Crystallography Open Database
Search results
Result: there are 511 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)
Searching journal of publication like 'Acta Crystallographica Section C Structural Chemistry' volume of publication is 74
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 2020964 | CIF HKL Paper | C26 H14 Fe2 O6 S2 | P -1 | 10.1425; 16.1771; 24.5865 106.98; 99.453; 96.998 | 3743.7 | Mebi, Charles; Gerasimchuk, Nikolay; Labrecque, Jordan Crystal and electronic structure of a hexacarbonyldiiron cluster tethered to naphthalene-2-thiolate ligands Acta Crystallographica Section C, 2018, 74 |
| 2020965 | CIF HKL Paper | C27 H24 N2 O2 | P b c a | 18.4485; 11.6452; 19.5931 90; 90; 90 | 4209.31 | Han, Shu-Ying; Niu, Xue; Wang, Jia; Jin, Guo-Xia; Liu, Ai; Ma, Jian-Ping Characterization and gas adsorption of a novel three-dimensional metal‒organic framework (MOF) generated from a new polydentate fluorene-bridged ligand Acta Crystallographica Section C, 2018, 74 |
| 2020966 | CIF HKL | C30 H36 N2 Ni O9 S | P 1 21/c 1 | 10.281; 23.5073; 12.3557 90; 95.674; 90 | 2971.48 | Han, Shu-Ying; Niu, Xue; Wang, Jia; Jin, Guo-Xia; Liu, Ai; Ma, Jian-Ping Characterization and gas adsorption of a novel three-dimensional metal‒organic framework (MOF) generated from a new polydentate fluorene-bridged ligand Acta Crystallographica Section C, 2018, 74 |
| 2020967 | CIF HKL Paper | C20 H23 Cl N4 O5 | P -1 | 9.0137; 10.608; 11.8132 84.941; 85.798; 69.408 | 1052.18 | Faroque, Muhammad Umer; Noureen, Sajida; Ahmed, Maqsood; Tahir, Muhammad Nawaz Electrostatic properties of the pyrimethamine‒2,4-dihydroxybenzoic acid cocrystal in methanol studied using transferred electron-density parameters Acta Crystallographica Section C, 2018, 74, 100-107 |
| 2020968 | CIF HKL Paper | C22 H18 F N O2 S | P 1 21/c 1 | 15.9489; 7.2739; 15.9222 90; 95.813; 90 | 1837.6 | Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher Four closely related <i>N</i>-(3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophen-2-yl)benzamides: order <i>versus</i> disorder, and similar molecular conformations but different modes of supramolecular aggregation, with a new disordered refinement of 2-amino-3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophene Acta Crystallographica Section C, 2018, 74, 45-53 |
| 2020969 | CIF HKL Paper | C22 H18 Cl N O2 S | P 1 21/n 1 | 11.6776; 14.2461; 12.2957 90; 109.336; 90 | 1930.13 | Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher Four closely related <i>N</i>-(3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophen-2-yl)benzamides: order <i>versus</i> disorder, and similar molecular conformations but different modes of supramolecular aggregation, with a new disordered refinement of 2-amino-3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophene Acta Crystallographica Section C, 2018, 74, 45-53 |
| 2020970 | CIF HKL Paper | C22 H17 F2 N O2 S | P -1 | 7.6718; 9.8833; 13.5925 104.925; 95.476; 103.633 | 954.32 | Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher Four closely related <i>N</i>-(3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophen-2-yl)benzamides: order <i>versus</i> disorder, and similar molecular conformations but different modes of supramolecular aggregation, with a new disordered refinement of 2-amino-3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophene Acta Crystallographica Section C, 2018, 74, 45-53 |
| 2020971 | CIF HKL Paper | C23 H21 N O3 S | P -1 | 8.5129; 12.923; 19.031 96.811; 102.665; 105.321 | 1935.1 | Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher Four closely related <i>N</i>-(3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophen-2-yl)benzamides: order <i>versus</i> disorder, and similar molecular conformations but different modes of supramolecular aggregation, with a new disordered refinement of 2-amino-3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophene Acta Crystallographica Section C, 2018, 74, 45-53 |
| 2020972 | CIF HKL Paper | C15 H15 N O S | P n a 21 | 9.208; 14.0485; 10.3826 90; 90; 90 | 1343.08 | Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Glidewell, Christopher Four closely related <i>N</i>-(3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophen-2-yl)benzamides: order <i>versus</i> disorder, and similar molecular conformations but different modes of supramolecular aggregation, with a new disordered refinement of 2-amino-3-benzoyl-4,5,6,7-tetrahydrobenzo[<i>b</i>]thiophene Acta Crystallographica Section C, 2018, 74, 45-53 |
| 2020973 | CIF HKL | C13 H18 N10 O S | P -1 | 7.7255; 9.1381; 12.4594 92.241; 104.034; 97.248 | 844.3 | Hützler, Wilhelm Maximilian; Bolte, Michael Sulfur as hydrogen-bond acceptor in cocrystals of 2-thio-modified thymine Acta Crystallographica Section C, 2018, 74, 21-30 |
| 2020974 | CIF HKL | C21 H31 N13 O3 S2 | C 1 c 1 | 10.0743; 14.383; 18.647 90; 100.427; 90 | 2657.3 | Hützler, Wilhelm Maximilian; Bolte, Michael Sulfur as hydrogen-bond acceptor in cocrystals of 2-thio-modified thymine Acta Crystallographica Section C, 2018, 74, 21-30 |
| 2020975 | CIF HKL | C15.5 H18.5 N7.5 O1.5 S | P 1 21/n 1 | 11.1237; 19.5259; 16.7313 90; 100.9; 90 | 3568.5 | Hützler, Wilhelm Maximilian; Bolte, Michael Sulfur as hydrogen-bond acceptor in cocrystals of 2-thio-modified thymine Acta Crystallographica Section C, 2018, 74, 21-30 |
| 2020976 | CIF HKL | C21 H31 N13 O5 S2 | C 1 2/c 1 | 22.573; 9.1593; 13.9211 90; 98.701; 90 | 2845.1 | Hützler, Wilhelm Maximilian; Bolte, Michael Sulfur as hydrogen-bond acceptor in cocrystals of 2-thio-modified thymine Acta Crystallographica Section C, 2018, 74, 21-30 |
| 2020977 | CIF HKL | C22 H33 N13 O5 S2 | C 1 2/c 1 | 23.53; 8.7478; 14.2006 90; 102.037; 90 | 2858.7 | Hützler, Wilhelm Maximilian; Bolte, Michael Sulfur as hydrogen-bond acceptor in cocrystals of 2-thio-modified thymine Acta Crystallographica Section C, 2018, 74, 21-30 |
| 2020978 | CIF HKL | C21 H30 N18 O3 S3 | R -3 | 17.6827; 17.6827; 16.4925 90; 90; 120 | 4466 | Hützler, Wilhelm Maximilian; Bolte, Michael Sulfur as hydrogen-bond acceptor in cocrystals of 2-thio-modified thymine Acta Crystallographica Section C, 2018, 74, 21-30 |
| 2020979 | CIF HKL Paper | C28 H44 N2 | P 1 21/n 1 | 12.992; 12.399; 23.385 90; 92.81; 90 | 3763 | Dolinar, Brian S.; Samedov, Kerim; Maloney, Andrew G. P.; West, Robert; Khrustalev, Victor N.; Guzei, Ilia A. A chiral diamine: practical implications of a three-stereoisomer cocrystallization Acta Crystallographica Section C, 2018, 74, 54-61 |
| 2020980 | CIF HKL Paper | C51 H42 Cu3 F6 I2 N3 P4 | P 1 21/n 1 | 18.931; 12.4391; 21.78 90; 98.012; 90 | 5078.8 | Zhu, Qiu-Meng; Song, Li; Chai, Wen-Xiang; Shen, Hang-Yan; Wei, Qin-Hua; Qin, Lai-Shun A novel luminescent ionic trinuclear Cu~3~I~2~ cluster cuprous complex supported by a P^N ligand: synthesis, structure characterization, properties and TD‒DFT calculations Acta Crystallographica Section C, 2018, 74, 62-68 |
| 2020981 | CIF | C16 H14 N2 O4 S | P -1 | 6.9783; 9.7631; 11.8912 78.365; 74.458; 81.063 | 760.07 | Sevinçek, Resul; Barut Celepci, Duygu; Köktaş Koca, Serap; Akgül, Özlem; Aygün, Muittin Substituent position effect on the crystal structures of <i>N</i>-phenyl-2-phthalimidoethanesulfonamide derivatives Acta Crystallographica Section C, 2018, 74, 31-36 |
| 2020982 | CIF | C16 H13 N3 O6 S | P -1 | 7.1547; 10.4322; 11.8228 100.106; 104.043; 102.278 | 812.14 | Sevinçek, Resul; Barut Celepci, Duygu; Köktaş Koca, Serap; Akgül, Özlem; Aygün, Muittin Substituent position effect on the crystal structures of <i>N</i>-phenyl-2-phthalimidoethanesulfonamide derivatives Acta Crystallographica Section C, 2018, 74, 31-36 |
| 2020983 | CIF | C17 H16 N2 O5 S | P 1 21/n 1 | 10.9408; 7.2555; 21.1923 90; 99.838; 90 | 1657.5 | Sevinçek, Resul; Barut Celepci, Duygu; Köktaş Koca, Serap; Akgül, Özlem; Aygün, Muittin Substituent position effect on the crystal structures of <i>N</i>-phenyl-2-phthalimidoethanesulfonamide derivatives Acta Crystallographica Section C, 2018, 74, 31-36 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!