiFMe<sub>2</sub>): an asymmetric bis(silyl) niobocene hydride complex. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 158-163 |
2312038 | CIF HKL Paper | C21 H25 Cu2 N3 O4 | P -1 | 8.0549; 9.8811; 13.7189 106.451; 103.271; 91.482 | 1014.4 | Ranaweera, Samantha A.; Donnadieu, Bruno; Henry, William P.; White, Mark G. Effects of electron-donating ability of binding sites on coordination number: the interactions of a cyclic Schiff base with copper ions. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 142-148 |
2312039 | CIF HKL Paper | C29 H18 F4 N4 O4 | P 1 21/c 1 | 23.8353; 6.8067; 16.6103 90; 109.104; 90 | 2546.43 | Bosch, Eric; Moreno, Bryce S.; Bowling, Nathan P. π-Complexation and C-H hydrogen bonding in the formation of colored cocrystals. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 149-157 |
2312040 | CIF HKL Paper | C29 H18 F4 N4 O4 | P b c n | 13.131; 14.423; 26.523 90; 90; 90 | 5023 | Bosch, Eric; Moreno, Bryce S.; Bowling, Nathan P. π-Complexation and C-H hydrogen bonding in the formation of colored cocrystals. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 149-157 |
2312043 | CIF HKL Paper | C26 H20 Cl2 N4 | P -1 | 6.1037; 9.3345; 10.4146 83.039; 77.139; 85.055 | 573.15 | Parkin, Sean; Glidewell, Christopher; Horton, Peter N. (E,E)-1,1'-[1,2-Bis(4-chlorophenyl)ethane-1,2-diyl]bis(phenyldiazene) revisited: threefold configurational disorder of (S,S), (R,R) and (S,R) isomers, a detailed critique. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 77-82 |
2312044 | CIF HKL Paper | C26 H20 Cl2 N4 | C 1 c 1 | 22.657; 5.4399; 19.086 90; 99.967; 90 | 2316.9 | Parkin, Sean; Glidewell, Christopher; Horton, Peter N. (E,E)-1,1'-[1,2-Bis(4-chlorophenyl)ethane-1,2-diyl]bis(phenyldiazene) revisited: threefold configurational disorder of (S,S), (R,R) and (S,R) isomers, a detailed critique. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 77-82 |
2312045 | CIF HKL Paper | C26 H20 Cl2 N4 | C 1 2/c 1 | 22.657; 5.4399; 19.086 90; 99.967; 90 | 2316.9 | Parkin, Sean; Glidewell, Christopher; Horton, Peter N. (E,E)-1,1'-[1,2-Bis(4-chlorophenyl)ethane-1,2-diyl]bis(phenyldiazene) revisited: threefold configurational disorder of (S,S), (R,R) and (S,R) isomers, a detailed critique. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 77-82 |
2312046 | CIF HKL Paper | C25 H19 N | P 1 21/c 1 | 12.6112; 8.6352; 17.308 90; 105.925; 90 | 1812.51 | Vera, Diana R.; Ardila, Diana M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher Conversion of 2-methyl-4-styrylquinolines into 2,4-distyrylquinolines: synthesis, and spectroscopic and structural characterization of five examples. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 94-103 |
2312047 | CIF HKL Paper | C25 H17 Cl2 N | C 1 2/c 1 | 28.495; 9.5384; 16.052 90; 118.581; 90 | 3831.2 | Vera, Diana R.; Ardila, Diana M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher Conversion of 2-methyl-4-styrylquinolines into 2,4-distyrylquinolines: synthesis, and spectroscopic and structural characterization of five examples. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 94-103 |
2312048 | CIF HKL Paper | C32 H22 Br N O | P 1 21/n 1 | 12.287; 15.528; 12.844 90; 99.877; 90 | 2414.2 | Vera, Diana R.; Ardila, Diana M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher Conversion of 2-methyl-4-styrylquinolines into 2,4-distyrylquinolines: synthesis, and spectroscopic and structural characterization of five examples. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 94-103 |
2312049 | CIF HKL Paper | C32 H21 Br Cl N O | P -1 | 9.9051; 11.3936; 11.8192 77.727; 76.116; 86.448 | 1265.2 | Vera, Diana R.; Ardila, Diana M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher Conversion of 2-methyl-4-styrylquinolines into 2,4-distyrylquinolines: synthesis, and spectroscopic and structural characterization of five examples. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 94-103 |
2312050 | CIF HKL Paper | C30 H20 Br N O S | P b c a | 15.5785; 16.4215; 18.3126 90; 90; 90 | 4684.8 | Vera, Diana R.; Ardila, Diana M.; Palma, Alirio; Cobo, Justo; Glidewell, Christopher Conversion of 2-methyl-4-styrylquinolines into 2,4-distyrylquinolines: synthesis, and spectroscopic and structural characterization of five examples. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 94-103 |
2312077 | CIF HKL Paper | C8 H14 N8 O4 | P -1 | 7.1203; 7.2221; 7.3808 96.813; 106.031; 114.329 | 320.47 | Domasevitch, Kostiantyn V.; Senchyk, Ganna A.; Lysenko, Andrey B.; Rusanov, Eduard B. Gradual evolution of hydrogen-bonding patterns with the carbamoylcyanonitrosomethanide anion in a series of aliphatic diammonium salts. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 177-185 |
2312078 | CIF HKL Paper | C10 H16 N8 O4 | C 1 2/c 1 | 14.5686; 7.1704; 13.9658 90; 104.209; 90 | 1414.27 | Domasevitch, Kostiantyn V.; Senchyk, Ganna A.; Lysenko, Andrey B.; Rusanov, Eduard B. Gradual evolution of hydrogen-bonding patterns with the carbamoylcyanonitrosomethanide anion in a series of aliphatic diammonium salts. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 177-185 |
2312079 | CIF HKL Paper | C10 H18 N8 O4 | C 1 2/c 1 | 16.4095; 6.7848; 14.8471 90; 116.556; 90 | 1478.61 | Domasevitch, Kostiantyn V.; Senchyk, Ganna A.; Lysenko, Andrey B.; Rusanov, Eduard B. Gradual evolution of hydrogen-bonding patterns with the carbamoylcyanonitrosomethanide anion in a series of aliphatic diammonium salts. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 177-185 |
2312080 | CIF HKL Paper | C12 H22 N8 O4 | P 1 21/c 1 | 4.6121; 16.8608; 10.7931 90; 93.853; 90 | 837.41 | Domasevitch, Kostiantyn V.; Senchyk, Ganna A.; Lysenko, Andrey B.; Rusanov, Eduard B. Gradual evolution of hydrogen-bonding patterns with the carbamoylcyanonitrosomethanide anion in a series of aliphatic diammonium salts. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 177-185 |
2312081 | CIF HKL Paper | C132 H192 B4 N12 | P -1 | 15.5952; 15.7968; 25.7779 74.729; 85.878; 89.857 | 6109.5 | Lovstedt, Alex; Dempsey, Stephen H.; Kass, Steven R. Structure determination of a bis[4-(di-n-butylamino)phenyl](pyridin-3-yl)borane tetramer highlighting a unique geometric conformation of the core 16-membered ring. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 170-176 |
2312083 | CIF HKL Paper | C18 H42 O21 | P 21 21 21 | 8.8921; 12.2495; 23.798 90; 90; 90 | 2592.2 | Kawasaki, Takuro; Takahashi, Miwako; Kiyanagi, Ryoji; Ohhara, Takashi Rearrangement of hydrogen bonds in dehydrated raffinose tetrahydrate: a time-of-flight neutron diffraction study. Acta crystallographica. Section C, Structural chemistry, 2022, 78, 743-748 |
2312084 | CIF HKL Paper | C18 H40 O20 | P 21 21 21 | 8.987; 12.3973; 23.528 90; 90; 90 | 2621.4 | Kawasaki, Takuro; Takahashi, Miwako; Kiyanagi, Ryoji; Ohhara, Takashi Rearrangement of hydrogen bonds in dehydrated raffinose tetrahydrate: a time-of-flight neutron diffraction study. Acta crystallographica. Section C, Structural chemistry, 2022, 78, 743-748 |
2312085 | CIF HKL Paper | C10 H12 N2 O4 S | P 1 21/n 1 | 8.6173; 14.6662; 9.4885 90; 108.075; 90 | 1140.01 | Kolade, Sherif O.; Izunobi, Josephat U.; Gordon, Allen T.; Hosten, Eric C.; Olasupo, Idris A.; Ogunlaja, Adeniyi S.; Asekun, Olayinka T.; Familoni, Oluwole B. N-Cycloamino substituent effects on the packing architecture of ortho-sulfanilamide molecular crystals and their in silico carbonic anhydrase II and IX inhibitory activities. Acta crystallographica. Section C, Structural chemistry, 2022, 78, 730-742 |
2312086 | CIF HKL Paper | C11 H14 N2 O4 S | P 1 21/n 1 | 8.6881; 15.0266; 9.8337 90; 106.526; 90 | 1230.8 | Kolade, Sherif O.; Izunobi, Josephat U.; Gordon, Allen T.; Hosten, Eric C.; Olasupo, Idris A.; Ogunlaja, Adeniyi S.; Asekun, Olayinka T.; Familoni, Oluwole B. N-Cycloamino substituent effects on the packing architecture of ortho-sulfanilamide molecular crystals and their in silico carbonic anhydrase II and IX inhibitory activities. Acta crystallographica. Section C, Structural chemistry, 2022, 78, 730-742 |
2312087 | CIF HKL Paper | C14 H12 N2 O4 S | P 1 21/n 1 | 7.4701; 23.6743; 7.8614 90; 94.989; 90 | 1385.02 | Kolade, Sherif O.; Izunobi, Josephat U.; Gordon, Allen T.; Hosten, Eric C.; Olasupo, Idris A.; Ogunlaja, Adeniyi S.; Asekun, Olayinka T.; Familoni, Oluwole B. N-Cycloamino substituent effects on the packing architecture of ortho-sulfanilamide molecular crystals and their in silico carbonic anhydrase II and IX inhibitory activities. Acta crystallographica. Section C, Structural chemistry, 2022, 78, 730-742 |
2312088 | CIF HKL Paper | C10 H14 N2 O2 S | P 1 21/c 1 | 16.399; 7.9485; 18.376 90; 113.907; 90 | 2189.8 | Kolade, Sherif O.; Izunobi, Josephat U.; Gordon, Allen T.; Hosten, Eric C.; Olasupo, Idris A.; Ogunlaja, Adeniyi S.; Asekun, Olayinka T.; Familoni, Oluwole B. N-Cycloamino substituent effects on the packing architecture of ortho-sulfanilamide molecular crystals and their in silico carbonic anhydrase II and IX inhibitory activities. Acta crystallographica. Section C, Structural chemistry, 2022, 78, 730-742 |
2312089 | CIF HKL Paper | C11 H16 N2 O2 S | P b c a | 11.1747; 10.485; 20.1368 90; 90; 90 | 2359.36 | Kolade, Sherif O.; Izunobi, Josephat U.; Gordon, Allen T.; Hosten, Eric C.; Olasupo, Idris A.; Ogunlaja, Adeniyi S.; Asekun, Olayinka T.; Familoni, Oluwole B. N-Cycloamino substituent effects on the packing architecture of ortho-sulfanilamide molecular crystals and their in silico carbonic anhydrase II and IX inhibitory activities. Acta crystallographica. Section C, Structural chemistry, 2022, 78, 730-742 |
2312090 | CIF HKL Paper | C14 H14 N2 O2 S | P 1 21/n 1 | 9.799; 10.2612; 13.201 90; 100.682; 90 | 1304.4 | Kolade, Sherif O.; Izunobi, Josephat U.; Gordon, Allen T.; Hosten, Eric C.; Olasupo, Idris A.; Ogunlaja, Adeniyi S.; Asekun, Olayinka T.; Familoni, Oluwole B. N-Cycloamino substituent effects on the packing architecture of ortho-sulfanilamide molecular crystals and their in silico carbonic anhydrase II and IX inhibitory activities. Acta crystallographica. Section C, Structural chemistry, 2022, 78, 730-742 |
2312091 | CIF HKL Paper | C25 H20 Cu N4 O8 | P -1 | 10.4795; 11.1326; 12.1768 101.393; 105.793; 115.958 | 1143.78 | Bhat, Satish Shantaram; Kawade, Vitthal A.; Revankar, Vidyanand K.; Kumbar, Vijay; Bhat, Kishore Synthesis, crystal structure and biological properties of a fluorophore-labelled mixed-ligand copper(II) complex incorporating N-hydroxynaphthalene-1,8-dicarboximide. Acta crystallographica. Section C, Structural chemistry, 2022, 78, 755-759 |
2312092 | CIF HKL Paper | Cl H2 K O | P 1 21/n 1 | 5.687; 6.3969; 8.447 90; 107.08; 90 | 293.7 | Yamashita, Keishiro; Komatsu, Kazuki; Kagi, Hiroyuki Crystal structure of potassium chloride monohydrate: water intercalation into the B1 structure of KCl under high pressure. Acta crystallographica. Section C, Structural chemistry, 2022, 78, 749-754 |
2312093 | CIF HKL Paper | C55 H41 Cu F6 N P3 | P -1 | 11.0585; 12.0918; 19.5318 73.751; 74.975; 74.263 | 2365.4 | Zhang, Dan Qi; Song, Li; Wu, Jin Tao; Zhu, Yu Fan; Xu, Wen Ze; Lai, Jia Qi; Chai, Wen Xiang Structural, spectroscopic, luminescence sensing and TD-DFT theoretical studies of a CuP<sub>2</sub>N-type complex. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 186-192 |
2312094 | CIF HKL Paper | C17 H16 Cl N2 O2 P | P -1 | 6.927; 8.613; 14.335 83.295; 81.574; 80.251 | 830.1 | Yuan, Haokun; Zhang, Ran; Hu, Kai; Fang, Ruiqin Proton-transfer salts of diphenylphosphinic acid with substituted 2-aminopyridine: crystal structure, spectroscopic and DFT studies. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 193-203 |
2312095 | CIF HKL Paper | C18 H16 N3 O2 P | P -1 | 6.267; 9.551; 14.615 88.185; 84.742; 75.841 | 844.6 | Yuan, Haokun; Zhang, Ran; Hu, Kai; Fang, Ruiqin Proton-transfer salts of diphenylphosphinic acid with substituted 2-aminopyridine: crystal structure, spectroscopic and DFT studies. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 193-203 |
2312096 | CIF HKL Paper | C18 H19 N2 O2 P | C 1 2/c 1 | 27.998; 10.747; 11.362 90; 97.344; 90 | 3391 | Yuan, Haokun; Zhang, Ran; Hu, Kai; Fang, Ruiqin Proton-transfer salts of diphenylphosphinic acid with substituted 2-aminopyridine: crystal structure, spectroscopic and DFT studies. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 193-203 |
2312097 | CIF HKL | C26 H21 Cl N6 O | P -1 | 9.652; 9.7408; 14.1445 98.183; 104.638; 90.059 | 1272.6 | Vicentes, Daniel E.; Rodríguez, Ricaurte; Cobo, Justo; Glidewell, Christopher Synthesis of 5-(arylmethylideneamino)-4-(1H-benzo[d]imidazol-1-yl)pyrimidine hybrids: synthetic sequence and the molecular and supramolecular structures of two intermediates and three final products. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 227-236 |
2312098 | CIF HKL Paper | C24 H21 N O | C 1 2/c 1 | 19.5522; 5.8693; 31.3714 90; 91.438; 90 | 3599 | Battaglia, Zachary O.; Kersten, Jordan T.; Nicol, Elise M.; Whitworth, Paloma; Wheeler, Kraig A.; Hall, Charlie L.; Potticary, Jason; Hamilton, Victoria; Hall, Simon R.; D'Ambruoso, Gemma D; Matsumoto, Masaomi; Warren, Stephen D.; Cremeens, Matthew E. Crystal structures, Hirshfeld analysis, and energy framework analysis of two differently 3'-substituted 4-methylchalcones: 3'-(N=CHC<sub>6</sub>H<sub>4</sub>-p-CH<sub>3</sub>)-4-methylchalcone and 3'-(NHCOCH<sub>3</sub>)-4-methylchalcone. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 217-226 |
2312099 | CIF HKL Paper | C18 H17 N O2 | C 1 2/c 1 | 25.1922; 5.7621; 20.7012 90; 109.066; 90 | 2840.14 | Battaglia, Zachary O.; Kersten, Jordan T.; Nicol, Elise M.; Whitworth, Paloma; Wheeler, Kraig A.; Hall, Charlie L.; Potticary, Jason; Hamilton, Victoria; Hall, Simon R.; D'Ambruoso, Gemma D; Matsumoto, Masaomi; Warren, Stephen D.; Cremeens, Matthew E. Crystal structures, Hirshfeld analysis, and energy framework analysis of two differently 3'-substituted 4-methylchalcones: 3'-(N=CHC<sub>6</sub>H<sub>4</sub>-p-CH<sub>3</sub>)-4-methylchalcone and 3'-(NHCOCH<sub>3</sub>)-4-methylchalcone. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 217-226 |
2312100 | CIF HKL Paper | C161 H210 Cl16 N4 Ni O20 P4 Pt2 Si4 | P -1 | 12.702; 19.372; 20.34 71.313; 81.809; 78.917 | 4635 | Gildenast, Hans; Gruszien, Lukas; Englert, Ulli The heterometallic one-dimensional solvated coordination polymer [NiPt<sub>2</sub>Cl<sub>6</sub>(TRIP-Py)<sub>4</sub>]<sub>n</sub>. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 118-124 |
2312111 | CIF HKL Paper | Nd0.51 Ni4.83 Tb1.51 Zn12.17 | R -3 m :H | 9.0637; 9.0637; 13.2319 90; 90; 120 | 941.38 | Nytka, Vitalii; Kordan, Vasyl; Stetskiv, Andrij; Pavlyuk, Volodymyr Tb<sub>2-x</sub>Nd<sub>x</sub>Zn<sub>17-y</sub>Ni<sub>y</sub> (x = 0.5, y = 4.83): a new intermetallic with a maximum disordered structure and its hydrogen storage properties. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 257-262 |
2312112 | CIF HKL Paper | C14 H8 F N O2 S | P -1 | 7.5224; 8.4415; 10.82 91.437; 104.157; 112.754 | 608.8 | Çakmak, Şukriye; Aycan, Tuğba; Yakan, Hasan; Veyisoğlu, Aysel; Tanak, Hasan; Evecen, Meryem Preparation, spectroscopic, X-ray crystallographic, DFT, antimicrobial and ADMET studies of N-[(4-flourophenyl)sulfanyl]phthalimide. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 249-256 |
2312125 | CIF HKL Paper | C6 H32 Cl3 Co N6 O4 | P -3 c 1 | 11.3193; 11.3193; 15.4254 90; 90; 120 | 1711.6 | Kollitz, Megan R.; Lappin, A. Graham; Oliver, Allen G. Double-salt formation in crystal structures containing [Co(en)<sub>3</sub>]Cl<sub>3</sub>. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 164-169 |
2312126 | CIF HKL Paper | C12 H60 Cl7 Co2 N12 Na O6 | P -3 c 1 | 11.354; 11.354; 15.683 90; 90; 120 | 1751 | Kollitz, Megan R.; Lappin, A. Graham; Oliver, Allen G. Double-salt formation in crystal structures containing [Co(en)<sub>3</sub>]Cl<sub>3</sub>. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 164-169 |
2312127 | CIF HKL Paper | C12 H60 Cl7 Co2 K N12 O6 | P -3 c 1 | 11.4444; 11.4444; 15.649 90; 90; 120 | 1775.02 | Kollitz, Megan R.; Lappin, A. Graham; Oliver, Allen G. Double-salt formation in crystal structures containing [Co(en)<sub>3</sub>]Cl<sub>3</sub>. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 164-169 |
2312128 | CIF HKL Paper | C12 H64 Cl7 Co2 N13 O6 | P -3 c 1 | 11.4131; 11.4131; 15.578 90; 90; 120 | 1757.3 | Kollitz, Megan R.; Lappin, A. Graham; Oliver, Allen G. Double-salt formation in crystal structures containing [Co(en)<sub>3</sub>]Cl<sub>3</sub>. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 164-169 |
2312129 | CIF HKL Paper | C12 H60 Cl7 Co2 N12 Na O6 | P 3 | 11.32; 11.32; 8.049 90; 90; 120 | 893.2 | Kollitz, Megan R.; Lappin, A. Graham; Oliver, Allen G. Double-salt formation in crystal structures containing [Co(en)<sub>3</sub>]Cl<sub>3</sub>. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 164-169 |
2312130 | CIF HKL Paper | C13 H20 N6 S | P 1 21/n 1 | 9.1032; 10.9034; 15.3748 90; 107.202; 90 | 1457.78 | Ziembicka, Dagmara; Olczak, Andrzej; Gobis, Katarzyna; Korona-Głowniak, Izabela; Pietrzak, Anna; Augustynowicz-Kopeć, Ewa; Głogowska, Agnieszka; Zaborowski, Marcin; Szczesio, Małgorzata Synthesis, structure, ADME and biological activity of three 2,6-disubstituted thiosemicarbazone derivatives. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 283-291 |
2312131 | CIF HKL Paper | C14 H22 N6 S | P 1 21/c 1 | 9.3148; 9.386; 36.2261 90; 94.812; 90 | 3156.04 | Ziembicka, Dagmara; Olczak, Andrzej; Gobis, Katarzyna; Korona-Głowniak, Izabela; Pietrzak, Anna; Augustynowicz-Kopeć, Ewa; Głogowska, Agnieszka; Zaborowski, Marcin; Szczesio, Małgorzata Synthesis, structure, ADME and biological activity of three 2,6-disubstituted thiosemicarbazone derivatives. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 283-291 |
2312132 | CIF HKL Paper | C15 H19 N5 O2 S | I 1 a 1 | 7.96887; 10.94707; 18.4759 90; 96.242; 90 | 1602.2 | Ziembicka, Dagmara; Olczak, Andrzej; Gobis, Katarzyna; Korona-Głowniak, Izabela; Pietrzak, Anna; Augustynowicz-Kopeć, Ewa; Głogowska, Agnieszka; Zaborowski, Marcin; Szczesio, Małgorzata Synthesis, structure, ADME and biological activity of three 2,6-disubstituted thiosemicarbazone derivatives. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 283-291 |
2312133 | CIF HKL Paper | C20 H16 N4 O6 Pb | P 1 21/n 1 | 7.769; 22.149; 13.656 90; 99.399; 90 | 2318 | Liu, Xiangning; Cai, Hua; Zhou, Ruikang; Li, Yaqi Construction of a Pb<sup>II</sup> coordination polymer from a semi-rigid ditopic 2,2-biimidazole derivative: synthesis, crystal structure and characterization. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 263-268 |
2312134 | CIF HKL Paper | C17 H24 N2 O5 | P 21 21 21 | 4.82; 19.11; 19.28 90; 90; 90 | 1775.9 | Gessmann, Renate; Garcia-Saez, Isabel; Simatos, Georgios; Mitraki, Anna Z-Ala-Ile-OH, a dipeptide building block suitable for the formation of orthorhombic microtubes. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 277-282 |
2312135 | CIF Paper | C6 H12 B N O7 S | P b c a | 14.1807; 7.4675; 20.0702 90; 90; 90 | 2125.32 | Rivera-Segura, Jacobo; Barba, Victor; Hernandez-Ahuactzi, Iran F; Tlahuext, Hugo Boron-π interactions in two 3-(dihydroxyboryl)anilinium salts analyzed by crystallographic studies and supported by the noncovalent interactions (NCI) index theoretical approach. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 269-276 |
2312136 | CIF HKL Paper | C7 H12 B N O6 S | P 1 21/n 1 | 10.97561; 7.22452; 13.5494 90; 103.343; 90 | 1045.38 | Rivera-Segura, Jacobo; Barba, Victor; Hernandez-Ahuactzi, Iran F; Tlahuext, Hugo Boron-π interactions in two 3-(dihydroxyboryl)anilinium salts analyzed by crystallographic studies and supported by the noncovalent interactions (NCI) index theoretical approach. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 269-276 |
2312145 | CIF HKL Paper | C34 H78 Cd N4 O6 S2 Si2 | P 1 21/n 1 | 16.424; 16.876; 18.265 90; 112.66; 90 | 4672 | Kowalkowska-Zedler, Daria; Bruździak, Piotr; Hnatejko, Zbigniew; Łyszczek, Renata; Brillowska-Dąbrowska, Anna; Ponikiewski, Łukasz; Cieśla, Bartosz; Pladzyk, Agnieszka Solvent influence on the crystal structures of new cadmium tri-tert-butoxysilanethiolate complexes with 1,4-bis(3-aminopropyl)piperazine: luminescence and antifungal activity. Acta crystallographica. Section C, Structural chemistry, 2023 |
2312146 | CIF HKL Paper | C58 H132 Cd2 N4 O12 S4 Si4 | P 1 21/n 1 | 9.6433; 29.0546; 14.5665 90; 91.466; 90 | 4079.94 | Kowalkowska-Zedler, Daria; Bruździak, Piotr; Hnatejko, Zbigniew; Łyszczek, Renata; Brillowska-Dąbrowska, Anna; Ponikiewski, Łukasz; Cieśla, Bartosz; Pladzyk, Agnieszka Solvent influence on the crystal structures of new cadmium tri-tert-butoxysilanethiolate complexes with 1,4-bis(3-aminopropyl)piperazine: luminescence and antifungal activity. Acta crystallographica. Section C, Structural chemistry, 2023 |
2312147 | CIF HKL Paper | C14 H13 N3 O5 | P 1 21/n 1 | 15.3082; 5.202; 18.6832 90; 112.809; 90 | 1371.46 | Murtaza, Ghulam; Khan, Majid; Farooq, Saba; Choudhary, M. Iqbal; Yousuf, Sammer New cocrystals of heterocyclic drugs: structural, antileishmanial, larvicidal and urease inhibition studies. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 237-248 |
2312148 | CIF HKL Paper | C22 H17 Cl N2 O4 | P 1 21/n 1 | 5.1567; 21.1373; 17.8054 90; 92.826; 90 | 1938.41 | Murtaza, Ghulam; Khan, Majid; Farooq, Saba; Choudhary, M. Iqbal; Yousuf, Sammer New cocrystals of heterocyclic drugs: structural, antileishmanial, larvicidal and urease inhibition studies. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 237-248 |
2312149 | CIF HKL Paper | C24 H20 N2 O3 | P 1 21/c 1 | 15.344; 5.4552; 23.7301 90; 96.148; 90 | 1974.89 | Murtaza, Ghulam; Khan, Majid; Farooq, Saba; Choudhary, M. Iqbal; Yousuf, Sammer New cocrystals of heterocyclic drugs: structural, antileishmanial, larvicidal and urease inhibition studies. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 237-248 |
2312150 | CIF HKL Paper | C21 H18 N4 O2 | P 1 21/n 1 | 5.1236; 17.7396; 19.7236 90; 91.09; 90 | 1792.37 | Murtaza, Ghulam; Khan, Majid; Farooq, Saba; Choudhary, M. Iqbal; Yousuf, Sammer New cocrystals of heterocyclic drugs: structural, antileishmanial, larvicidal and urease inhibition studies. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 237-248 |
2312153 | CIF HKL Paper | C28 H20 Cl N4 P Te | P 1 21/n 1 | 18.2538; 7.3008; 20.0497 90; 106.867; 90 | 2557.02 | Nag, Tamali; Ovens, Jeffrey S.; Bryce, David L. <sup>77</sup>Se and <sup>125</sup>Te solid-state NMR and X-ray diffraction structural study of chalcogen-bonded 3,4-dicyano-1,2,5-chalcogenodiazole cocrystals. Acta crystallographica. Section C, Structural chemistry, 2022, 78, 517-523 |
2312154 | CIF HKL Paper | C12 H20 Cl N4 P Te | P -1 | 6.95; 9.5921; 13.604 102.427; 101.89; 91.876 | 863.8 | Nag, Tamali; Ovens, Jeffrey S.; Bryce, David L. <sup>77</sup>Se and <sup>125</sup>Te solid-state NMR and X-ray diffraction structural study of chalcogen-bonded 3,4-dicyano-1,2,5-chalcogenodiazole cocrystals. Acta crystallographica. Section C, Structural chemistry, 2022, 78, 517-523 |
2312155 | CIF HKL Paper | C14 H6 N8 O2 Se2 | P 1 21/c 1 | 6.2634; 7.4089; 18.32 90; 96.42; 90 | 844.8 | Nag, Tamali; Ovens, Jeffrey S.; Bryce, David L. <sup>77</sup>Se and <sup>125</sup>Te solid-state NMR and X-ray diffraction structural study of chalcogen-bonded 3,4-dicyano-1,2,5-chalcogenodiazole cocrystals. Acta crystallographica. Section C, Structural chemistry, 2022, 78, 517-523 |
2312156 | CIF HKL Paper | C26 H28 N4 O10 Zr | P 1 2/n 1 | 11.3873; 9.0517; 14.4136 90; 113.225; 90 | 1365.28 | Harmošová, Michaela; Vilková, Mária; Kello, Martin; Smolko, Lukáš; Samol'ová, Erika; Šebová, Dominika; Potočňák, Ivan Low-dimensional compounds containing bioactive ligands. XXII. First crystal structure, cytotoxic activity and DNA and HSA binding of a zirconium(IV) complex with 8-hydroxyquinoline-2-carboxylic acid. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312157 | CIF HKL Paper | C19 H17 N O2 | P -1 | 7.774; 7.9955; 12.4836 106.383; 98.191; 93.279 | 732.96 | Yahiaoui, Ahmed Abderrahim; Ghichi, Nadir; Hannachi, Douniazed; Mezhoud, Bilel; Djedouani, Amel; Kraim, Khairedine; Crochet, Aurélien; Stoeckli-Evans, Helen The synthesis and crystal structure of (E)-2-{[(4-methoxynaphthalen-1-yl)methylidene]amino}-4-methylphenol: Hirshfeld surface analysis, DFT calculations and anticorrosion studies. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312275 | CIF HKL Paper | Cd Cu2 S4 Si | P m n 21 | 7.60853; 6.48071; 6.24923 90; 90; 90 | 308.141 | Treece, Megan M.; Kelly, Jordan C.; Rosello, Kate E.; Craig, Andrew J.; Aitken, Jennifer A. Accurate X-ray diffraction data required for proper evaluation of bond valence sums and global instability indexes: redetermination of the crystal structures of diamond-like Cu<sub>2</sub>CdSiS<sub>4</sub> and Cu<sub>2</sub>HgSnS<sub>4</sub> as a case study. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312276 | CIF HKL Paper | Cu2 Hg S4 Sn | I -4 2 m | 5.5798; 5.5798; 10.86 90; 90; 90 | 338.12 | Treece, Megan M.; Kelly, Jordan C.; Rosello, Kate E.; Craig, Andrew J.; Aitken, Jennifer A. Accurate X-ray diffraction data required for proper evaluation of bond valence sums and global instability indexes: redetermination of the crystal structures of diamond-like Cu<sub>2</sub>CdSiS<sub>4</sub> and Cu<sub>2</sub>HgSnS<sub>4</sub> as a case study. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312277 | CIF HKL Paper | C21 H21 N3 O3 | P 1 21/n 1 | 7.4355; 34.195; 7.7242 90; 112.512; 90 | 1814.3 | Scheepers, Matthew Clarke; Lemmerer, Andreas The synthesis and characterization of a series of cocrystals of an isoniazid derivative with butan-2-one and propan-2-one. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312278 | CIF HKL Paper | C17 H19 N3 O5 | P 1 21/n 1 | 11.0834; 13.8364; 12.0014 90; 115.71; 90 | 1658.26 | Scheepers, Matthew Clarke; Lemmerer, Andreas The synthesis and characterization of a series of cocrystals of an isoniazid derivative with butan-2-one and propan-2-one. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312279 | CIF HKL Paper | C20 H19 N3 O3 | C 1 c 1 | 7.6312; 33.5293; 7.3493 90; 114.298; 90 | 1713.88 | Scheepers, Matthew Clarke; Lemmerer, Andreas The synthesis and characterization of a series of cocrystals of an isoniazid derivative with butan-2-one and propan-2-one. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312280 | CIF HKL Paper | C17 H17 Cl N4 O5 | P 1 21/n 1 | 7.2682; 34.0775; 7.6124 90; 111.081; 90 | 1759.27 | Scheepers, Matthew Clarke; Lemmerer, Andreas The synthesis and characterization of a series of cocrystals of an isoniazid derivative with butan-2-one and propan-2-one. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312281 | CIF HKL Paper | C17 H19 N3 O5 | P -1 | 9.2054; 11.5589; 15.6268 92.383; 93.092; 90.666 | 1658.74 | Scheepers, Matthew Clarke; Lemmerer, Andreas The synthesis and characterization of a series of cocrystals of an isoniazid derivative with butan-2-one and propan-2-one. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312282 | CIF HKL Paper | C8 H6 N4 S2 | P -1 | 5.6832; 7.4639; 11.7473 91.524; 95.245; 106.024 | 476.24 | Wzgarda-Raj, Kinga; Dominikowska, Justyna; Husik, Natallia; Rybarczyk-Pirek, Agnieszka J 2,2'-Dithiobispyrazine: about the disulfide bond. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312301 | CIF HKL Paper | C15 H17 N O4 | P 1 21/c 1 | 11.7637; 11.746; 10.3316 90; 111.384; 90 | 1329.31 | Kennedy, Alan R.; Cruickshank, Laura; Maher, Pamela; McKinnon, Zoe A structural comparison of salt forms of dopamine with the structures of other phenylethylamines. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312302 | CIF HKL Paper | C15 H16 N2 O6 | P 1 21/n 1 | 7.4993; 18.5051; 10.761 90; 99.628; 90 | 1472.33 | Kennedy, Alan R.; Cruickshank, Laura; Maher, Pamela; McKinnon, Zoe A structural comparison of salt forms of dopamine with the structures of other phenylethylamines. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312303 | CIF HKL Paper | C18 H28 N2 O10 S2 | P b c a | 10.6328; 8.5651; 23.8669 90; 90; 90 | 2173.6 | Kennedy, Alan R.; Cruickshank, Laura; Maher, Pamela; McKinnon, Zoe A structural comparison of salt forms of dopamine with the structures of other phenylethylamines. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312304 | CIF HKL Paper | C14 H19 N O7 S | P 1 21/c 1 | 17.4085; 11.9234; 7.6779 90; 95.273; 90 | 1586.95 | Kennedy, Alan R.; Cruickshank, Laura; Maher, Pamela; McKinnon, Zoe A structural comparison of salt forms of dopamine with the structures of other phenylethylamines. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312305 | CIF HKL Paper | C6 H12 Bi O9 | P -1 | 7.6518; 8.2376; 9.6402 102.414; 93.1; 115.838 | 526.51 | Timakova, Evgeniya V.; Afonina, Liubov I.; Drebushchak, Tatiana N.; Zakharov, Boris A. Two new bismuth salts with succinic acid: synthesis, structural, spectroscopic and thermal characterization. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312306 | CIF HKL Paper | C8 H14 Bi2 O12 | P -1 | 7.8258; 9.6629; 10.1924 81.457; 75.553; 77.881 | 725.97 | Timakova, Evgeniya V.; Afonina, Liubov I.; Drebushchak, Tatiana N.; Zakharov, Boris A. Two new bismuth salts with succinic acid: synthesis, structural, spectroscopic and thermal characterization. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312307 | CIF HKL Paper | C81 H58 Cl2 O38 P2 | C 1 2/c 1 | 28.778; 16.511; 34.938 90; 108.189; 90 | 15771 | Som, Shubham; Hasija, Avantika; Chopra, Deepak From liquid to crystal via mechanochemical grinding: unique host-guest (HOF) cocrystal. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312308 | CIF HKL Paper | C16 H12 N2 O10 Tc2 | P n a 21 | 18.116; 10.359; 12.148 90; 90; 90 | 2280 | Zuhayra, Maaz; Lützen, Arne; Ruiz, Miguel A. X-ray-determined structure of the technetium complex [Tc<sub>2</sub>(μ-CO)<sub>2</sub>(NC<sub>5</sub>H<sub>5</sub>)<sub>2</sub>(CO)<sub>6</sub>] revisited: [Tc<sub>2</sub>(μ-OMe)<sub>2</sub>(NC<sub>5</sub>H<sub>5</sub>)<sub>2</sub>(CO)<sub>6</sub>] as the correct formulation. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312309 | CIF HKL Paper | C18 H16 N2 O8 Tc2 | P n a 21 | 18.116; 10.359; 12.148 90; 90; 90 | 2280 | Zuhayra, Maaz; Lützen, Arne; Ruiz, Miguel A. X-ray-determined structure of the technetium complex [Tc<sub>2</sub>(μ-CO)<sub>2</sub>(NC<sub>5</sub>H<sub>5</sub>)<sub>2</sub>(CO)<sub>6</sub>] revisited: [Tc<sub>2</sub>(μ-OMe)<sub>2</sub>(NC<sub>5</sub>H<sub>5</sub>)<sub>2</sub>(CO)<sub>6</sub>] as the correct formulation. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312310 | CIF HKL Paper | C10 H15 Cl N6 O4 | P -1 | 8.3769; 8.7294; 9.7804 74.8391; 79.5481; 78.3934 | 669.88 | Sangavi, Marimuthu; Kumaraguru, Narayanasamy; McMillen, Colin D.; Butcher, Ray J. Supramolecular interactions in some organic hydrated 2,4,6-triaminopyrimidinium carboxylate and sulfate salts. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312311 | CIF HKL Paper | C11 H16 N6 O6 | P 1 21/c 1 | 8.2567; 12.7736; 13.2612 90; 102.433; 90 | 1365.8 | Sangavi, Marimuthu; Kumaraguru, Narayanasamy; McMillen, Colin D.; Butcher, Ray J. Supramolecular interactions in some organic hydrated 2,4,6-triaminopyrimidinium carboxylate and sulfate salts. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312312 | CIF HKL Paper | C4 H11 N5 O5 S | P 1 21/n 1 | 9.0198; 10.1953; 9.8987 90; 103.305; 90 | 885.85 | Sangavi, Marimuthu; Kumaraguru, Narayanasamy; McMillen, Colin D.; Butcher, Ray J. Supramolecular interactions in some organic hydrated 2,4,6-triaminopyrimidinium carboxylate and sulfate salts. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312313 | CIF HKL Paper | C11 H15 N7 O8 | P -1 | 6.977; 10.5805; 11.217 83.491; 87.651; 80.623 | 811.5 | Sangavi, Marimuthu; Kumaraguru, Narayanasamy; McMillen, Colin D.; Butcher, Ray J. Supramolecular interactions in some organic hydrated 2,4,6-triaminopyrimidinium carboxylate and sulfate salts. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312314 | CIF HKL Paper | C34 H22 N4 | P -1 | 8.5339; 11.8471; 13.2628 87.563; 71.508; 85.627 | 1267.72 | Chen, Ziqiang; Xin, Gaojie; Gao, Penglian; Jin, Yingying Synthesis, structures and properties of two donor-acceptor acridone-based compounds. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312315 | CIF HKL Paper | C34 H20 N4 | P 1 21/c 1 | 11.7306; 7.1509; 29.769 90; 96.28; 90 | 2482.2 | Chen, Ziqiang; Xin, Gaojie; Gao, Penglian; Jin, Yingying Synthesis, structures and properties of two donor-acceptor acridone-based compounds. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312316 | CIF HKL Paper | C44 H52 Cu2 K2 O4 | P -1 | 9.6864; 10.484; 10.658 66.22; 89.67; 82.73 | 981.3 | Young, Jr, Victor G; Brennessel, William W.; Ellis, John E. Crystal structure and synthesis of the bis(anthracene)dicuprate dianion as the dipotassium salt, [K(tetrahydrofuran)<sub>2</sub>]<sub>2</sub>[{Cu(9,10-η<sup>2</sup>-anthracene)}<sub>2</sub>], the first anionic arene complex of copper. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 456-463 |
2312321 | CIF HKL Paper | C13 H12 F3 N3 O S | P 1 21/c 1 | 7.2418; 28.0107; 7.3569 90; 116.29; 90 | 1337.97 | Pyrih, Andrii; Łapiński, Andrzej; Zięba, Sylwia; Mizera, Adam; Lesyk, Roman; Gzella, Andrzej K.; Jaskolski, Mariusz Proton tautomerism and stereoisomerism in 5-[(dimethylamino)methylidene]-4-[3/4-(trifluoromethylphenyl)amino]-1,3-thiazol-2(5H)-ones: synthesis, crystal structure and spectroscopic studies. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312322 | CIF HKL Paper | C13 H12 F3 N3 O S | P 1 21/c 1 | 6.1727; 27.9473; 7.6297 90; 90.123; 90 | 1316.2 | Pyrih, Andrii; Łapiński, Andrzej; Zięba, Sylwia; Mizera, Adam; Lesyk, Roman; Gzella, Andrzej K.; Jaskolski, Mariusz Proton tautomerism and stereoisomerism in 5-[(dimethylamino)methylidene]-4-[3/4-(trifluoromethylphenyl)amino]-1,3-thiazol-2(5H)-ones: synthesis, crystal structure and spectroscopic studies. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312323 | CIF HKL Paper | C16 H16 Br N3 | P -1 | 7.8073; 9.8003; 10.79 72.964; 85.084; 74.448 | 760.44 | Moreno-Suárez, Erika; Avila-Acosta, Rafael; Sánchez-Ramírez, Karen; Castillo, Juan Carlos; Macías, Mario A Crystallographic, spectroscopic and thermal studies of 1-(4-bromophenyl)-5-(2,5-dimethyl-1H-pyrrol-1-yl)-3-methyl-1H-pyrazole. Acta crystallographica. Section C, Structural chemistry, 2023, 79 |
2312333 | CIF HKL Paper | C32 H28 Cl6 N8 Ru | P -1 | 11.2435; 11.4038; 13.634 74.278; 75.995; 84.642 | 1631.99 | Faller, Jack; Chase, Kevin J.; Parr, Jonathan; Mercado, Brandon Studies of κ<sup>2</sup>- and κ<sup>3</sup>-tripyridylamine complexes of ruthenium and π-stacking by pyridyls. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 491-496 |
2312334 | CIF HKL Paper | C31 H25 Cl4 F6 N8 Ru Sb | P 1 21/n 1 | 8.3209; 27.3213; 15.7839 90; 99.554; 90 | 3538.5 | Faller, Jack; Chase, Kevin J.; Parr, Jonathan; Mercado, Brandon Studies of κ<sup>2</sup>- and κ<sup>3</sup>-tripyridylamine complexes of ruthenium and π-stacking by pyridyls. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 491-496 |
2312347 | CIF HKL Paper | C30 H26 Cl3 N O4 | P 1 21 1 | 10.0732; 10.0051; 14.7474 90; 109.945; 90 | 1397.15 | Czapik, Agnieszka; Kwit, Marcin Diversity of N-triphenylacetyl-L-tyrosine solvates with halogenated solvents. Acta crystallographica. Section C, Structural chemistry, 2021, 77, 745-756 |
2312348 | CIF HKL Paper | C30 H27 Cl2 N O4 | P 1 21 1 | 10.04475; 9.82563; 14.59465 90; 108.742; 90 | 1364.05 | Czapik, Agnieszka; Kwit, Marcin Diversity of N-triphenylacetyl-L-tyrosine solvates with halogenated solvents. Acta crystallographica. Section C, Structural chemistry, 2021, 77, 745-756 |
2312349 | CIF HKL Paper | C30 H26 Cl3 N O4 | P 21 21 2 | 9.27898; 32.3574; 9.96336 90; 90; 90 | 2991.44 | Czapik, Agnieszka; Kwit, Marcin Diversity of N-triphenylacetyl-L-tyrosine solvates with halogenated solvents. Acta crystallographica. Section C, Structural chemistry, 2021, 77, 745-756 |
2312350 | CIF HKL Paper | C29.1 H25.2 Cl0.2 N O4 | P 21 21 21 | 9.28862; 10.34013; 24.3525 90; 90; 90 | 2338.95 | Czapik, Agnieszka; Kwit, Marcin Diversity of N-triphenylacetyl-L-tyrosine solvates with halogenated solvents. Acta crystallographica. Section C, Structural chemistry, 2021, 77, 745-756 |
2312351 | CIF HKL Paper | C30.5 H26.5 Cl4.5 N O4 | P 1 21/c 1 | 10.00099; 9.33129; 31.8959 90; 90.4958; 90 | 2976.48 | Czapik, Agnieszka; Kwit, Marcin Diversity of N-triphenylacetyl-L-tyrosine solvates with halogenated solvents. Acta crystallographica. Section C, Structural chemistry, 2021, 77, 745-756 |
2312363 | CIF HKL Paper | C10 H16 Cl2 Co0.2 N4 Zn0.8 | C 1 2/c 1 | 15.0191; 8.304; 23.9862 90; 95.8239; 90 | 2976.08 | Adach, Anna; Tyszka-Czochara, Małgorzata; Daszkiewicz, Marek An efficient one-pot synthesis of pyrazole complexes formed in situ: synthesis, crystal structure, Hirshfeld surface analysis and in vitro biological properties. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 520-529 |
2312364 | CIF HKL Paper | C20 H30 Br1.4 Cl0.6 Co0.2 N8 Zn1.8 | P -1 | 8.2698; 8.406; 10.3062 84.826; 69.156; 87.133 | 666.7 | Adach, Anna; Tyszka-Czochara, Małgorzata; Daszkiewicz, Marek An efficient one-pot synthesis of pyrazole complexes formed in situ: synthesis, crystal structure, Hirshfeld surface analysis and in vitro biological properties. Acta crystallographica. Section C, Structural chemistry, 2023, 79, 520-529 |
2312365 | CIF HKL Paper | C14 H14 N2 O6 U | P 1 21/n 1 | 7.734; 19.01; 10.6154 90; 96.106; 90 | 1551.9 | Whittington, Abigail A.; Keimowitz, Alison R.; Tanski, Joseph M. Crystal structures of three uranyl-acetate-bipyridine complexes crystallized from hydraulic fracking fluid. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312366 | CIF HKL Paper | C34 H36 N6 O15 U3 | P 1 21/n 1 | 13.809; 12.6324; 23.699 90; 103.412; 90 | 4021.3 | Whittington, Abigail A.; Keimowitz, Alison R.; Tanski, Joseph M. Crystal structures of three uranyl-acetate-bipyridine complexes crystallized from hydraulic fracking fluid. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312367 | CIF HKL Paper | C24 H22 N4 O6 U | P -1 | 8.006; 8.786; 8.833 78.274; 84.648; 74.814 | 586.6 | Whittington, Abigail A.; Keimowitz, Alison R.; Tanski, Joseph M. Crystal structures of three uranyl-acetate-bipyridine complexes crystallized from hydraulic fracking fluid. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312385 | CIF HKL Paper | C10 H13 N5 O3 | P 1 | 5.2027; 8.9738; 12.3715 78.249; 83.171; 76.338 | 547.97 | Leonard, Peter; Zhang, Aigui; Budow-Busse, Simone; Daniliuc, Constantin; Seela, Frank α-D-2'-Deoxyadenosine, an irradiation product of canonical DNA and a component of anomeric nucleic acids: crystal structure, packing and Hirshfeld surface analysis. Acta crystallographica. Section C, Structural chemistry, 2024, 80, 21-29 |
2312393 | CIF HKL Paper | C41 H47 Br F N7 O7 S | P -1 | 12.5755; 12.6649; 14.4336 68.909; 82.733; 75.557 | 2075.3 | Yang, Haiwu; Liang, Minyi; Tian, Fang Crystal structure and Hirshfeld surface analysis of a salt of antineoplastic kinase inhibitor vandetanib. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312394 | CIF HKL Paper | C22 H32.64 Ag N9 O13.32 S2 | C 2 2 21 | 4.8791; 22.049; 28.256 90; 90; 90 | 3039.8 | Al-Mahamad, Lamia L G; Clegg, William Synthesis and crystal structure of a silver(I) 6-methylmercaptopurine riboside complex. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312395 | CIF HKL Paper | C52 H40 F4 N4 Pt | I 4/m | 17.1883; 17.1883; 9.1123 90; 90; 90 | 2692.1 | Dash, Zane S.; Huang, Raymond Q.; Kimber, Ana N.; Olubajo, Opeyemi T.; Polk, Mark; Rancu, Oliver P.; Zhang, Lauren L.; Fu, Jane; Nagelj, Nejc; Reynolds, Kristopher G.; Zheng, Shao Liang; Dogutan, Dilek K. Oxygen quenching of structurally characterized [5,10,15,20-tetrakis(4-fluoro-2,6-dimethylphenyl)porphyrinato]platinum(II). Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312396 | CIF Paper | C27 H41 N3 O5 | I 1 2 1 | 40.2744; 5.0976; 27.698 90; 105.729; 90 | 5473.5 | Gurung, Kshitij; Šimek, Petr; Jegorov, Jr, Alexandr; Palatinus, Lukáš Structure and absolute configuration of natural fungal product beauveriolide I, isolated from Cordyceps javanica, determined by 3D electron diffraction. Acta crystallographica. Section C, Structural chemistry, 2024, 80, 56-61 |
2312397 | CIF Paper | C58 H52 N4 O8 | P 21 21 21 | 33.5486; 26.4223; 5.36515 90; 90; 90 | 4755.84 | Guerain, Mathieu; Correia, Natalia T.; Roca-Paixão, Luisa; Chevreau, Hubert; Affouard, Frederic Using synchrotron high-resolution powder X-ray diffraction for the structure determination of a new cocrystal formed by two active principle ingredients. Acta crystallographica. Section C, Structural chemistry, 2024, 80, 37-42 |
2312416 | CIF Paper | C36 H42 Cl2 N2 O3 | C 1 2/c 1 | 13.8926; 11.9663; 19.3872 90; 100.384; 90 | 3170.2 | Wood, Matthew R.; Bernal, Ivan; Lalancette, Roger A. Crystal structure and analytical profile of 1,2-diphenyl-2-pyrrolidin-1-ylethanone hydrochloride or `α-D2PV': a synthetic cathinone seized by law enforcement, along with its diluent sugar, myo-inositol. Acta crystallographica. Section C, Structural chemistry, 2024, 80, 91-97 |
2312417 | CIF Paper | C6 H12 O6 | P 1 21/n 1 | 6.61708; 12.0474; 18.88721 90; 93.9791; 90 | 1502.03 | Wood, Matthew R.; Bernal, Ivan; Lalancette, Roger A. Crystal structure and analytical profile of 1,2-diphenyl-2-pyrrolidin-1-ylethanone hydrochloride or `α-D2PV': a synthetic cathinone seized by law enforcement, along with its diluent sugar, myo-inositol. Acta crystallographica. Section C, Structural chemistry, 2024, 80, 91-97 |
2312418 | CIF HKL Paper | C29 H21 Br N4 O5 Zn | P 1 21/c 1 | 9.73; 16.52; 17.649 90; 103.19; 90 | 2762 | Wang, Yan; Cheng, Wei Wei; Mou, Yi; Wen, Shuai; Wang, Dongkai; Xue, Yun Shan A twofold interpenetrated two-dimensional zinc(II) coordination polymer for the highly sensitive detection of nitrofurantoin in aqueous medium. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312419 | CIF HKL Paper | C20 H20 N6 O | P -1 | 9.455; 9.628; 12.023 69.506; 79.904; 66.215 | 937.4 | Song, Huijie; Peng, Ri; Zuo, Yi; Wang, Tao; Zhu, Dunru Syntheses, crystal structures and intermolecular interactions of six novel pyrimidin-2-yl-substituted triaryltriazoles. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312420 | CIF HKL Paper | C17 H12 N6 | P b c a | 8.5626; 18.701; 19.024 90; 90; 90 | 3046.3 | Song, Huijie; Peng, Ri; Zuo, Yi; Wang, Tao; Zhu, Dunru Syntheses, crystal structures and intermolecular interactions of six novel pyrimidin-2-yl-substituted triaryltriazoles. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312421 | CIF HKL Paper | C17 H11 Br N6 | P -1 | 8.551; 9.4214; 11.5813 85.894; 70.776; 65.64 | 800.3 | Song, Huijie; Peng, Ri; Zuo, Yi; Wang, Tao; Zhu, Dunru Syntheses, crystal structures and intermolecular interactions of six novel pyrimidin-2-yl-substituted triaryltriazoles. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312422 | CIF HKL Paper | C17 H11 Cl N6 | P -1 | 8.5105; 9.3681; 10.8959 81.355; 82.482; 67.388 | 790.3 | Song, Huijie; Peng, Ri; Zuo, Yi; Wang, Tao; Zhu, Dunru Syntheses, crystal structures and intermolecular interactions of six novel pyrimidin-2-yl-substituted triaryltriazoles. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312423 | CIF HKL Paper | C17 H11 F N6 | P -1 | 8.624; 9.503; 10.471 80.312; 81.512; 64.78 | 762.5 | Song, Huijie; Peng, Ri; Zuo, Yi; Wang, Tao; Zhu, Dunru Syntheses, crystal structures and intermolecular interactions of six novel pyrimidin-2-yl-substituted triaryltriazoles. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312424 | CIF HKL Paper | C18 H14 N6 | P b c a | 15.7069; 11.8266; 17.5763 90; 90; 90 | 3265 | Song, Huijie; Peng, Ri; Zuo, Yi; Wang, Tao; Zhu, Dunru Syntheses, crystal structures and intermolecular interactions of six novel pyrimidin-2-yl-substituted triaryltriazoles. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312429 | CIF HKL Paper | C20 H14 N2 O4 | P -1 | 7.6186; 9.4985; 11.9173 105.38; 95.005; 93.78 | 824.78 | Balasubramanian, Hemalatha; Mariappan, Petchi Raman; Poomani, Kumaradhas Crystal structure, intermolecular interactions, charge-density distribution and ADME properties of the acridinium 4-nitrobenzoate and 2-amino-3-methylpyridinium 4-nitrobenzoate salts: a combined experimental and theoretical study. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312430 | CIF HKL Paper | C13 H13 N3 O4 | P 1 21 1 | 8.2555; 6.752; 11.8096 90; 90.573; 90 | 658.25 | Balasubramanian, Hemalatha; Mariappan, Petchi Raman; Poomani, Kumaradhas Crystal structure, intermolecular interactions, charge-density distribution and ADME properties of the acridinium 4-nitrobenzoate and 2-amino-3-methylpyridinium 4-nitrobenzoate salts: a combined experimental and theoretical study. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312458 | CIF HKL Paper | C22 H22 N2 O2 | P 1 21/c 1 | 12.8456; 5.5803; 16.7446 90; 132.566; 90 | 884.01 | Jozuka, Wataru; Kim, Sung Hoon; Matsumoto, Shinya Three polymorphs of a new N,N'-dipropylated isoindigo derivative. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312459 | CIF HKL Paper | C22 H22 N2 O2 | C 1 2/c 1 | 35.4947; 5.5238; 18.9927 90; 109.151; 90 | 3517.73 | Jozuka, Wataru; Kim, Sung Hoon; Matsumoto, Shinya Three polymorphs of a new N,N'-dipropylated isoindigo derivative. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312460 | CIF HKL Paper | C22 H22 N2 O2 | P 1 21/c 1 | 15.0486; 9.1347; 18.5227 90; 136.112; 90 | 1765.16 | Jozuka, Wataru; Kim, Sung Hoon; Matsumoto, Shinya Three polymorphs of a new N,N'-dipropylated isoindigo derivative. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312461 | CIF Paper | C12 H13 N3 O4 S | P 1 21 1 | 5.8163; 6.9218; 15.6295 90; 93.354; 90 | 628.154 | Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes. Acta crystallographica. Section C, Structural chemistry, 2024, 80, 66-79 |
2312462 | CIF Paper | C12 H17 N3 O7 S | P -1 | 8.2876; 10.6404; 17.4834 89.734; 84.793; 86.146 | 1531.91 | Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes. Acta crystallographica. Section C, Structural chemistry, 2024, 80, 66-79 |
2312463 | CIF Paper | C12 H17 N4 O4.5 S | C 1 2/c 1 | 35.1636; 7.8905; 10.4972 90; 100.091; 90 | 2867.5 | Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes. Acta crystallographica. Section C, Structural chemistry, 2024, 80, 66-79 |
2312464 | CIF Paper | C16 H24 N4 O6 S | P -1 | 8.4933; 13.0977; 17.1657 90.97; 103.18; 95.132 | 1850.43 | Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes. Acta crystallographica. Section C, Structural chemistry, 2024, 80, 66-79 |
2312465 | CIF Paper | C12 H13 N3 O4 S | P c c n | 12.6592; 28.3597; 7.1268 90; 90; 90 | 2558.6 | Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes. Acta crystallographica. Section C, Structural chemistry, 2024, 80, 66-79 |
2312466 | CIF Paper | C12 H11 K N2 O5 S | P -1 | 5.962; 7.2033; 31.929 83.852; 86.361; 88.868 | 1360.5 | Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes. Acta crystallographica. Section C, Structural chemistry, 2024, 80, 66-79 |
2312467 | CIF Paper | C12 H14 K N3 O5 S | P -1 | 13.3058; 13.6247; 18.4664 88.373; 73.971; 66.313 | 2933.52 | Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes. Acta crystallographica. Section C, Structural chemistry, 2024, 80, 66-79 |
2312468 | CIF Paper | C16 H22 K N3 O7 S | P 1 21/n 1 | 9.4006; 12.1583; 34.4743 90; 95.496; 90 | 3922.14 | Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes. Acta crystallographica. Section C, Structural chemistry, 2024, 80, 66-79 |
2312469 | CIF Paper | C12 H9 K N2 O4 S | P c c n | 12.5535; 27.9698; 6.9982 90; 90; 90 | 2457.2 | Kennedy, Alan R.; Kirkhouse, Jennifer B. A.; McCarney, Karen M.; Puissegur, Olivier Isostructural behaviour in ammonium and potassium salt forms of sulfonated azo dyes. Acta crystallographica. Section C, Structural chemistry, 2024, 80, 66-79 |
2312470 | CIF Paper | C13 H14 O5 | P 21 21 21 | 4.9524; 11.0302; 20.9007 90; 90; 90 | 1141.72 | Decato, Daniel; Palatinus, Lukáš; Stierle, Andrea; Stierle, Donald Absolute structure determination of Berkecoumarin by X-ray and electron diffraction. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312471 | CIF HKL Paper | C44 H48 Cl6 Fe3 N16 O | P -1 | 8.9568; 12.8555; 12.8951 116.349; 91.178; 91.622 | 1329.09 | Pacholski, Roman; Durka, Krzysztof; Buchalski, Piotr Synthesis and crystal structure of an iron triazole complex resulting from the unexpected ligand cleavage of a triazolium carbene precursor. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312472 | CIF Paper | C68 H56 B3 Ce Cl4 N12 O6 | P 1 21/c 1 | 11.2742; 27.1355; 21.3644 90; 90.166; 90 | 6536 | Thomas, Jarrod R.; Sulway, Scott A. Borotropic shifting of the [hydrotris(2'-furyl)pyrazol-1-yl]borate ligand in high-coordinate lanthanide complexes. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312473 | CIF Paper | C67 H54 B3 Cl2 Dy N12 O6 | P -1 | 12.1461; 16.1883; 17.1795 102.659; 103.322; 95.948 | 3164.6 | Thomas, Jarrod R.; Sulway, Scott A. Borotropic shifting of the [hydrotris(2'-furyl)pyrazol-1-yl]borate ligand in high-coordinate lanthanide complexes. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312474 | CIF Paper | C66 H52 B3 Dy N12 O6 | P -1 | 11.72; 11.9389; 21.9139 75.579; 76.715; 86.477 | 2890.2 | Thomas, Jarrod R.; Sulway, Scott A. Borotropic shifting of the [hydrotris(2'-furyl)pyrazol-1-yl]borate ligand in high-coordinate lanthanide complexes. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312475 | CIF HKL Paper | Ge29.7 Mg22.3 Ni64 | F m -3 m | 11.5036; 11.5036; 11.5036 90; 90; 90 | 1522.3 | Pavlyuk, Nazar; Dmytriv, Grygoriy; Bondaruk, Alina; Ciesielski, Wojciech; Pavlyuk, Volodymyr Crystal, electronic structure and hydrogenation properties of the Mg<sub>5.57</sub>Ni<sub>16</sub>Ge<sub>7.43</sub> cluster phase with a new type of polyhedron. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312476 | CIF HKL Paper | C6 H10 N8 O12 | P b c a | 21.4196; 6.1927; 21.9265 90; 90; 90 | 2908.44 | Domasevitch, Kostiantyn V.; Krautscheid, Harald Two metastable high hydrates of energetic material 3,3',5,5'-tetranitro-4,4'-bipyrazole. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312477 | CIF HKL Paper | C6 H12 N8 O13 | P 1 21/c 1 | 11.2164; 20.8114; 6.6646 90; 90.435; 90 | 1555.67 | Domasevitch, Kostiantyn V.; Krautscheid, Harald Two metastable high hydrates of energetic material 3,3',5,5'-tetranitro-4,4'-bipyrazole. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312478 | CIF Paper | C10 H16 Cu4 N6 O2 | C 1 2/c 1 | 9.6829; 8.2557; 21.4992 90; 95.212; 90 | 1711.52 | Corfield, Peter W. R.; Elsayed, Ahmed; DaCunha, Tristan; Bender, Christopher Crystal structures, electron spin resonance, and thermogravimetric analysis of three mixed-valence copper cyanide polymers. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312479 | CIF Paper | C10 H18 Cu3 N6 O2 | P 1 21/c 1 | 9.3903; 8.9608; 9.7986 90; 112.134; 90 | 763.74 | Corfield, Peter W. R.; Elsayed, Ahmed; DaCunha, Tristan; Bender, Christopher Crystal structures, electron spin resonance, and thermogravimetric analysis of three mixed-valence copper cyanide polymers. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312480 | CIF Paper | C8 H14 Cu3 N6 O2 | P 1 21/c 1 | 9.5158; 8.8022; 9.3589 90; 117.358; 90 | 696.22 | Corfield, Peter W. R.; Elsayed, Ahmed; DaCunha, Tristan; Bender, Christopher Crystal structures, electron spin resonance, and thermogravimetric analysis of three mixed-valence copper cyanide polymers. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312483 | CIF Paper | C12 H16 N2 O4 | P 41 21 2 | 11.1312; 11.1312; 10.894 90; 90; 90 | 1349.8 | González-González, Juan Saulo; Martínez-Santos, Alfonso; Emparán-Legaspi, María José; Pineda-Contreras, Armando; Martínez-Martínez, Francisco Javier; Flores-Alamo, Marcos; García-Ortega, Hector Molecular structure and selective theophylline complexation by conformational change of diethyl N,N'-(1,3-phenylene)dicarbamate. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312484 | CIF Paper | C19 H24 N6 O6 | P -1 | 7.5284; 11.2362; 12.2606 85.742; 76.887; 79.803 | 993.5 | González-González, Juan Saulo; Martínez-Santos, Alfonso; Emparán-Legaspi, María José; Pineda-Contreras, Armando; Martínez-Martínez, Francisco Javier; Flores-Alamo, Marcos; García-Ortega, Hector Molecular structure and selective theophylline complexation by conformational change of diethyl N,N'-(1,3-phenylene)dicarbamate. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312485 | CIF Paper | C14 H18 N4 O9 | P -1 | 14.6803; 8.8743; 6.9537 106.922; 96.304; 97.55 | 848.64 | Guerain, Mathieu; Chevreau, Hubert; Guinet, Yannick; Paccou, Laurent; Elkaïm, Erik; Hédoux, Alain Relationship between synthesis method-crystal structure-melting properties in cocrystals: the case of caffeine-citric acid. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312503 | CIF HKL Paper | C44 H34 Cl2 Mn N6 O10 | P -1 | 8.93282; 12.32698; 18.86081 89.8757; 85.6122; 83.5667 | 2057.68 | Fajardo, Daniel A.; Arteaga, Danny; Ellena, Javier; Santiago, Pedro H. O.; D'Vries, Richard F; Lenis, Luis Alberto Synthesis, characterization and structural analysis of complexes from 2,2':6',2''-terpyridine derivatives with transition metals. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312504 | CIF HKL Paper | C42 H30 Cl2 Mn N6 O8 | P 1 21/c 1 | 9.51026; 12.5149; 31.2962 90; 96.878; 90 | 3698.07 | Fajardo, Daniel A.; Arteaga, Danny; Ellena, Javier; Santiago, Pedro H. O.; D'Vries, Richard F; Lenis, Luis Alberto Synthesis, characterization and structural analysis of complexes from 2,2':6',2''-terpyridine derivatives with transition metals. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312505 | CIF HKL Paper | C42 H30 Cl2 N6 Ni O8 | P 1 21/c 1 | 9.3581; 12.6255; 31.4046 90; 97.038; 90 | 3682.52 | Fajardo, Daniel A.; Arteaga, Danny; Ellena, Javier; Santiago, Pedro H. O.; D'Vries, Richard F; Lenis, Luis Alberto Synthesis, characterization and structural analysis of complexes from 2,2':6',2''-terpyridine derivatives with transition metals. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312506 | CIF HKL Paper | C18 H24 Ca O20 Zn | C 1 2/c 1 | 17.848; 20.106; 6.5975 90; 97.997; 90 | 2344.5 | Chinchan, Kunlanit; Jiajaroen, Suwadee; Theppitak, Chatphorn; Laksee, Sakchai; Sukwattanasinitt, Mongkol; Chainok, Kittipong Synthesis, structure and photoluminescence properties of heterometallic-based coordination polymers of trimesic acid. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312507 | CIF HKL Paper | C18 H24 Ca Co O20 | C 1 2/c 1 | 17.875; 20.192; 6.5339 90; 98.557; 90 | 2332 | Chinchan, Kunlanit; Jiajaroen, Suwadee; Theppitak, Chatphorn; Laksee, Sakchai; Sukwattanasinitt, Mongkol; Chainok, Kittipong Synthesis, structure and photoluminescence properties of heterometallic-based coordination polymers of trimesic acid. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312508 | CIF HKL Paper | C18 H30 Ca O24 Zn2 | C c c a :2 | 6.9927; 18.934; 20.808 90; 90; 90 | 2755 | Chinchan, Kunlanit; Jiajaroen, Suwadee; Theppitak, Chatphorn; Laksee, Sakchai; Sukwattanasinitt, Mongkol; Chainok, Kittipong Synthesis, structure and photoluminescence properties of heterometallic-based coordination polymers of trimesic acid. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312509 | CIF Paper | C52 H68 Cu2 O24 | P c c n | 27.7701; 21.2278; 9.3888 90; 90; 90 | 5534.7 | Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312510 | CIF Paper | C45 H61 Cu2 N O18 | P -1 | 10.1659; 10.7383; 12.9878 76.132; 69.646; 75.304 | 1267.74 | Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312511 | CIF Paper | C40 H49 Cu2 Li O24 | P -1 | 9.7711; 10.1924; 12.5863 73.615; 79.528; 83.412 | 1179.87 | Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312512 | CIF Paper | C43 H56 Cu2 N4 O15 | P -1 | 8.886; 10.702; 12.36 73.13; 73.07; 81.68 | 1073.8 | Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312513 | CIF Paper | C85 H108 Cu4 N2 O32 | P n m a | 12.833; 54.548; 12.119 90; 90; 90 | 8483 | Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312514 | CIF Paper | C44 H64 Cu2 N4 O20 | P -1 | 10.4964; 10.6595; 12.3226 97.271; 101.042; 108.13 | 1260.15 | Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312515 | CIF Paper | C68 H84 Cu2 N4 O21 | P -1 | 10.2155; 12.0897; 15.7111 69.581; 75.988; 79.651 | 1754.64 | Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312516 | CIF Paper | C38 H30 Cu2 N2 O15 | C 1 2/c 1 | 11.9851; 17.7472; 17.1294 90; 92.637; 90 | 3639.6 | Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312517 | CIF Paper | C56 H52 Cu2 N4 O20 | P b c a | 17.5993; 16.4583; 19.7389 90; 90; 90 | 5717.46 | Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312518 | CIF Paper | C41 H54 Cu2 O20 | I 1 2/a 1 | 19.4801; 13.0774; 34.5443 90; 97.702; 90 | 8720.7 | Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312519 | CIF Paper | C70 H120 Cu2 N4 O30 | P 1 c 1 | 9.7404; 20.3001; 22.9088 90; 118.494; 90 | 3981.1 | Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312520 | CIF Paper | C13 H18 N2 O3 | P 1 21/n 1 | 15.3994; 10.6592; 16.9261 90; 110.424; 90 | 2603.68 | Abrahams, Brendan F.; Commons, Christopher J.; Hudson, Timothy A.; Sanchez-Arlt, Robin Supramolecular hydrogen-bonded networks formed from copper(II) carboxylate dimers. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312521 | CIF Paper | C4 H4 F6 O6 S2 | P -1 | 10.036; 10.664; 11.276 83.54; 64.178; 89.593 | 1078.2 | Pickl, Thomas; Zuber, Julian; Stephan, Johannes; Pöthig, Alexander Crystal structure elucidation of a geminal and vicinal bis(trifluoromethanesulfonate) ester. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312522 | CIF Paper | C3 H2 F6 O6 S2 | P 1 21 1 | 8.9822; 4.9413; 10.94 90; 102.406; 90 | 474.22 | Pickl, Thomas; Zuber, Julian; Stephan, Johannes; Pöthig, Alexander Crystal structure elucidation of a geminal and vicinal bis(trifluoromethanesulfonate) ester. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312523 | CIF HKL Paper | C16 H31 Li N2 | P -1 | 6.316; 9.6925; 13.7463 97.336; 99.662; 93.52 | 819.83 | Erickson, Alexander N.; Haltiwanger, Curtis; Rahim, Masoumeh; Garner, Charles M. Preferential crystallization of (±)-pinenyllithium·TMEDA. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312524 | CIF Paper | C3 H8 N2 O4 | P b c a | 9.9714; 9.8671; 11.1884 90; 90; 90 | 1100.81 | Hollenwäger, Dirk; Nitzer, Alexander; Bockmair, Valentin; Kornath, Andreas J. The crystal structure of the ammonium salt of 2-aminomalonic acid. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312525 | CIF HKL Paper | C16 H24 N4 O6 | P -1 | 6.8383; 7.2272; 9.7427 82.921; 76.809; 82.043 | 462.18 | Balasubramanian, Hemalatha; Ashraf, Aarifa Muhammed; Karuppannan, Srikanth; Poomani, Kumaradhas Synthesis and structural investigation of salts of 2-amino-3-methylpyridine with carboxylic acid derivatives: an experimental and theoretical study. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
2312526 | CIF HKL Paper | C13 H13 Cl N2 O3 | P 1 21/c 1 | 11.7399; 8.3731; 13.6779 90; 106.782; 90 | 1287.27 | Balasubramanian, Hemalatha; Ashraf, Aarifa Muhammed; Karuppannan, Srikanth; Poomani, Kumaradhas Synthesis and structural investigation of salts of 2-amino-3-methylpyridine with carboxylic acid derivatives: an experimental and theoretical study. Acta crystallographica. Section C, Structural chemistry, 2024, 80 |
5000027 | CIF | C21 H22 N2 O2 | P 21 21 21 | 11.267; 11.892; 12.105 90; 90; 90 | 1621.91 | Glover, S. S. B.; Gould, R. O.; Walkinshaw, M. D. Structures of strychnine (I), C~21~H~22~N~2~O~2~, and a solvate of brucine (II), C~23~H~26~N~2~O~4~.C~2~H~6O~.2H~2~O Acta Crystallographica Section C, 1985, 41, 990-994 |
5000074 | CIF | C18 H21 N O3 | P 21 21 21 | 7.491; 13.697; 14.775 90; 90; 90 | 1515.98 | Canfield, D. V.; Barrick, J.; Giessen, B. C. Structure of codeine Acta Crystallographica Section C, 1987, 43, 977-979 |
5000087 | CIF | Pb S | F m -3 m | 5.9237; 5.9237; 5.9237 90; 90; 90 | 207.864 | Noda, Y.; Masumoto, K.; Ohba, S.; Saito, Y.; Toriumi, K.; Iwata, Y.; Shibuya, I. Temperature dependence of atomic thermal parameters of lead chalcogenides, PbS, PbSe and PbTe Locality: synthetic Sample: T = 200 K Acta Crystallographica, Section C, 1987, 43, 1443-1445 |
5000110 | CIF | C6 H13 N O2 | P 1 21 1 | 14.666; 5.324; 9.606 90; 94.06; 90 | 748.17 | Coll, M.; Solans, X.; Font-Altaba, M.; Subirana, J. A. Structure of L-leucine: a redetermination Acta Crystallographica Section C, 1986, 42, 599-601 |
5000133 | CIF | C18 H24 I N O4 | P 21 21 21 | 9.574; 10.614; 17.549 90; 90; 90 | 1783.3 | Wongweichintana, C.; Holt, E. M.; Purdie, N. Structures of morphine methyl iodide monohydrate, (C~18~H~22~NO~3~)^+^.I^-^.H~2~O, and di(morphine) dihydrogensulfate pentahydrate, 2(C~17~H~20~NO~3~)^+^.SO~4~^2-^.5H~2~O Acta Crystallographica Section C, 1984, 40, 1486-1490 |
5000182 | CIF | C22 H14 | P 1 21 1 | 8.48; 6.154; 13.515 90; 90.46; 90 | 705.27 | De, A.; Ghosh, R.; Roychowdhury, S.; Roychowdhury, P. Structural analysis of picene, C~22~H~14~ Acta Crystallographica Section C, 1985, 41, 907-909 |
5000226 | CIF | ? | P 1 21/c 1 | 7.257; 6.457; 12.378 90; 99.51; 90 | 572 | Eby, R. K.; Hawthorne, F. C. Clinoclase and the geometry of [5]-coordinate Cu^2+^ in minerals Acta Crystallographica Section C, 1990, 46, 2291-2294 |
5000267 | CIF | C26 H46 O9 | P 21 21 21 | 5.834; 20.035; 21.503 90; 90; 90 | 2513.36 | Mattia, C. A.; Mazzarella, L.; Puliti, R.; Riccio, R.; Minale, L. Structure and stereochemistry of (24R)-27-nor-5α-cholestane-3β,4β,5,6α,7β,8,14,15α,24-nonaol: a highly hydroxylated marine steroid from the starfish Archaster typicus Acta Crystallographica Section C, 1988, 44, 2170-2173 |
5000273 | CIF | C20 H18 N2 O5 S2 | P 1 21/c 1 | 9.934; 18.73; 10.563 90; 96.23; 90 | 1953.79 | Andersen, K. A.; Anderson, O. P. Structure of a model for aspirochlorine (antibiotic A30641) Acta Crystallographica Section C, 1991, 47, 1561-1563 |
6000573 | CIF | C4 H8 O | C 1 2/c 1 | 6.1464; 8.8767; 7.7154 90; 107.549; 90 | 401.36 | David, W. I. F.; Ibberson, R. M. A reinvestigation of the structure of tetrahydrofuran by high-resolution neutron powder diffraction Acta Crystallographica C, 1992, 48, 301-303 |
6000574 | CIF | C4 H8 O | C 1 2/c 1 | 6.1905; 8.9308; 7.8152 90; 107.022; 90 | 413.14 | David, W. I. F.; Ibberson, R. M. A reinvestigation of the structure of tetrahydrofuran by high-resolution neutron powder diffraction Acta Crystallographica C, 1992, 48, 301-303 |
6000600 | CIF | C18 H26 O | P b c a | 10.313; 11.049; 28.024 90; 90; 90 | 3193.29 | De Ridder, D. J. A.; Schenk, H. Crystal studies of musk compounds. III. Structures of 6-acetyl-1,1,2,3,3,5-hexamethylindan (musk phantolid)(I) and 6-acetyl-3-isopropyl-1,1,3,5-tetramethylindan(II) Acta Crystallographica Section C, 1991, 47, 1044-1047 |
9007703 | CIF | As D9 O10 U | P 4/n c c :2 | 7.1615; 7.1615; 17.639 90; 90; 90 | 904.653 | Fitch, A. N.; Bernard, L.; Howe, A. T.; Wright, A. F.; Fender, B. E. F. The room-temperature structure of DUO2AsO4*4D2O by powder neutron diffraction Locality: synthetic Acta Crystallographica, Section C, 1983, 39, 159-162 |
9007704 | CIF | S2 Sb Tl | P -1 | 6.123; 6.293; 11.838 101.34; 98.39; 103.21 | 426.612 | Rey, N.; Jumas, J. C.; Olivier-Fourcade J; Philippot, E. Sur les composes III-V-VI: Etude structurale du disulfure d'antimoine et de thallium, TlSbS2 Acta Crystallographica, Section C, 1983, 39, 971-974 |
9007705 | CIF | Br0.36 Cl0.64 Cu6 O7.52 Pb | F m -3 m | 9.224; 9.224; 9.224 90; 90; 90 | 784.798 | Dubler, E.; Vedani, A.; Oswald, H. R. New structure determination of murdochite, Cu6PbO8 Acta Crystallographica, Section C, 1983, 39, 1143-1146 |
9007706 | CIF | Fe3 O4 | F d -3 m :2 | 8.3969; 8.3969; 8.3969 90; 90; 90 | 592.048 | Fleet, M. E. The structure of magnetite: two annealed natural magnetites, Fe3.005O4 and Fe2.96Mg0.04O4 Note: Sample No.633, Fe3.005, annealed at 1373 K for 7 days Acta Crystallographica, Section C, 1984, 40, 1491-1493 |
9007707 | CIF | Fe2.961 Mg0.039 O4 | F d -3 m :2 | 8.3975; 8.3975; 8.3975 90; 90; 90 | 592.175 | Fleet, M. E. The structure of magnetite: two annealed natural magnetites, Fe3.005O4 and Fe2.96Mg0.04O4 Note: Sample No.2741, Fe2.96, annealed at 1073 K for 7 days Acta Crystallographica, Section C, 1984, 40, 1491-1493 |
9007708 | CIF | C13 H10 | P n m a | 8.365; 18.745; 5.654 90; 90; 90 | 886.558 | Gerkin, R. E.; Lundstedt, A. P.; Reppart, W. J. Structure of fluorene, C~13~H~10~, at 159 K Acta Crystallographica Section C, 1984, 40, 1892-1894 |
9007709 | CIF | As3 Ca0.4 Ce0.06 Cu6 Fe0.09 H18 La0.04 Nd0.01 O21 Y0.31 | P 63/m | 13.583; 13.583; 5.895 90; 90; 120 | 941.902 | Aruga, A.; Nakai, I. Structure of Ca-rich agardite, (Ca0.40Y0.31Fe0.09Ce0.06La0.04Nd0.01)Cu6.19[(AsO4)2.42(HAsO4)0.49](OH)6.38*3H2O Locality: Setoda, Hiroshima, Japan Acta Crystallographica, Section C, 1985, 41, 161-163 |
9007710 | CIF | O Pb | P b c m | 5.8931; 5.4904; 4.7528 90; 90; 90 | 153.779 | Hill, R. J. Refinement of the structure of orthorhombic PbO (massicot) by Rietveld analysis of neutron powder diffraction data Acta Crystallographica, Section C, 1985, 41, 1281-1284 |
9007711 | CIF | Ca1.543 Na2.914 O9 Si3 | R -3 m :H | 10.5; 10.5; 13.184 90; 90; 120 | 1258.8 | Ohsato, H.; Maki, I.; Takeuchi, Y. Structure of Na2CaSi2O6 Acta Crystallographica, Section C, 1985, 41, 1575-1577 |
9007712 | CIF | C Ni O3 | R -3 c :H | 4.6117; 4.6117; 14.735 90; 90; 120 | 271.396 | Pertlik, F. Structures of hydrothermally synthesized cobalt(II) carbonate and nickel(II) carbonate Locality: synthetic Acta Crystallographica, Section C, 1986, 42, 4-5 |
9007713 | CIF | C Co O3 | R -3 c :H | 4.6618; 4.6618; 14.963 90; 90; 120 | 281.616 | Pertlik, F. Structures of hydrothermally synthesized cobalt(II) carbonate and nickel(II) carbonate Locality: synthetic Acta Crystallographica, Section C, 1986, 42, 4-5 |
9007714 | CIF | Fe2 Mo3 O8 | P 63 m c | 5.781; 5.781; 10.06 90; 90; 120 | 291.162 | Kanazawa, Y.; Sasaki, A. Structure of kamiokite Note: anisoB's taken from ICSD Acta Crystallographica, Section C, 1986, 42, 9-11 |
9007715 | CIF | Ca Cl2 H12 O6 | P 3 2 1 | 7.8759; 7.8758; 3.9545 90; 90; 120 | 212.431 | Agron, P. A.; Busing, W. R. Calcium and strontium dichloride hexahydrates by neutron diffraction Acta Crystallographica, Section C, 1986, 42, 141-143 |
9007716 | CIF | Cl2 H12 O6 Sr | P 3 2 1 | 7.9596; 7.9596; 4.1243 90; 90; 120 | 226.289 | Agron, P. A.; Busing, W. R. Calcium and strontium dichloride hexahydrates by neutron diffraction Acta Crystallographica, Section C, 1986, 42, 141-143 |
9007717 | CIF | Ca2 Na2 O9 Si3 | P 31 2 1 | 10.464; 10.464; 13.168 90; 90; 120 | 1248.67 | Ohsato, H.; Takeuchi, Y.; Maki, I. Structure of Na4Ca4[Si6O18] Acta Crystallographica, Section C, 1986, 42, 934-937 |
9007718 | CIF | Cl Cu2 H3 O3 | P n m a | 6.03; 6.865; 9.12 90; 90; 90 | 377.531 | Parise, J. B.; Hyde, B. G. The structure of atacamite and its relationship to spinel Acta Crystallographica, Section C, 1986, 42, 1277-1280 |
9007719 | CIF | Mn Na O6 Si2 | C 1 2/c 1 | 9.513; 8.621; 5.354 90; 105.14; 90 | 423.849 | Ohashi, H.; Osawa, T.; Tsukimura, K. Refinement of the structure of manganese sodium dimetasilicate Note: pyroxene Note: anisoB's from ICSD Acta Crystallographica, Section C, 1987, 43, 605-607 |
9007720 | CIF | Ca3.8 Na4.4 O18 Si6 | P 31 2 1 | 10.464; 10.464; 13.176 90; 90; 120 | 1249.42 | Fischer, R. X.; Tillmanns, E. Revised data for combeite, Na2Ca2Si3O9 Acta Crystallographica, Section C, 1987, 43, 1852-1854 |
9007721 | CIF | Ca1.5 Na2.64 O9 Si3 | R -3 m :H | 10.429; 10.429; 13.149 90; 90; 120 | 1238.54 | Fischer, R. X.; Tillmanns, E. Revised data for combeite, Na2Ca2Si3O9 Acta Crystallographica, Section C, 1987, 43, 1852-1854 |
9007722 | CIF | Fe0.561 Ni17.439 S16 | C 2 2 2 | 9.3359; 11.2185; 9.43 90; 90; 90 | 987.649 | Fleet, M. E. Structure of godlevskite, Ni9S8 Acta Crystallographica, Section C, 1987, 43, 2255-2257 |
9007723 | CIF | Bi2 O3 | P -4 21 c | 7.739; 7.739; 5.636 90; 90; 90 | 337.552 | Blower, S. K.; Greaves, C. The structure of beta-Bi2O3 from powder neutron diffraction data Acta Crystallographica, Section C, 1988, 44, 587-589 |
9007724 | CIF | C3 Cl Cu N O3 | P 1 21/c 1 | 5.192; 7.945; 16.51 90; 100.24; 90 | 670.197 | Norman, R. E.; Rose, N. J.; Stenkamp, R. E. Mono-amino-acid-copper complexes: syntheses and structures of chloro(glycinato)(methanol)copper(II) and chloro(glycinato)(1-methylimidazole)copper(II) Acta Crystallographica, Section C, 1990, 46, 1-6 |
9007725 | CIF | C6 Cl Cu N3 O2 | P c a 21 | 24.97; 4.009; 9.116 90; 90; 90 | 912.555 | Norman, R. E.; Rose, N. J.; Stenkamp, R. E. Mono-amino-acid-copper complexes: syntheses and structures of chloro(glycinato)(methanol)copper(II) and chloro(glycinato) (1-methylimidazole)copper(II) Acta Crystallographica, Section C, 1990, 46, 1-6 |
9007726 | CIF | N4 O8 Pt Tc2 | P -1 | 5.178; 7.725; 7.935 69.33; 79.74; 77.41 | 288.044 | Rochon, F. D.; Kong, P. C.; Melanson, R. Tetraammineplatinum(II) bis[pertechnetate(VII)] Acta Crystallographica, Section C, 1990, 46, 8-10 |
9007727 | CIF | Cd2 H28 Na2 O32 P6 | P -1 | 7.709; 11.028; 9.231 108.25; 110.06; 79.77 | 697.913 | Averbuch-Pouchot M T Crystal chemistry of cyclo-hexaphosphates. V. structure of cadmium sodium cyclo-hexaphosphate tetradecahydrate Acta Crystallographica, Section C, 1990, 46, 10-13 |
9007729 | CIF | Cu3 H2 O9 V2 | P 1 21/m 1 | 7.444; 6.658; 7.759 90; 93.57; 90 | 383.807 | Leblanc, M.; Ferey, G. Room-temperature structures of oxocopper(II) vanadate(V) hydrates, Cu3V2O8(H2O) and CuV2O6(H2O)2 Acta Crystallographica, Section C, 1990, 46, 15-18 |
9007731 | CIF | Bi0.9 Cu Ni S3 Sb0.1 | P 21 21 21 | 7.514; 12.557; 4.888 90; 90; 90 | 461.199 | Bente, K.; Doering, T.; Edenharter, A.; Kupcik, V.; Steins, M.; Wendschuh-Josties M Structure of the new mineral muckeite, BiCuNiS3 Acta Crystallographica, Section C, 1990, 46, 127-128 |
9007732 | CIF | Cu2 H3 K O10 S2 | C 1 2/m 1 | 8.955; 6.265; 7.628 90; 117.45; 90 | 379.772 | Chevrier, G.; Giester, G.; Jarosch, D.; Zemann, J. Neutron diffraction study of the hydrogen-bond system in Cu2K(H3O2)(SO4)2 Acta Crystallographica, Section C, 1990, 46, 175-177 |
9007734 | CIF | Eu Mo6 S8 | R -3 :R | 6.5378; 6.5378; 6.5378 88.809; 88.809; 88.809 | 279.265 | Kubel, F.; Yvon, K. Structural phase transitions in Chevrel phases containing divalent metal cations. II. Structure refinement of triclinic EuMo6S8 and BaMo6S8 at low temperature Sample: T = 112 K Acta Crystallographica, Section C, 1990, 46, 181-186 |
9007735 | CIF | Eu Mo6 S8 | P -1 | 6.4692; 6.5651; 6.5986 89.179; 89.184; 88.009 | 280.024 | Kubel, F.; Yvon, K. Structural phase transitions in Chevrel phases containing divalent metal cations. II. Structure refinement of triclinic EuMo6S8 and BaMo6S8 at low temperature Sample: T = 40 K Acta Crystallographica, Section C, 1990, 46, 181-186 |
9007736 | CIF | Ba Mo6 S8 | R -3 :R | 6.6441; 6.6441; 6.6441 88.562; 88.562; 88.562 | 293.025 | Kubel, F.; Yvon, K. Structural phase transitions in Chevrel phases containing divalent metal cations. II. Structure refinement of triclinic EuMo6S8 and BaMo6S8 at low temperature Sample: T = 177 K Acta Crystallographica, Section C, 1990, 46, 181-186 |
9007737 | CIF | Ba Mo6 S8 | P -1 | 6.5896; 6.65; 6.6899 88.731; 88.818; 88.059 | 292.859 | Kubel, F.; Yvon, K. Structural phase transitions in Chevrel phases containing divalent metal cations. II. Structure refinement of triclinic EuMo6S8 and BaMo6S8 at low temperature Sample: T = 173 K Acta Crystallographica, Section C, 1990, 46, 181-186 |
9007738 | CIF | Co D12 F6 O6 Si | R -3 :H | 9.369; 9.369; 9.731 90; 90; 120 | 739.732 | Chevrier, G.; Saint-James R Structure investigation by neutron diffraction of deuterated cobalt fluosilicate hexahydrate Acta Crystallographica, Section C, 1990, 46, 186-189 |
9007739 | CIF | Al F6 H6 K O2 | P a -3 | 8.6464; 8.6464; 8.6464 90; 90; 90 | 646.407 | Frenzen, G.; Massa, W. Kalium-dioxonium-hexafluoroaluminat Acta Crystallographica, Section C, 1990, 46, 190-192 |
9007740 | CIF | Na2 O7 W2 | C m c 21 | 3.7777; 26.6067; 5.429 90; 90; 90 | 545.68 | Range, K. J.; Haase, H. Na2W2O7(II), a high-pressure phase of disodium ditungstate(VI) Acta Crystallographica, Section C, 1990, 46, 317-318 |
9007741 | CIF | F H O3 S | P 21 21 21 | 4.868; 6.736; 9.359 90; 90; 90 | 306.89 | Bartmann, K.; Mootz, D. Structures of two strong Bronsted acids: (I) fluorosulfuric acid and (II) trifluoromethanesulfonic acid Sample: T = 123 K Acta Crystallographica, Section C, 1990, 46, 319-320 |
9007742 | CIF | C H F3 O3 S | P 1 21/n 1 | 4.947; 11.26; 8.457 90; 99.21; 90 | 465.009 | Bartmann, K.; Mootz, D. Structures of two strong Bronsted acids: (I) fluorosulfuric acid and (II) trifluoromethanesulfonic acid Sample: T = 173 K Acta Crystallographica, Section C, 1990, 46, 319-320 |
9007743 | CIF | Cl2 H12 Ni O12 | P a -3 | 10.3159; 10.3159; 10.3159 90; 90; 90 | 1097.8 | Gallucci, J. C.; Gerkin, R. E. The structure of hexaaquanickel(II) chlorate Acta Crystallographica, Section C, 1990, 46, 350-354 |
9007744 | CIF | Ba2 Cu2.941 O6.822 Y | P m m m | 3.836; 3.883; 11.686 90; 90; 90 | 174.065 | Brodt, K.; Fuess, H.; Paulus, E. F.; Assmus, W.; Kowalewski, J. Untwinned single crystals of the high-temperature superconductor YBa2Cu3O7-x Acta Crystallographica, Section C, 1990, 46, 354-358 |
9007745 | CIF | Cs H O4 S | P 1 21/c 1 | 8.214; 5.809; 10.984 90; 119.39; 90 | 456.651 | Itoh, K.; Ukeda, T.; Ozaki, T.; Nakamura, E. Redetermination of the structure of caesium hydrogensulfate Acta Crystallographica, Section C, 1990, 46, 358-361 |
9007746 | CIF | Ba H8 O5 | P n m a | 7.64; 11.403; 5.965 90; 90; 90 | 519.664 | Lutz, H. D.; Kellersohn, T.; Vogt, T. Hydrogen bonding in barium hydroxide trihydrate by neutron diffraction Acta Crystallographica, Section C, 1990, 46, 361-363 |
9007747 | CIF | Li2 O5 Si2 | P b c n | 5.683; 4.784; 14.648 90; 90; 90 | 398.242 | Smith, R. I.; Howie, R. A.; West, A. R.; Aragon-Pina A; Villafuerte-Castrejon M E The structure of metastable lithium disilicate, Li2Si2O5 Acta Crystallographica, Section C, 1990, 46, 363-365 |
9007748 | CIF | S4 Tm2 Zn | P n m a | 13.308; 7.769; 6.285 90; 90; 90 | 649.805 | Lemoine, P.; Tomas, A.; Vovan, T.; Guittard, M. Structure du sulfure de thulium et de zinc ZnTm2S4 Acta Crystallographica, Section C, 1990, 46, 365-368 |
9007749 | CIF | I2 Na4 O | I 4/m m m | 4.655; 4.655; 15.94 90; 90; 90 | 345.404 | Sabrowsky, H.; Hippler, K.; Sitta, S.; Vogt, P.; Walz, L. Structure of Na4OI2 Acta Crystallographica, Section C, 1990, 46, 368-369 |
9007750 | CIF | B2 Ba2 Cu O6 | P n m a | 8.023; 11.29; 13.889 90; 90; 90 | 1258.06 | Smith, R. W.; Keszler, D. A. Structure of Ba2Cu(BO3)2 Acta Crystallographica, Section C, 1990, 46, 370-372 |
9007752 | CIF | Al2.26 Nb0.8 Ti2.94 | P -3 m 1 | 4.5554; 4.5554; 5.5415 90; 90; 120 | 99.589 | Shoemaker, C. B.; Shoemaker, D. P.; Bendersky, L. A. Structure of omega-Ti3Al2.25Nb.75 Acta Crystallographica, Section C, 1990, 46, 374-377 |
9007753 | CIF | S3 Tm2 | R -3 c :H | 6.768; 6.768; 18.236 90; 90; 120 | 723.404 | Range, K. J.; Drexler, H.; Gietl, A.; Klement, U.; Lange, K. G. Tm2S3-V, a corundum-type modification of thulium sesquisulfide Acta Crystallographica, Section C, 1990, 46, 487-488 |
9007754 | CIF | Mo3 N2 O10 | P n m a | 13.182; 7.589; 9.286 90; 90; 90 | 928.955 | Range, K. J.; Fassler, A. Diammonium trimolybdate(VI), (NH4)2Mo3O10 Acta Crystallographica, Section C, 1990, 46, 488-489 |
9007755 | CIF | C8 Ge2 I9 N | C 1 2/c 1 | 17.953; 9.99; 17.509 90; 108.87; 90 | 2971.47 | Muller, V. U.; Krug, V. Tetraethylammoniumiodid-germaniumtetraiodid(1/2), eine strukture mit einem von acht iodatomen koordinierten iodidion Acta Crystallographica, Section C, 1990, 46, 523-525 |
9007756 | CIF | H2 N3 O10 Y | P -1 | 7.388; 7.889; 8.204 64.43; 70.9; 62.74 | 378.39 | Ribar, B.; Radivojevic, P.; Argay, G.; Kalman, A. Structure of yttrium nitrate monohydrate Acta Crystallographica, Section C, 1990, 46, 525-527 |
9007757 | CIF | Pb5.05 S13 Sb4.95 | I 1 2/m 1 | 23.698; 3.98; 24.466 90; 93.9; 90 | 2302.24 | Skowron, A.; Brown, I. D. Refinement of the structure of robinsonite, Pb4Sb6S13 Acta Crystallographica, Section C, 1990, 46, 527-731 |
9007758 | CIF | Pb4.65 S11 Sb4.35 | P n a m | 23.49; 21.245; 4.02 90; 90; 90 | 2006.16 | Skowron, A.; Brown, I. D. Refinement of the structure of boulangerite, Pb5Sb4S11 Acta Crystallographica, Section C, 1990, 46, 531-534 |
9007759 | CIF | Pb1.44 S5 Sb2.56 | P b n m | 11.355; 19.783; 4.042 90; 90; 90 | 907.979 | Skowron, A.; Brown, I. D. Structure of Pb2Sb2S5 Acta Crystallographica, Section C, 1990, 46, 534-536 |
9007760 | CIF | Na0.56 O5 V2 | C 1 2/m 1 | 11.663; 3.6532; 8.92 90; 90.91; 90 | 380.009 | Kanke, Y.; Kato, K.; Takayama-Muromachi E; Isobe, M. Structure of Na0.56V2O5 Acta Crystallographica, Section C, 1990, 46, 536-538 |
9007761 | CIF | Br4 Ca Mn O8 | C 1 2/m 1 | 9.062; 9.582; 9.405 90; 112.96; 90 | 751.958 | Duhlev, R.; Brown, I. D. Structure of calcium manganese(II) tetrabromide octahydrate Acta Crystallographica, Section C, 1990, 46, 538-541 |
9007762 | CIF | As Cl2 O3 Pb2 | P 1 21/m 1 | 6.41; 5.525; 9.293 90; 90.69; 90 | 329.09 | Effenberger, H.; Miletich, R.; Pertlik, F. Structure of dilead(II) hydrogenarsenate(III) dichloride Acta Crystallographica, Section C, 1990, 46, 541-543 |
9007763 | CIF | Ca1.003 Ge2 Na1.997 O6 | R -3 m :H | 10.788; 10.788; 13.46 90; 90; 120 | 1356.62 | Nishi, F.; Takeuchi, Y. Structure of sodium calcium germanate Na2CaGe2O6 Acta Crystallographica, Section C, 1990, 46, 544-546 |
9007764 | CIF | Cu2 O7 P2 | C 1 2/c 1 | 6.895; 8.113; 9.164 90; 109.62; 90 | 482.863 | Effenberger, H. Structural refinement of low-temperature copper(II) pyrophosphate Acta Crystallographica, Section C, 1990, 46, 691-692 |
9007765 | CIF | As Na3 O15 S | P 21 21 21 | 9.22; 12.831; 13.906 90; 90; 90 | 1645.1 | Kempa, P. B.; Wiebcke, M.; Felsche, J. Structure of trisodium monothioarsenate dodecahydrate Sample: T = 213 K Acta Crystallographica, Section C, 1990, 46, 729-732 |
9007766 | CIF | C16 Co4 O16 Sn | F -4 3 c | 17.255; 17.255; 17.255 90; 90; 90 | 5137.42 | Leigh, J. S.; Whitmire, K. H. The structures of [Sn{Co(CO4)4}4] and [Pb{Co(CO)4}4] Acta Crystallographica, Section C, 1990, 46, 732-736 |
9007767 | CIF | C16 Co4 O16 Pb | P c c n | 12.184; 12.267; 17.22 90; 90; 90 | 2573.72 | Leigh, J. S.; Whitmire, K. H. The structures of [Sn{Co(CO4)4}4] and [Pb{Co(CO)4}4] Acta Crystallographica, Section C, 1990, 46, 732-736 |
9007768 | CIF | Cl Na3 O | P m -3 m | 4.496; 4.496; 4.496 90; 90; 90 | 90.882 | Hippler, K.; Sitta, S.; Vogt, P.; Sabrowsky, H. Structure of Na3OCl Acta Crystallographica, Section C, 1990, 46, 736-738 |
9007769 | CIF | H4 K O7 V | P 1 | 6.501; 7.882; 7.501 107.18; 95.5; 116.2 | 317.797 | Lapshin, A. E.; Smolin, Y. I.; Shepelev, Y. F.; Schwendt, P.; Gyepesova, D. Structure of dipotassium aquadioxotetraperoxodivanadate(V) trihydrate Sample: T = 153 K Acta Crystallographica, Section C, 1990, 46, 738-741 |
9007770 | CIF | H14 N4 O6 Ru S2 | P 1 21/c 1 | 6.2019; 7.0213; 11.761 90; 115.3; 90 | 463.015 | Condren, S. M.; Cordes, A. W.; Durham, B. Structure of cis-tetraamminebis(hydrogensulfito)ruthenium(II) Acta Crystallographica, Section C, 1990, 46, 889-890 |
9007771 | CIF | C8 Cl4 Hf O2 | P 21 21 21 | 7.914; 12.806; 14.357 90; 90; 90 | 1455.03 | Duraj, S. A.; Towns, R. L. R.; Baker, R. J.; Schupp, J. Structure of cis-tetrachlorobis(tetrahydrofuran)hafnium(IV) Acta Crystallographica, Section C, 1990, 46, 890-892 |
9007772 | CIF | C12 Cl2 Co N8 O10 | P -1 | 9.508; 9.428; 9.309 78.86; 105.08; 120.13 | 694.91 | Ganesh, V.; Seshasayee, M.; Aravamudan, G.; Heijdenrijk, D.; Schenk, H. Structure of hexaaquacobalt(II) dichloride bis(hexamethylenetetramine)* tetrahydrate Acta Crystallographica, Section C, 1990, 46, 949-951 |
9007773 | CIF | Cr H16 N3 O10 P2 | P 1 21/c 1 | 7.825; 10.107; 15.322 90; 103.92; 90 | 1176.19 | Haromy, T. P.; Linck, C. F.; Cleland, W. W.; Sundaralingam, M. Structures of the meridional and facial isomers of triamminechromium pyrophosphate dihydrate Sample: a) meridional monoaquatriammine(pyrophosphato)-chromium(III) dihydrate Acta Crystallographica, Section C, 1990, 46, 951-957 |
9007774 | CIF | Cr H14 N3 O9 P2 | P 1 21/c 1 | 8.695; 10.327; 11.913 90; 97.81; 90 | 1059.79 | Haromy, T. P.; Linck, C. F.; Cleland, W. W.; Sundaralingam, M. Structures of the meridional and facial isomers of triamminechromium pyrophosphate dihydrate Sample: (b), alpha,beta,beta'-tridentate triammine(pyrophosphato) chromium(III)dihydrate dimer Acta Crystallographica, Section C, 1990, 46, 951-957 |
9007775 | CIF | Na2 O18 S3 Th | P 1 21/c 1 | 5.567; 16.81; 15.76 90; 91.925; 90 | 1474.01 | Habash, J.; Smith, A. J. Structure of disodium triaquatri-u-sulfato-thorate(IV) trihydrate Acta Crystallographica, Section C, 1990, 46, 957-960 |
9007776 | CIF | Cl3 O6 Y | P 1 2/n 1 | 7.8346; 6.4729; 9.5817 90; 93.768; 90 | 484.862 | Bell, A. M. T.; Smith, A. J. Structure of hexaaquadichloroyttrium(III) chloride Acta Crystallographica, Section C, 1990, 46, 960-962 |
9007777 | CIF | C3 H8 Ag Ba O9 P | P 1 21/a 1 | 6.578; 23.811; 6.61 90; 90.57; 90 | 1035.27 | Weichsel, A.; Lis, T. Structure of silver(I) barium phosphoenolpyruvate trihydrate Acta Crystallographica, Section C, 1990, 46, 962-965 |
9007779 | CIF | Ca H16 Li O13 P3 | P -1 | 7.767; 10.144; 7.225 105.17; 102.76; 84.95 | 535.566 | Averbuch-Pouchot M T; Durif, A. Crystal chemistry of cyclo-hexaphosphates. X. structure of dicalcium dilithium cyclo-hexaphosphate octahydrate Acta Crystallographica, Section C, 1990, 46, 968-970 |
9007780 | CIF | Ba2 Cu1.1 Ho2 O8 Pt0.9 | P c m n | 10.303; 5.668; 13.178 90; 90; 90 | 769.561 | Saito, Y.; Ukei, K.; Shishido, T.; Fukuda, T. Structure of Ho2Ba2Cu1+xPt1-xO8(x=0.1) Acta Crystallographica, Section C, 1990, 46, 970-972 |
9007781 | CIF | Fe3 H11 N2.26 O32 Rb2.74 S6 | P -1 | 9.783; 9.586; 18.389 95.3; 93.19; 118.12 | 1504.77 | Mereiter K Structure of a triclinic rubidium ammonium triaqua-u3-oxo-hexa-u-sulfato-triferrate(III) tetrahydrate, Rb2.74(NH4)2.26Fe3O(SO4)6.7H2O Acta Crystallographica, Section C, 1990, 46, 972-976 |
9007782 | CIF | Ag0.616 Nb S2 | P 63/m m c | 3.354; 3.354; 14.431 90; 90; 120 | 140.59 | Van der Lee, A.; Wiegers, A.; Haange, R. J.; de Boer, J. L. Structure of Ag0.6NbS2 Acta Crystallographica, Section C, 1990, 46, 976-979 |
9007783 | CIF | H2 I2 O7 Sr | I 1 2/c 1 | 8.9003; 7.748; 9.6496 90; 90.23; 90 | 665.426 | Lutz, H. D.; Kellersohn, T.; Vogt, T. Structural instability of the water molecule in Sr(IO3)2.H2O, a neutron diffraction study Acta Crystallographica, Section C, 1990, 46, 979-981 |
9007784 | CIF | Mg2 Pt Si | P 63/m m c | 4.254; 4.254; 8.542 90; 90; 120 | 133.871 | Range, K. J.; Rau, F.; Klement, U. Dimagnesium platinum silicon Acta Crystallographica, Section C, 1990, 46, 1092-1093 |
9007785 | CIF | Er O4 V | I 41/a :2 | 5.003; 5.003; 11.143 90; 90; 90 | 278.909 | Range, K. J.; Meister, H. ErVO4-II, a scheelite-type high-pressure modification of erbium orthovanadate Acta Crystallographica, Section C, 1990, 46, 1093-1094 |
9007786 | CIF | As3 H2 Na3 O10 | C 1 2/c 1 | 10.86; 9.323; 18.27 90; 103; 90 | 1802.39 | Driss, A.; Jouini, T. Structure d'un triarseniate: Na3H2As3O10 Acta Crystallographica, Section C, 1990, 46, 1185-1188 |
9007787 | CIF | Mo5 O8 Sn | P 1 21/c 1 | 7.533; 9.268; 9.97 90; 109.73; 90 | 655.201 | Gougeon, P.; Potel, M.; Sergent, M. Structure of SnMo5O8 containing bioctahedral Mo10 clusters Acta Crystallographica, Section C, 1990, 46, 1188-1190 |
9007789 | CIF | Ga2 Sn Ta5 | I 4/m c m | 10.354; 10.354; 5.1795 90; 90; 90 | 555.27 | Ye, J.; Horiuchi, H.; Shishido, T.; Ukei, K.; Fukuda, T. Structure of Ta5SnGa2 Acta Crystallographica, Section C, 1990, 46, 1193-1195 |
9007790 | CIF | Ga Sn2 V2 | A e a m | 6.7191; 18.798; 5.603 90; 90; 90 | 707.691 | Ye, J.; Horiuchi, H.; Shishido, T.; Fukuda, T. Structure of V2Sn2Ga Acta Crystallographica, Section C, 1990, 46, 1195-1197 |
9007791 | CIF | Gd Si | P n m a | 7.973; 3.858; 5.753 90; 90; 90 | 176.961 | Nagaki, D. A.; Simon, A. Structure of gadolinium monosilicide Acta Crystallographica, Section C, 1990, 46, 1197-1199 |
9007792 | CIF | Li O16 Rb4 S4 | P 41 | 7.615; 7.615; 29.458 90; 90; 90 | 1708.22 | Zuniga, F. J.; Etxebarria, J.; Madariaga, G.; Breczewski, T. Structure and absolute chirality of Rb4LiH3(SO4)4 at 293 K Acta Crystallographica, Section C, 1990, 46, 1199-1202 |
9007793 | CIF | Ge8.5 Na4 O20 | I 41/a :2 | 15.0263; 15.0263; 7.3971 90; 90; 90 | 1670.19 | Fleet, M. E. Refinement of the structure of sodium enneagermanate (Na4Ge9O20) Acta Crystallographica, Section C, 1990, 46, 1202-1204 |
9007794 | CIF | Lu O4 S5 U4 | I 4/m m m | 3.8014; 3.8014; 34.2 90; 90; 90 | 494.212 | Jaulmes, P. S.; Julien-Pouzol M; Dugue, J.; Laruelle, P.; Vovan, T.; Guittard, M. Structure de l'oxysulfure d'uranium et de lutecium, (USO)4LuS Acta Crystallographica, Section C, 1990, 46, 1205-1207 |
9007795 | CIF | C16 Br4 P2 Ta | P 1 21/c 1 | 8.493; 30.369; 8.898 90; 99.22; 90 | 2265.36 | Hovnanian, N.; Hubert-Pfalzgraf L G; Borgne, G. L. Structures of two polymorphs of cis-TaBr4(PhPMe2)2 Sample: 1 Acta Crystallographica, Section C, 1990, 46, 1207-1209 |
9007796 | CIF | C16 Br4 P2 Ta | P 21 21 21 | 14.38; 19.17; 8.28 90; 90; 90 | 2282.5 | Hovnanian, N.; Hubert-Pfalzgraf L G; Borgne, G. L. Structures of two polymorphs of cis-TaBr4(PhPMe2)2 Sample: 2 Acta Crystallographica, Section C, 1990, 46, 1207-1209 |
9007797 | CIF | Br2 K4 O | I 4/m m m | 5.145; 5.145; 16.527 90; 90; 90 | 378.875 | Hippler, K.; Sitta, S.; Vogt, P.; Sabrowsky, H.; Walz, L. Structure of K4OBr2 Acta Crystallographica, Section C, 1990, 46, 1359-1360 |
9007798 | CIF | Al H14 Na O9.25 Si3 | P n m a | 9.868; 10.082; 10.098 90; 90; 90 | 1004.64 | Hansen, S.; Hakansson, U.; Falth, L. Structure of synthetic zeolite Na-P2 Acta Crystallographica, Section C, 1990, 46, 1361-1362 |
9007799 | CIF | Al0.225 H5.5 Na0.444 O2.611 Si0.795 | I 41/a m d :2 | 9.9989; 9.9989; 10.0697 90; 90; 90 | 1006.75 | Hakansson, U.; Falth, L.; Hansen, S. Structure of a high-silica variety of zeolite Na-P Acta Crystallographica, Section C, 1990, 46, 1363-1364 |
9007800 | CIF | H3 Na3 O5 Si | P 1 21/c 1 | 7.898; 5.96; 11.142 90; 105.57; 90 | 505.231 | Schmid, R. L.; Felsche, J. Structure of trisodium hydrogenorthosilicate monohydrate Acta Crystallographica, Section C, 1990, 46, 1365-1368 |
9007802 | CIF | Al5 Ca1.88 H12 Na O26 Si5 Sr0.12 | P n c n | 13.1043; 13.0569; 13.2463 90; 90; 90 | 2266.46 | Stahl, K.; Kvick, A.; Smith, J. V. Thomsonite, a neutron diffraction study at 13 K Sample: T = 13 K Acta Crystallographica, Section C, 1990, 46, 1370-1373 |
9007803 | CIF | K2 O10 Si4 Zn | P 21 21 21 | 10.0673; 14.047; 7.0673 90; 90; 90 | 999.425 | Kohara, S.; Kawahara, A. Structure of synthetic dipotassium zinc tetrasilicate Acta Crystallographica, Section C, 1990, 46, 1373-1376 |
9007805 | CIF | Cu H4 O6 P2 | P 1 21/a 1 | 7.4748; 9.9406; 7.5175 90; 99.722; 90 | 550.558 | Sghyar, P. M.; Durand, J.; Cot, L.; Rafiq, M. Structure de Cu(HPO3H)2 Acta Crystallographica, Section C, 1990, 46, 1378-1381 |
9007806 | CIF | K0.75 Mo Nb O12 P3 | P b c m | 8.8518; 9.1453; 12.5174 90; 90; 90 | 1013.31 | Leclaire, A.; Borel, M. M.; Grandin, A.; Raveau, B. Non-stoichiometry in the KMo2P3O12-tunnel structure: the oxide K0.75MoNbP3O12 Acta Crystallographica, Section C, 1990, 46, 1381-1383 |
9007807 | CIF | Ba Cu2 O7 Si2 | P n m a | 6.866; 13.19; 6.909 90; 90; 90 | 625.697 | Janczak, J.; Kubiak, R.; Glowiak, T. Structure of barium copper pyrosilicate at 300 K Acta Crystallographica, Section C, 1990, 46, 1383-1385 |
9007808 | CIF | Be13 U | F m -3 c | 10.268; 10.268; 10.268 90; 90; 90 | 1082.57 | McElfresh, M. W.; Hall, J. H.; Ryan, R. R.; Smith, J. L.; Fisk, Z. Structure of the heavy-fermion superconductor UBe13 Note: x-coordinate of U altered from reported value. Acta Crystallographica, Section C, 1990, 46, 1579-1580 |
9007809 | CIF | Br2 H12 Ni O14 | P -3 | 7.874; 7.874; 5.423 90; 90; 120 | 291.18 | Gallucci, J. C.; Gerkin, R. E.; Reppart, W. J. Structure of nickel(II) perbromate hexahydrate at 296K Acta Crystallographica, Section C, 1990, 46, 1580-1584 |
9007810 | CIF | As8 Fe3 Na6.96 O28 | C 1 2/c 1 | 9.94; 8.5483; 28.762 90; 93.683; 90 | 2438.86 | Masquelier, C.; d'Yvoire F; Rodier, N. Structure of the sodium ion conductor Na7Fe3(As2O7)4 Acta Crystallographica, Section C, 1990, 46, 1584-1587 |
9007811 | CIF | O15 Pb V6 | C 1 2/m 1 | 15.463; 3.6477; 10.116 90; 109.2; 90 | 538.849 | Kata, K. V.; Kosuda, K. Die Struktur der eindimensional fehlgeordneten blei-vanadiumbronze, Beta-Pb0.333V2O5 Acta Crystallographica, Section C, 1990, 46, 1587-1590 |
9007812 | CIF | K O10 V4 | C m c m | 3.6784; 11.612; 18.6332 90; 90; 90 | 795.891 | Kanke, Y.; Kato, K.; Takayama-Muromachi E; Isobe, M.; Kosuda, K. Structure of K0.5V2O5 Acta Crystallographica, Section C, 1990, 46, 1590-1592 |
9007813 | CIF | C4 N2 Na7 Nb3 O83 P2 W15 | P -1 | 13.341; 15.89; 21.395 87.85; 77.18; 71.87 | 4200.44 | Finke, R. G.; Lyon, D. K.; Nomiya, K.; Weakley, T. J. R. Structure of nonasodium alpha-triniobatopentadecawolframatodiphosphate- acetonitrile-water(1/2/23), Na9[P2W15Nb3O62].2CH3CN.23H2O Acta Crystallographica, Section C, 1990, 46, 1592-1596 |
9007814 | CIF | Na Rb S | P 4/n m m :1 | 4.696; 4.696; 7.559 90; 90; 90 | 166.694 | Hippler, K.; Hitzbleck, R. D.; Sitta, S.; Vogt, P.; Wortmann, R.; Sabrowsky, H. Structure of RbNaS Acta Crystallographica, Section C, 1990, 46, 1596-1597 |
9007815 | CIF | S2 Ta | P 63/m m c | 3.314; 3.314; 12.097 90; 90; 120 | 115.057 | Meetsma, A.; Wiegers, G. A.; Haange, R. J.; de Boer, J. L. Structure of 2H-TaS2 Acta Crystallographica, Section C, 1990, 46, 1598-1599 |
9007816 | CIF | F4 H4 K3 O10 V2 | P -1 | 8.518; 12.46; 5.981 92.3; 90.9; 102.7 | 618.564 | Lapshin, A. E.; Smolin, Y. I.; Shepelev, Y. F.; Schwendt, P.; Gyepesova, D. Structure of tripotassium u-fluoro-u-peroxo-bis(fluorooxoperoxovanadate)(3-) hydrogen fluoride dihydrate Acta Crystallographica, Section C, 1990, 46, 1753-1755 |
9007817 | CIF | Cl2 O2 Pb | C c c e :1 | 6.004; 12.504; 6.01 90; 90; 90 | 451.195 | Okuda, M.; Ishihara, M.; Yamanaka, M.; Ohba, S.; Saito, Y. Structures of lead chlorite, magnesium chlorite hexahydrate and silver chlorite Sample: Compound (I) Acta Crystallographica, Section C, 1990, 46, 1755-1759 |
9007818 | CIF | Cl2 Mg O10 | P 42 m c | 7.471; 7.471; 9.98 90; 90; 90 | 557.042 | Okuda, M.; Ishihara, M.; Yamanaka, M.; Ohba, S.; Saito, Y. Structures of lead chlorite, magnesium chlorite hexahydrate and silver chlorite Sample: Compound (II) Acta Crystallographica, Section C, 1990, 46, 1755-1759 |
9007819 | CIF | Ag Cl O2 | P c c a | 6.0754; 6.6796; 6.1226 90; 90; 90 | 248.463 | Okuda, M.; Ishihara, M.; Yamanaka, M.; Ohba, S.; Saito, Y. Structures of lead chlorite, magnesium chlorite hexahydrate and silver chlorite Sample: Compound (III) Acta Crystallographica, Section C, 1990, 46, 1755-1759 |
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