Crystallography Open Database

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Searching journal of publication like 'Acta crystallographica. Section C, Structural chemistry' volume of publication is 79

COD ID: 2022700
CIF file

HKL data

Original IUCr paper

Formula: - C8 H17 Cl N6 O -
Comments: Aristov, Michael M.; Geng, Han; Harris, James W.; Berry, John F. Clarifying the structures of imidines: using crystallographic characterization to identify tautomers and localized systems of π-bonding. Acta crystallographica. Section C, Structural chemistry 79(Pt 4) (2023) 133-141
Space group: C 1 2/c 1
Cell volume: 2367.1
Cell parameters: 19.294; 9.4173; 13.743; 90; 108.57; 90;  

COD ID: 2022701
CIF file

HKL data

Original IUCr paper

Formula: - C4 H7 N3 -
Comments: Aristov, Michael M.; Geng, Han; Harris, James W.; Berry, John F. Clarifying the structures of imidines: using crystallographic characterization to identify tautomers and localized systems of π-bonding. Acta crystallographica. Section C, Structural chemistry 79(Pt 4) (2023) 133-141
Space group: P -1
Cell volume: 234.36
Cell parameters: 5.9577; 6.7494; 6.8249; 101.641; 104.225; 111.425;  

COD ID: 2022702
CIF file

HKL data

Original IUCr paper

Formula: - C4 H6 N2 O -
Comments: Aristov, Michael M.; Geng, Han; Harris, James W.; Berry, John F. Clarifying the structures of imidines: using crystallographic characterization to identify tautomers and localized systems of π-bonding. Acta crystallographica. Section C, Structural chemistry 79(Pt 4) (2023) 133-141
Space group: P 1 21/n 1
Cell volume: 447.56
Cell parameters: 7.3685; 8.0074; 8.4211; 90; 115.741; 90;  

COD ID: 2022703
CIF file

HKL data

Original IUCr paper

Formula: - C5 H8 N2 O -
Comments: Aristov, Michael M.; Geng, Han; Harris, James W.; Berry, John F. Clarifying the structures of imidines: using crystallographic characterization to identify tautomers and localized systems of π-bonding. Acta crystallographica. Section C, Structural chemistry 79(Pt 4) (2023) 133-141
Space group: P -1
Cell volume: 278.05
Cell parameters: 6.3296; 7.0222; 7.351; 84.975; 71.693; 63.889;  

COD ID: 2022704
CIF file

HKL data

Original IUCr paper

Formula: - C6 H13 N3 O -
Comments: Aristov, Michael M.; Geng, Han; Harris, James W.; Berry, John F. Clarifying the structures of imidines: using crystallographic characterization to identify tautomers and localized systems of π-bonding. Acta crystallographica. Section C, Structural chemistry 79(Pt 4) (2023) 133-141
Space group: P 1 21/c 1
Cell volume: 1578
Cell parameters: 9.4887; 14.5341; 12.2828; 90; 111.32; 90;  

COD ID: 2022705
CIF file

HKL data

Original IUCr paper

Formula: - C4 H2 Cl N O2 S -
Comments: George, Tanner; McWilliams, Samantha W.; Masuda, Jason D.; Schriver, Melbourne J. Synthesis and crystal structures of halogenated oxathiazolones and an unexpected propanamide. Acta crystallographica. Section C, Structural chemistry 79(Pt 4) (2023) 125-132
Space group: P 1 21 1
Cell volume: 1814.9
Cell parameters: 9.7839; 10.2313; 18.272; 90; 97.125; 90;  

COD ID: 2022706
CIF file

HKL data

Original IUCr paper

Formula: - C3 H4 Br2 Cl N O -
Comments: George, Tanner; McWilliams, Samantha W.; Masuda, Jason D.; Schriver, Melbourne J. Synthesis and crystal structures of halogenated oxathiazolones and an unexpected propanamide. Acta crystallographica. Section C, Structural chemistry 79(Pt 4) (2023) 125-132
Space group: P 1 21 1
Cell volume: 1463.12
Cell parameters: 6.5967; 24.1942; 9.1724; 90; 91.904; 90;  

COD ID: 2022707
CIF file

HKL data

Original IUCr paper

Formula: - C10 H7 Br2 N O2 S -
Comments: George, Tanner; McWilliams, Samantha W.; Masuda, Jason D.; Schriver, Melbourne J. Synthesis and crystal structures of halogenated oxathiazolones and an unexpected propanamide. Acta crystallographica. Section C, Structural chemistry 79(Pt 4) (2023) 125-132
Space group: P c a 21
Cell volume: 1144.96
Cell parameters: 7.1195; 16.4402; 9.7821; 90; 90; 90;  

COD ID: 2022776
CIF file

HKL data

Original IUCr paper

Formula: - C18 H14 N2 O -
Comments: Ghichi, Nadir; Djedouani, Amel; Hannachid, Douniazed; Elhadi, Said Mohamed; Benboudiaf, Ali; Merazig, Hocine; Ouksel, Louiza; Hellal, Abdelkader; Stoeckli-Evans, Helen Synthesis and crystal structures of two 1H-benzo[d]imidazole derivatives: DFT and anticorrosion studies, and Hirshfeld surface analysis Acta Crystallographica Section C Structural Chemistry 79(7) (2023) 292-304
Space group: P c a 21
Cell volume: 1399.61
Cell parameters: 9.1548; 9.7791; 15.6336; 90; 90; 90;  

COD ID: 2022777
CIF file

HKL data

Original IUCr paper

Formula: - C32 H30 N2 O3 -
Comments: Ghichi, Nadir; Djedouani, Amel; Hannachid, Douniazed; Elhadi, Said Mohamed; Benboudiaf, Ali; Merazig, Hocine; Ouksel, Louiza; Hellal, Abdelkader; Stoeckli-Evans, Helen Synthesis and crystal structures of two 1H-benzo[d]imidazole derivatives: DFT and anticorrosion studies, and Hirshfeld surface analysis Acta Crystallographica Section C Structural Chemistry 79(7) (2023) 292-304
Space group: P -1
Cell volume: 1296.37
Cell parameters: 10.7065; 10.9434; 12.8256; 69.029; 82.871; 67.515;  

COD ID: 2022834
CIF file

HKL data

Original IUCr paper

Formula: - C8 H7 N3 O2 -
Comments: Decato, Daniel; Jahnke, Michael; Berryman, Orion Conformational polymorphism of 3-(azidomethyl)benzoic acid Acta Crystallographica Section C Structural Chemistry 79(9) (2023)
Space group: P 1 21/c 1
Cell volume: 798.68
Cell parameters: 7.6327; 9.5561; 11.2899; 90; 104.095; 90;  

COD ID: 2022835
CIF file

Original IUCr paper

Formula: - C8 H7 N3 O2 -
Comments: Decato, Daniel; Jahnke, Michael; Berryman, Orion Conformational polymorphism of 3-(azidomethyl)benzoic acid Acta Crystallographica Section C Structural Chemistry 79(9) (2023)
Space group: P 1 21/n 1
Cell volume: 803.95
Cell parameters: 3.7712; 6.1229; 34.868; 90; 93.099; 90;  

COD ID: 2022836
CIF file

HKL data

Original IUCr paper

Formula: - C8 H7 N3 O2 -
Comments: Decato, Daniel; Jahnke, Michael; Berryman, Orion Conformational polymorphism of 3-(azidomethyl)benzoic acid Acta Crystallographica Section C Structural Chemistry 79(9) (2023)
Space group: P -1
Cell volume: 395.96
Cell parameters: 3.8029; 9.9199; 11.5709; 66.828; 82.168; 82.245;  

COD ID: 2022847
CIF file

HKL data

Original IUCr paper

Formula: - C40 H40 Cl2 F6 N P2 Pt S Sb -
Comments: Faller, Jack; Parr, Jonathan Hemilability and structural considerations in complexes of platinum(II) comprising bis(diphenylphosphanyl)methane monoxide, monosulfide, and monoselenide Acta Crystallographica Section C Structural Chemistry 79(9) (2023)
Space group: P 21 21 21
Cell volume: 4344
Cell parameters: 12.9774; 18.3039; 18.2877; 90; 90; 90;  

COD ID: 2312035
CIF file

Original IUCr paper

Formula: - C16 H10 F4 I2 N2 S2 -
Comments: 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 79(Pt 4) (2023) 112-117
Space group: P 1 21/c 1
Cell volume: 961.7
Cell parameters: 16.288; 5.79; 10.546; 90; 104.77; 90;  

COD ID: 2312036
CIF file

Original IUCr paper

Formula: - C11 H12 Cl2 N2 S2 -
Comments: 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 79(Pt 4) (2023) 112-117
Space group: F 2 d d
Cell volume: 2633.1
Cell parameters: 8.0815; 17.2161; 18.9254; 90; 90; 90;  

COD ID: 2312037
CIF file

HKL data

Original IUCr paper

Formula: - C14 H23 F I Nb Si2 -
Comments: 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 79(Pt 4) (2023) 158-163
Space group: C 1 2/c 1
Cell volume: 3500.8
Cell parameters: 15.1427; 8.9369; 26.143; 90; 98.304; 90;  

COD ID: 2312038
CIF file

HKL data

Original IUCr paper

Formula: - C21 H25 Cu2 N3 O4 -
Comments: 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 79(Pt 4) (2023) 142-148
Space group: P -1
Cell volume: 1014.4
Cell parameters: 8.0549; 9.8811; 13.7189; 106.451; 103.271; 91.482;  

COD ID: 2312039
CIF file

HKL data

Original IUCr paper

Formula: - C29 H18 F4 N4 O4 -
Comments: 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 79(Pt 4) (2023) 149-157
Space group: P 1 21/c 1
Cell volume: 2546.43
Cell parameters: 23.8353; 6.8067; 16.6103; 90; 109.104; 90;  

COD ID: 2312040
CIF file

HKL data

Original IUCr paper

Formula: - C29 H18 F4 N4 O4 -
Comments: 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 79(Pt 4) (2023) 149-157
Space group: P b c n
Cell volume: 5023
Cell parameters: 13.131; 14.423; 26.523; 90; 90; 90;  

COD ID: 2312043
CIF file

HKL data

Original IUCr paper

Formula: - C26 H20 Cl2 N4 -
Comments: 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 79(Pt 3) (2023) 77-82
Space group: P -1
Cell volume: 573.15
Cell parameters: 6.1037; 9.3345; 10.4146; 83.039; 77.139; 85.055;  

COD ID: 2312044
CIF file

HKL data

Original IUCr paper

Formula: - C26 H20 Cl2 N4 -
Comments: 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 79(Pt 3) (2023) 77-82
Space group: C 1 c 1
Cell volume: 2316.9
Cell parameters: 22.657; 5.4399; 19.086; 90; 99.967; 90;  

COD ID: 2312045
CIF file

HKL data

Original IUCr paper

Formula: - C26 H20 Cl2 N4 -
Comments: 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 79(Pt 3) (2023) 77-82
Space group: C 1 2/c 1
Cell volume: 2316.9
Cell parameters: 22.657; 5.4399; 19.086; 90; 99.967; 90;  

COD ID: 2312046
CIF file

HKL data

Original IUCr paper

Formula: - C25 H19 N -
Comments: 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 79(Pt 3) (2023) 94-103
Space group: P 1 21/c 1
Cell volume: 1812.51
Cell parameters: 12.6112; 8.6352; 17.308; 90; 105.925; 90;  

COD ID: 2312047
CIF file

HKL data

Original IUCr paper

Formula: - C25 H17 Cl2 N -
Comments: 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 79(Pt 3) (2023) 94-103
Space group: C 1 2/c 1
Cell volume: 3831.2
Cell parameters: 28.495; 9.5384; 16.052; 90; 118.581; 90;  

COD ID: 2312048
CIF file

HKL data

Original IUCr paper

Formula: - C32 H22 Br N O -
Comments: 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 79(Pt 3) (2023) 94-103
Space group: P 1 21/n 1
Cell volume: 2414.2
Cell parameters: 12.287; 15.528; 12.844; 90; 99.877; 90;  

COD ID: 2312049
CIF file

HKL data

Original IUCr paper

Formula: - C32 H21 Br Cl N O -
Comments: 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 79(Pt 3) (2023) 94-103
Space group: P -1
Cell volume: 1265.2
Cell parameters: 9.9051; 11.3936; 11.8192; 77.727; 76.116; 86.448;  

COD ID: 2312050
CIF file

HKL data

Original IUCr paper

Formula: - C30 H20 Br N O S -
Comments: 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 79(Pt 3) (2023) 94-103
Space group: P b c a
Cell volume: 4684.8
Cell parameters: 15.5785; 16.4215; 18.3126; 90; 90; 90;  

COD ID: 2312077
CIF file

HKL data

Original IUCr paper

Formula: - C8 H14 N8 O4 -
Comments: 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 79(Pt 5) (2023) 177-185
Space group: P -1
Cell volume: 320.47
Cell parameters: 7.1203; 7.2221; 7.3808; 96.813; 106.031; 114.329;  

COD ID: 2312078
CIF file

HKL data

Original IUCr paper

Formula: - C10 H16 N8 O4 -
Comments: 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 79(Pt 5) (2023) 177-185
Space group: C 1 2/c 1
Cell volume: 1414.27
Cell parameters: 14.5686; 7.1704; 13.9658; 90; 104.209; 90;  

COD ID: 2312079
CIF file

HKL data

Original IUCr paper

Formula: - C10 H18 N8 O4 -
Comments: 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 79(Pt 5) (2023) 177-185
Space group: C 1 2/c 1
Cell volume: 1478.61
Cell parameters: 16.4095; 6.7848; 14.8471; 90; 116.556; 90;  

COD ID: 2312080
CIF file

HKL data

Original IUCr paper

Formula: - C12 H22 N8 O4 -
Comments: 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 79(Pt 5) (2023) 177-185
Space group: P 1 21/c 1
Cell volume: 837.41
Cell parameters: 4.6121; 16.8608; 10.7931; 90; 93.853; 90;  

COD ID: 2312081
CIF file

HKL data

Original IUCr paper

Formula: - C132 H192 B4 N12 -
Comments: 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 79(Pt 5) (2023) 170-176
Space group: P -1
Cell volume: 6109.5
Cell parameters: 15.5952; 15.7968; 25.7779; 74.729; 85.878; 89.857;  

COD ID: 2312093
CIF file

HKL data

Original IUCr paper

Formula: - C55 H41 Cu F6 N P3 -
Comments: 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 79(Pt 5) (2023) 186-192
Space group: P -1
Cell volume: 2365.4
Cell parameters: 11.0585; 12.0918; 19.5318; 73.751; 74.975; 74.263;  

COD ID: 2312094
CIF file

HKL data

Original IUCr paper

Formula: - C17 H16 Cl N2 O2 P -
Comments: 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 79(Pt 5) (2023) 193-203
Space group: P -1
Cell volume: 830.1
Cell parameters: 6.927; 8.613; 14.335; 83.295; 81.574; 80.251;  

COD ID: 2312095
CIF file

HKL data

Original IUCr paper

Formula: - C18 H16 N3 O2 P -
Comments: 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 79(Pt 5) (2023) 193-203
Space group: P -1
Cell volume: 844.6
Cell parameters: 6.267; 9.551; 14.615; 88.185; 84.742; 75.841;  

COD ID: 2312096
CIF file

HKL data

Original IUCr paper

Formula: - C18 H19 N2 O2 P -
Comments: 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 79(Pt 5) (2023) 193-203
Space group: C 1 2/c 1
Cell volume: 3391
Cell parameters: 27.998; 10.747; 11.362; 90; 97.344; 90;  

COD ID: 2312097
CIF file

HKL data

Formula: - C26 H21 Cl N6 O -
Comments: 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 79(Pt 6) (2023) 227-236
Space group: P -1
Cell volume: 1272.6
Cell parameters: 9.652; 9.7408; 14.1445; 98.183; 104.638; 90.059;  

COD ID: 2312098
CIF file

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Original IUCr paper

Formula: - C24 H21 N O -
Comments: 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 79(Pt 6) (2023) 217-226
Space group: C 1 2/c 1
Cell volume: 3599
Cell parameters: 19.5522; 5.8693; 31.3714; 90; 91.438; 90;  

COD ID: 2312099
CIF file

HKL data

Original IUCr paper

Formula: - C18 H17 N O2 -
Comments: 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 79(Pt 6) (2023) 217-226
Space group: C 1 2/c 1
Cell volume: 2840.14
Cell parameters: 25.1922; 5.7621; 20.7012; 90; 109.066; 90;  

COD ID: 2312100
CIF file

HKL data

Original IUCr paper

Formula: - C161 H210 Cl16 N4 Ni O20 P4 Pt2 Si4 -
Comments: 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 79(Pt 4) (2023) 118-124
Space group: P -1
Cell volume: 4635
Cell parameters: 12.702; 19.372; 20.34; 71.313; 81.809; 78.917;  

COD ID: 2312111
CIF file

HKL data

Original IUCr paper

Formula: - Nd0.51 Ni4.83 Tb1.51 Zn12.17 -
Comments: 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 79(Pt 6) (2023) 257-262
Space group: R -3 m :H
Cell volume: 941.38
Cell parameters: 9.0637; 9.0637; 13.2319; 90; 90; 120;  

COD ID: 2312112
CIF file

HKL data

Original IUCr paper

Formula: - C14 H8 F N O2 S -
Comments: 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 79(Pt 6) (2023) 249-256
Space group: P -1
Cell volume: 608.8
Cell parameters: 7.5224; 8.4415; 10.82; 91.437; 104.157; 112.754;  

COD ID: 2312125
CIF file

HKL data

Original IUCr paper

Formula: - C6 H32 Cl3 Co N6 O4 -
Comments: 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 79(Pt 5) (2023) 164-169
Space group: P -3 c 1
Cell volume: 1711.6
Cell parameters: 11.3193; 11.3193; 15.4254; 90; 90; 120;  

COD ID: 2312126
CIF file

HKL data

Original IUCr paper

Formula: - C12 H60 Cl7 Co2 N12 Na O6 -
Comments: 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 79(Pt 5) (2023) 164-169
Space group: P -3 c 1
Cell volume: 1751
Cell parameters: 11.354; 11.354; 15.683; 90; 90; 120;  

COD ID: 2312127
CIF file

HKL data

Original IUCr paper

Formula: - C12 H60 Cl7 Co2 K N12 O6 -
Comments: 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 79(Pt 5) (2023) 164-169
Space group: P -3 c 1
Cell volume: 1775.02
Cell parameters: 11.4444; 11.4444; 15.649; 90; 90; 120;  

COD ID: 2312128
CIF file

HKL data

Original IUCr paper

Formula: - C12 H64 Cl7 Co2 N13 O6 -
Comments: 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 79(Pt 5) (2023) 164-169
Space group: P -3 c 1
Cell volume: 1757.3
Cell parameters: 11.4131; 11.4131; 15.578; 90; 90; 120;  

COD ID: 2312129
CIF file

HKL data

Original IUCr paper

Formula: - C12 H60 Cl7 Co2 N12 Na O6 -
Comments: 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 79(Pt 5) (2023) 164-169
Space group: P 3
Cell volume: 893.2
Cell parameters: 11.32; 11.32; 8.049; 90; 90; 120;  

COD ID: 2312130
CIF file

HKL data

Original IUCr paper

Formula: - C13 H20 N6 S -
Comments: 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 79(7) (2023) 283-291
Space group: P 1 21/n 1
Cell volume: 1457.78
Cell parameters: 9.1032; 10.9034; 15.3748; 90; 107.202; 90;  

COD ID: 2312131
CIF file

HKL data

Original IUCr paper

Formula: - C14 H22 N6 S -
Comments: 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 79(7) (2023) 283-291
Space group: P 1 21/c 1
Cell volume: 3156.04
Cell parameters: 9.3148; 9.386; 36.2261; 90; 94.812; 90;  

COD ID: 2312132
CIF file

HKL data

Original IUCr paper

Formula: - C15 H19 N5 O2 S -
Comments: 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 79(7) (2023) 283-291
Space group: I 1 a 1
Cell volume: 1602.2
Cell parameters: 7.96887; 10.94707; 18.4759; 90; 96.242; 90;  

COD ID: 2312133
CIF file

HKL data

Original IUCr paper

Formula: - C20 H16 N4 O6 Pb -
Comments: 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 79(7) (2023) 263-268
Space group: P 1 21/n 1
Cell volume: 2318
Cell parameters: 7.769; 22.149; 13.656; 90; 99.399; 90;  

COD ID: 2312134
CIF file

HKL data

Original IUCr paper

Formula: - C17 H24 N2 O5 -
Comments: 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 79(7) (2023) 277-282
Space group: P 21 21 21
Cell volume: 1775.9
Cell parameters: 4.82; 19.11; 19.28; 90; 90; 90;  

COD ID: 2312135
CIF file

Original IUCr paper

Formula: - C6 H12 B N O7 S -
Comments: 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 79(7) (2023) 269-276
Space group: P b c a
Cell volume: 2125.32
Cell parameters: 14.1807; 7.4675; 20.0702; 90; 90; 90;  

COD ID: 2312136
CIF file

HKL data

Original IUCr paper

Formula: - C7 H12 B N O6 S -
Comments: 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 79(7) (2023) 269-276
Space group: P 1 21/n 1
Cell volume: 1045.38
Cell parameters: 10.97561; 7.22452; 13.5494; 90; 103.343; 90;  

COD ID: 2312147
CIF file

HKL data

Original IUCr paper

Formula: - C14 H13 N3 O5 -
Comments: 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 79(Pt 6) (2023) 237-248
Space group: P 1 21/n 1
Cell volume: 1371.46
Cell parameters: 15.3082; 5.202; 18.6832; 90; 112.809; 90;  

COD ID: 2312148
CIF file

HKL data

Original IUCr paper

Formula: - C22 H17 Cl N2 O4 -
Comments: 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 79(Pt 6) (2023) 237-248
Space group: P 1 21/n 1
Cell volume: 1938.41
Cell parameters: 5.1567; 21.1373; 17.8054; 90; 92.826; 90;  

COD ID: 2312149
CIF file

HKL data

Original IUCr paper

Formula: - C24 H20 N2 O3 -
Comments: 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 79(Pt 6) (2023) 237-248
Space group: P 1 21/c 1
Cell volume: 1974.89
Cell parameters: 15.344; 5.4552; 23.7301; 90; 96.148; 90;  

COD ID: 2312150
CIF file

HKL data

Original IUCr paper

Formula: - C21 H18 N4 O2 -
Comments: 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 79(Pt 6) (2023) 237-248
Space group: P 1 21/n 1
Cell volume: 1792.37
Cell parameters: 5.1236; 17.7396; 19.7236; 90; 91.09; 90;  

COD ID: 2312156
CIF file

HKL data

Original IUCr paper

Formula: - C26 H28 N4 O10 Zr -
Comments: 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 79(8) (2023)
Space group: P 1 2/n 1
Cell volume: 1365.28
Cell parameters: 11.3873; 9.0517; 14.4136; 90; 113.225; 90;  

COD ID: 2312157
CIF file

HKL data

Original IUCr paper

Formula: - C19 H17 N O2 -
Comments: 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 79(8) (2023)
Space group: P -1
Cell volume: 732.96
Cell parameters: 7.774; 7.9955; 12.4836; 106.383; 98.191; 93.279;  

COD ID: 2312275
CIF file

HKL data

Original IUCr paper

Formula: - Cd Cu2 S4 Si -
Comments: 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 79(9) (2023)
Space group: P m n 21
Cell volume: 308.141
Cell parameters: 7.60853; 6.48071; 6.24923; 90; 90; 90;  

COD ID: 2312276
CIF file

HKL data

Original IUCr paper

Formula: - Cu2 Hg S4 Sn -
Comments: 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 79(9) (2023)
Space group: I -4 2 m
Cell volume: 338.12
Cell parameters: 5.5798; 5.5798; 10.86; 90; 90; 90;  

COD ID: 2312277
CIF file

HKL data

Original IUCr paper

Formula: - C21 H21 N3 O3 -
Comments: 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 79(9) (2023)
Space group: P 1 21/n 1
Cell volume: 1814.3
Cell parameters: 7.4355; 34.195; 7.7242; 90; 112.512; 90;  

COD ID: 2312278
CIF file

HKL data

Original IUCr paper

Formula: - C17 H19 N3 O5 -
Comments: 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 79(9) (2023)
Space group: P 1 21/n 1
Cell volume: 1658.26
Cell parameters: 11.0834; 13.8364; 12.0014; 90; 115.71; 90;  

COD ID: 2312279
CIF file

HKL data

Original IUCr paper

Formula: - C20 H19 N3 O3 -
Comments: 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 79(9) (2023)
Space group: C 1 c 1
Cell volume: 1713.88
Cell parameters: 7.6312; 33.5293; 7.3493; 90; 114.298; 90;  

COD ID: 2312280
CIF file

HKL data

Original IUCr paper

Formula: - C17 H17 Cl N4 O5 -
Comments: 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 79(9) (2023)
Space group: P 1 21/n 1
Cell volume: 1759.27
Cell parameters: 7.2682; 34.0775; 7.6124; 90; 111.081; 90;  

COD ID: 2312281
CIF file

HKL data

Original IUCr paper

Formula: - C17 H19 N3 O5 -
Comments: 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 79(9) (2023)
Space group: P -1
Cell volume: 1658.74
Cell parameters: 9.2054; 11.5589; 15.6268; 92.383; 93.092; 90.666;  

COD ID: 2312282
CIF file

HKL data

Original IUCr paper

Formula: - C8 H6 N4 S2 -
Comments: Wzgarda-Raj, Kinga; Dominikowska, Justyna; Husik, Natallia; Rybarczyk-Pirek, Agnieszka J 2,2'-Dithiobispyrazine: about the disulfide bond. Acta crystallographica. Section C, Structural chemistry 79(9) (2023)
Space group: P -1
Cell volume: 476.24
Cell parameters: 5.6832; 7.4639; 11.7473; 91.524; 95.245; 106.024;  

COD ID: 2312301
CIF file

HKL data

Original IUCr paper

Formula: - C15 H17 N O4 -
Comments: 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 79(10) (2023)
Space group: P 1 21/c 1
Cell volume: 1329.31
Cell parameters: 11.7637; 11.746; 10.3316; 90; 111.384; 90;  

COD ID: 2312302
CIF file

HKL data

Original IUCr paper

Formula: - C15 H16 N2 O6 -
Comments: 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 79(10) (2023)
Space group: P 1 21/n 1
Cell volume: 1472.33
Cell parameters: 7.4993; 18.5051; 10.761; 90; 99.628; 90;  

COD ID: 2312303
CIF file

HKL data

Original IUCr paper

Formula: - C18 H28 N2 O10 S2 -
Comments: 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 79(10) (2023)
Space group: P b c a
Cell volume: 2173.6
Cell parameters: 10.6328; 8.5651; 23.8669; 90; 90; 90;  

COD ID: 2312304
CIF file

HKL data

Original IUCr paper

Formula: - C14 H19 N O7 S -
Comments: 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 79(10) (2023)
Space group: P 1 21/c 1
Cell volume: 1586.95
Cell parameters: 17.4085; 11.9234; 7.6779; 90; 95.273; 90;  

COD ID: 2312305
CIF file

HKL data

Original IUCr paper

Formula: - C6 H12 Bi O9 -
Comments: 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 79(10) (2023)
Space group: P -1
Cell volume: 526.51
Cell parameters: 7.6518; 8.2376; 9.6402; 102.414; 93.1; 115.838;  

COD ID: 2312306
CIF file

HKL data

Original IUCr paper

Formula: - C8 H14 Bi2 O12 -
Comments: 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 79(10) (2023)
Space group: P -1
Cell volume: 725.97
Cell parameters: 7.8258; 9.6629; 10.1924; 81.457; 75.553; 77.881;  

COD ID: 2312307
CIF file

HKL data

Original IUCr paper

Formula: - C81 H58 Cl2 O38 P2 -
Comments: Som, Shubham; Hasija, Avantika; Chopra, Deepak From liquid to crystal via mechanochemical grinding: unique host-guest (HOF) cocrystal. Acta crystallographica. Section C, Structural chemistry 79(10) (2023)
Space group: C 1 2/c 1
Cell volume: 15771
Cell parameters: 28.778; 16.511; 34.938; 90; 108.189; 90;  

COD ID: 2312308
CIF file

HKL data

Original IUCr paper

Formula: - C16 H12 N2 O10 Tc2 -
Comments: 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 79(10) (2023)
Space group: P n a 21
Cell volume: 2280
Cell parameters: 18.116; 10.359; 12.148; 90; 90; 90;  

COD ID: 2312309
CIF file

HKL data

Original IUCr paper

Formula: - C18 H16 N2 O8 Tc2 -
Comments: 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 79(10) (2023)
Space group: P n a 21
Cell volume: 2280
Cell parameters: 18.116; 10.359; 12.148; 90; 90; 90;  

COD ID: 2312310
CIF file

HKL data

Original IUCr paper

Formula: - C10 H15 Cl N6 O4 -
Comments: 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 79(10) (2023)
Space group: P -1
Cell volume: 669.88
Cell parameters: 8.3769; 8.7294; 9.7804; 74.8391; 79.5481; 78.3934;  

COD ID: 2312311
CIF file

HKL data

Original IUCr paper

Formula: - C11 H16 N6 O6 -
Comments: 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 79(10) (2023)
Space group: P 1 21/c 1
Cell volume: 1365.8
Cell parameters: 8.2567; 12.7736; 13.2612; 90; 102.433; 90;  

COD ID: 2312312
CIF file

HKL data

Original IUCr paper

Formula: - C4 H11 N5 O5 S -
Comments: 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 79(10) (2023)
Space group: P 1 21/n 1
Cell volume: 885.85
Cell parameters: 9.0198; 10.1953; 9.8987; 90; 103.305; 90;  

COD ID: 2312313
CIF file

HKL data

Original IUCr paper

Formula: - C11 H15 N7 O8 -
Comments: 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 79(10) (2023)
Space group: P -1
Cell volume: 811.5
Cell parameters: 6.977; 10.5805; 11.217; 83.491; 87.651; 80.623;  

COD ID: 2312314
CIF file

HKL data

Original IUCr paper

Formula: - C34 H22 N4 -
Comments: 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 79(10) (2023)
Space group: P -1
Cell volume: 1267.72
Cell parameters: 8.5339; 11.8471; 13.2628; 87.563; 71.508; 85.627;  

COD ID: 2312315
CIF file

HKL data

Original IUCr paper

Formula: - C34 H20 N4 -
Comments: 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 79(10) (2023)
Space group: P 1 21/c 1
Cell volume: 2482.2
Cell parameters: 11.7306; 7.1509; 29.769; 90; 96.28; 90;  

COD ID: 2312316
CIF file

HKL data

Original IUCr paper

Formula: - C44 H52 Cu2 K2 O4 -
Comments: 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 79(Pt 11) (2023) 456-463
Space group: P -1
Cell volume: 981.3
Cell parameters: 9.6864; 10.484; 10.658; 66.22; 89.67; 82.73;  

COD ID: 2312321
CIF file

HKL data

Original IUCr paper

Formula: - C13 H12 F3 N3 O S -
Comments: 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 79(11) (2023)
Space group: P 1 21/c 1
Cell volume: 1337.97
Cell parameters: 7.2418; 28.0107; 7.3569; 90; 116.29; 90;  

COD ID: 2312322
CIF file

HKL data

Original IUCr paper

Formula: - C13 H12 F3 N3 O S -
Comments: 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 79(11) (2023)
Space group: P 1 21/c 1
Cell volume: 1316.2
Cell parameters: 6.1727; 27.9473; 7.6297; 90; 90.123; 90;  

COD ID: 2312323
CIF file

HKL data

Original IUCr paper

Formula: - C16 H16 Br N3 -
Comments: 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 79(11) (2023)
Space group: P -1
Cell volume: 760.44
Cell parameters: 7.8073; 9.8003; 10.79; 72.964; 85.084; 74.448;  

COD ID: 2312333
CIF file

HKL data

Original IUCr paper

Formula: - C32 H28 Cl6 N8 Ru -
Comments: 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 79(Pt 12) (2023) 491-496
Space group: P -1
Cell volume: 1631.99
Cell parameters: 11.2435; 11.4038; 13.634; 74.278; 75.995; 84.642;  

COD ID: 2312334
CIF file

HKL data

Original IUCr paper

Formula: - C31 H25 Cl4 F6 N8 Ru Sb -
Comments: 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 79(Pt 12) (2023) 491-496
Space group: P 1 21/n 1
Cell volume: 3538.5
Cell parameters: 8.3209; 27.3213; 15.7839; 90; 99.554; 90;  

COD ID: 2312363
CIF file

HKL data

Original IUCr paper

Formula: - C10 H16 Cl2 Co0.2 N4 Zn0.8 -
Comments: 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 79(12) (2023) 520-529
Space group: C 1 2/c 1
Cell volume: 2976.08
Cell parameters: 15.0191; 8.304; 23.9862; 90; 95.8239; 90;  

COD ID: 2312364
CIF file

HKL data

Original IUCr paper

Formula: - C20 H30 Br1.4 Cl0.6 Co0.2 N8 Zn1.8 -
Comments: 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 79(12) (2023) 520-529
Space group: P -1
Cell volume: 666.7
Cell parameters: 8.2698; 8.406; 10.3062; 84.826; 69.156; 87.133;  


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