Crystallography Open Database
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Result : There are 119 entries in the selection
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Searching journal of publication like 'ACS sustainable chemistry & engineering'
| COD ID: 4515206 | |
| CIF file | Formula: - C46 H34 Cu2 N6 O13 S2 - Comments: Panda, Dillip K.; Maity, Krishnendu; Palukoshka, Andrei; Ibrahim, Faysal; Saha, Sourav Li+ Ion-Conducting Sulfonate-Based Neutral Metal‒Organic Framework ACS Sustainable Chemistry & Engineering 7(5) (2019) 4619 Space group: P 1 21/c 1 Cell volume: 4169.2 Cell parameters: 10.8699; 28.1809; 13.7206; 90; 97.267; 90; |
| COD ID: 4515207 | |
| CIF file | Formula: - C51 H60 N4 Nd O4 P - Comments: Cheisson, Thibault; Cole, Bren E.; Manor, Brian C.; Carroll, Patrick J.; Schelter, Eric J. Phosphoryl-Ligand Adducts of Rare Earth-TriNOx Complexes: Systematic Studies and Implications for Separations Chemistry ACS Sustainable Chemistry & Engineering 7(5) (2019) 4993 Space group: P 1 21/c 1 Cell volume: 4624.5 Cell parameters: 19.1883; 12.5853; 19.3989; 90; 99.19; 90; |
| COD ID: 4515208 | |
| CIF file | Formula: - C36 H54 N4 Nd O4 P - Comments: Cheisson, Thibault; Cole, Bren E.; Manor, Brian C.; Carroll, Patrick J.; Schelter, Eric J. Phosphoryl-Ligand Adducts of Rare Earth-TriNOx Complexes: Systematic Studies and Implications for Separations Chemistry ACS Sustainable Chemistry & Engineering 7(5) (2019) 4993 Space group: C 1 2/c 1 Cell volume: 7859.8 Cell parameters: 38.1969; 10.9454; 19.2649; 90; 102.615; 90; |
| COD ID: 4515209 | |
| CIF file | Formula: - C39 H63 N7 Nd O4 P - Comments: Cheisson, Thibault; Cole, Bren E.; Manor, Brian C.; Carroll, Patrick J.; Schelter, Eric J. Phosphoryl-Ligand Adducts of Rare Earth-TriNOx Complexes: Systematic Studies and Implications for Separations Chemistry ACS Sustainable Chemistry & Engineering 7(5) (2019) 4993 Space group: P 1 21/c 1 Cell volume: 4216.1 Cell parameters: 11.9949; 18.6326; 18.9129; 90; 94.109; 90; |
| COD ID: 4515210 | |
| CIF file | Formula: - C36 H54 N4 Nd O7 P - Comments: Cheisson, Thibault; Cole, Bren E.; Manor, Brian C.; Carroll, Patrick J.; Schelter, Eric J. Phosphoryl-Ligand Adducts of Rare Earth-TriNOx Complexes: Systematic Studies and Implications for Separations Chemistry ACS Sustainable Chemistry & Engineering 7(5) (2019) 4993 Space group: C 1 2/c 1 Cell volume: 7933.3 Cell parameters: 16.5739; 17.6173; 27.2443; 90; 94.233; 90; |
| COD ID: 4515211 | |
| CIF file | Formula: - C39 H60 N4 Nd O4 P - Comments: Cheisson, Thibault; Cole, Bren E.; Manor, Brian C.; Carroll, Patrick J.; Schelter, Eric J. Phosphoryl-Ligand Adducts of Rare Earth-TriNOx Complexes: Systematic Studies and Implications for Separations Chemistry ACS Sustainable Chemistry & Engineering 7(5) (2019) 4993 Space group: C 1 2/c 1 Cell volume: 8190.2 Cell parameters: 16.4859; 17.8257; 27.8903; 90; 92.188; 90; |
| COD ID: 4515212 | |
| CIF file | Formula: - C45 H72 N4 Nd O4 P - Comments: Cheisson, Thibault; Cole, Bren E.; Manor, Brian C.; Carroll, Patrick J.; Schelter, Eric J. Phosphoryl-Ligand Adducts of Rare Earth-TriNOx Complexes: Systematic Studies and Implications for Separations Chemistry ACS Sustainable Chemistry & Engineering 7(5) (2019) 4993 Space group: P -1 Cell volume: 2285.4 Cell parameters: 11.5283; 12.1595; 16.8509; 86.866; 85.925; 76.097; |
| COD ID: 4515213 | |
| CIF file | Formula: - C33 H45 Dy N4 O3 - Comments: Cheisson, Thibault; Cole, Bren E.; Manor, Brian C.; Carroll, Patrick J.; Schelter, Eric J. Phosphoryl-Ligand Adducts of Rare Earth-TriNOx Complexes: Systematic Studies and Implications for Separations Chemistry ACS Sustainable Chemistry & Engineering 7(5) (2019) 4993 Space group: P -1 Cell volume: 3151.6 Cell parameters: 11.8184; 14.1946; 19.7841; 89.948; 89.399; 71.741; |
| COD ID: 4515214 | |
| CIF file | Formula: - C42 H66 N4 Nd O4 P - Comments: Cheisson, Thibault; Cole, Bren E.; Manor, Brian C.; Carroll, Patrick J.; Schelter, Eric J. Phosphoryl-Ligand Adducts of Rare Earth-TriNOx Complexes: Systematic Studies and Implications for Separations Chemistry ACS Sustainable Chemistry & Engineering 7(5) (2019) 4993 Space group: P 1 21/c 1 Cell volume: 4241.6 Cell parameters: 14.5413; 18.4181; 15.8401; 90; 91.075; 90; |
| COD ID: 4515215 | |
| CIF file | Formula: - C39 H60 Dy N4 O4 P - Comments: Cheisson, Thibault; Cole, Bren E.; Manor, Brian C.; Carroll, Patrick J.; Schelter, Eric J. Phosphoryl-Ligand Adducts of Rare Earth-TriNOx Complexes: Systematic Studies and Implications for Separations Chemistry ACS Sustainable Chemistry & Engineering 7(5) (2019) 4993 Space group: P 1 21/n 1 Cell volume: 3890.48 Cell parameters: 16.1024; 13.8935; 17.4194; 90; 93.326; 90; |
| COD ID: 4515216 | |
| CIF file | Formula: - C39 H63 Dy N7 O4 P - Comments: Cheisson, Thibault; Cole, Bren E.; Manor, Brian C.; Carroll, Patrick J.; Schelter, Eric J. Phosphoryl-Ligand Adducts of Rare Earth-TriNOx Complexes: Systematic Studies and Implications for Separations Chemistry ACS Sustainable Chemistry & Engineering 7(5) (2019) 4993 Space group: P 1 21/c 1 Cell volume: 4151.1 Cell parameters: 11.903; 18.563; 18.834; 90; 94.039; 90; |
| COD ID: 4515217 | |
| CIF file | Formula: - C42 H66 Dy N4 O4 P - Comments: Cheisson, Thibault; Cole, Bren E.; Manor, Brian C.; Carroll, Patrick J.; Schelter, Eric J. Phosphoryl-Ligand Adducts of Rare Earth-TriNOx Complexes: Systematic Studies and Implications for Separations Chemistry ACS Sustainable Chemistry & Engineering 7(5) (2019) 4993 Space group: P 1 21/c 1 Cell volume: 4263.2 Cell parameters: 12.054; 18.776; 18.8372; 90; 90.503; 90; |
| COD ID: 4515218 | |
| CIF file | Formula: - C8 H13 N O4 - Comments: Sagawa, Takuya; Kobayashi, Hirokazu; Murata, Chinatsu; Shichibu, Yukatsu; Konishi, Katsuaki; Fukuoka, Atsushi Catalytic Conversion of a Chitin-Derived Sugar Alcohol to an Amide-Containing Isosorbide Analog ACS Sustainable Chemistry & Engineering 7(17) (2019) 14883 Space group: P 1 21 1 Cell volume: 424.3 Cell parameters: 6.217; 7.746; 9.321; 90; 109.041; 90; |
| COD ID: 4515219 | |
| CIF file | Formula: - C44 H94 Cl6 N4 O4 Sn - Comments: Doidge, Euan D.; Kinsman, Luke M. M.; Ji, Yiran; Carson, Innis; Duffy, Andrew J.; Kordas, Izabela A.; Shao, Eddie; Tasker, Peter A.; Ngwenya, Bryne T.; Morrison, Carole A.; Love, Jason B. Evaluation of Simple Amides in the Selective Recovery of Gold from Secondary Sources by Solvent Extraction ACS Sustainable Chemistry & Engineering 7(17) (2019) 15019 Space group: P 1 21/n 1 Cell volume: 2826.36 Cell parameters: 18.1977; 8.4952; 19.6349; 90; 111.389; 90; |
| COD ID: 4515220 | |
| CIF file | Formula: - C21.46 H10 Cl0.25 Cr0.25 O8 Zr1.5 - Comments: Goetjen, Timothy A.; Zhang, Xuan; Liu, Jian; Hupp, Joseph T.; Farha, Omar K. Metal‒Organic Framework Supported Single Site Chromium(III) Catalyst for Ethylene Oligomerization at Low Pressure and Temperature ACS Sustainable Chemistry & Engineering 7(2) (2019) 2553 Space group: P 6/m m m Cell volume: 22130 Cell parameters: 39.1; 39.1; 16.7147; 90; 90; 120; |
| COD ID: 4515221 | |
| CIF file | Formula: - C8 H8 Cl I O - Comments: Yi, Wei; Wang, Peng-Fei; Lu, Meng; Liu, Qian-Qian; Bai, Xue; Chen, Kai-Die; Zhang, Jing-Wen; Liu, Gong-Qing Environmentally Friendly Protocol for the Oxidative Iodofunctionalization of Olefins in a Green Solvent ACS Sustainable Chemistry & Engineering 7(19) (2019) 16777 Space group: P 1 21/n 1 Cell volume: 888.84 Cell parameters: 13.0502; 4.5002; 15.3524; 90; 99.661; 90; |
| COD ID: 4515222 | |
| CIF file | Formula: - C68 H67 N8 O6 - Comments: Paul, Suparna; Bhuyan, Samuzal; Mukhopadhyay, Subhra Kanti; Murmu, Naresh Chandra; Banerjee, Priyabrata Sensitive and Selective in Vitro Recognition of Biologically Toxic As(III) by Rhodamine Based Chemoreceptor ACS Sustainable Chemistry & Engineering 7(16) (2019) 13687 Space group: P 1 21/c 1 Cell volume: 5664 Cell parameters: 9.1158; 32.969; 19.0369; 90; 98.12; 90; |
| COD ID: 4515223 | |
| CIF file | Formula: - C46 H34 F18 I2 N2 O2 - Comments: Wang, Shuo-Wen; Yu, Jian; Zhou, Qin-Yi; Chen, Si-Yu; Xu, Zhen-Hua; Tang, Shi Visible-Light-Induced Atom Transfer Radical Addition and Cyclization of Perfluoroalkyl Halides with 1,n-Enynes ACS Sustainable Chemistry & Engineering 7(11) (2019) 10154 Space group: P -1 Cell volume: 2341.7 Cell parameters: 9.6843; 15.0889; 16.578; 89.55; 78.093; 81.195; |
| COD ID: 4515224 | |
| CIF file | Formula: - C8 H10 F6 N4 O4 S2 - Comments: Zulfiqar, Sonia; Mantione, Daniele; El Tall, Omar; Ruipérez, Fernando; Sarwar, Muhammad Ilyas; Rothenberger, Alexander; Mecerreyes, David Pyridinium Containing Amide Based Polymeric Ionic Liquids for CO2/CH4 Separation ACS Sustainable Chemistry & Engineering 7(12) (2019) 10241 Space group: P 21 21 21 Cell volume: 6028.68 Cell parameters: 11.21892; 11.41336; 47.0823; 90; 90; 90; |
| COD ID: 4515225 | |
| CIF file | Formula: - C30 H30 Cu6 N12 O0 S6 - Comments: Wang, XiaoXuan; Xu, XinXin; Liu, Ning; Shi, Fa-Nian; Shi, GuiMei Zn‒H+ Battery, Versatile Energy Conversion Equipment for Electricity Generation and H2 Production Simultaneously ACS Sustainable Chemistry & Engineering 7(12) (2019) 10979 Space group: P c a 21 Cell volume: 4285.3 Cell parameters: 18.5028; 11.5294; 20.0879; 90; 90; 90; |
| COD ID: 4516230 | |
| CIF file | Formula: - C36 H36 Cu4 I4 N4 S8 - Comments: Liu, Guang-Ning; Xu, Rang-Dong; Zhao, Ruo-Yu; Sun, Yiqiang; Bo, Qi-Bing; Duan, Zhong-Yao; Li, Yue-Hua; Wang, Yang-Yang; Wu, Qian; Li, Cuncheng Hybrid Copper Iodide Cluster-Based Pellet Sensor for Highly Selective Optical Detection of o-Nitrophenol and Tetracycline Hydrochloride in Aqueous Solution ACS Sustainable Chemistry & Engineering 7(23) (2019) 18863 Space group: P 1 21/c 1 Cell volume: 2309.4 Cell parameters: 11.2976; 14.1599; 15.1689; 90; 107.882; 90; |
| COD ID: 4517003 | |
| CIF file | Formula: - C14 H14 N2 O3 S - Comments: Cunha, Micael R.; Tavares, Maurício T.; Carvalho, Camila F.; Silva, Nuno A. T.; Souza, Alfredo D. F.; Pereira, Gustavo J. V.; Ferreira, Fábio F.; Parise-Filho, Roberto Environmentally Safe Condition for the Synthesis of Aryl and Alkyl Sulfonyl Hydrazones via One-Pot Reaction ACS Sustainable Chemistry & Engineering 4(4) (2016) 1899 Space group: P 1 21/c 1 Cell volume: 1400.19 Cell parameters: 11.5414; 12.288; 10.9161; 90; 115.252; 90; |
| COD ID: 4517004 | |
| CIF file | Formula: - C11 H10 O5 - Comments: Wilson, Jedediah; Chen, Eugene Y.-X. Organocatalytic Cross-Coupling of Biofuranics to Multifunctional Difuranic C11 Building Blocks ACS Sustainable Chemistry & Engineering 4(9) (2016) 4927 Space group: P -1 Cell volume: 490.69 Cell parameters: 5.6317; 7.7476; 11.7256; 96.036; 92.324; 104.799; |
| COD ID: 4517005 | |
| CIF file | Formula: - C38 H48 N6 O13 - Comments: Udagawa, Akihiro; Johnston, Priscilla; Uekusa, Hidehiro; Koshima, Hideko; Saito, Kei; Asahi, Toru Solid-State Photochemical Reaction of Multisubstituted Thymine Derivatives ACS Sustainable Chemistry & Engineering 4(11) (2016) 6107 Space group: C 1 2/c 1 Cell volume: 7737 Cell parameters: 41.6712; 9.02761; 26.1878; 90; 128.247; 90; |
| COD ID: 4517006 | |
| CIF file | Formula: - C46 H54 N8 O16 - Comments: Udagawa, Akihiro; Johnston, Priscilla; Uekusa, Hidehiro; Koshima, Hideko; Saito, Kei; Asahi, Toru Solid-State Photochemical Reaction of Multisubstituted Thymine Derivatives ACS Sustainable Chemistry & Engineering 4(11) (2016) 6107 Space group: P 1 21/c 1 Cell volume: 2263.63 Cell parameters: 11.0679; 13.2125; 16.1614; 90; 106.704; 90; |
| COD ID: 4517007 | |
| CIF file | Formula: - C26 H32 N4 O9 - Comments: Udagawa, Akihiro; Johnston, Priscilla; Uekusa, Hidehiro; Koshima, Hideko; Saito, Kei; Asahi, Toru Solid-State Photochemical Reaction of Multisubstituted Thymine Derivatives ACS Sustainable Chemistry & Engineering 4(11) (2016) 6107 Space group: P 1 21/c 1 Cell volume: 2642.5 Cell parameters: 10.943; 12.7063; 19.0931; 90; 95.517; 90; |
| COD ID: 4517008 | |
| CIF file | Formula: - C22 H28 Na O9 S - Comments: Miles-Barrett, Daniel M.; Montgomery, James R. D.; Lancefield, Christopher S.; Cordes, David B.; Slawin, Alexandra M. Z.; Lebl, Tomas; Carr, Reuben; Westwood, Nicholas J. Use of Bisulfite Processing To Generate High-β-O-4 Content Water-Soluble Lignosulfonates ACS Sustainable Chemistry & Engineering 5(2) (2017) 1831 Space group: I 1 a 1 Cell volume: 4571 Cell parameters: 19.0828; 11.0641; 21.971; 90; 99.81; 90; |
| COD ID: 4517009 | |
| CIF file | Formula: - C20 H15 Cl2 F N4 O8 - Comments: Chen, Liang; Huang, Rong; Du, Xuan-Xuan; Yan, Sheng-Jiao; Lin, Jun One-Pot Synthesis of Highly Functionalized Bicyclic Imidazopyridinium Derivatives in Ethanol ACS Sustainable Chemistry & Engineering 5(2) (2017) 1899 Space group: P 1 21/n 1 Cell volume: 2077.9 Cell parameters: 7.8249; 22.011; 12.217; 90; 99.059; 90; |
| COD ID: 4517010 | |
| CIF file | Formula: - C28 H16 N O4 Zn - Comments: Zhao, Hongmei; Xia, Qiansu; Xing, Hongzhu; Chen, Dashu; Wang, Hong Construction of Pillared-Layer MOF as Efficient Visible-Light Photocatalysts for Aqueous Cr(VI) Reduction and Dye Degradation ACS Sustainable Chemistry & Engineering 5(5) (2017) 4449 Space group: P 1 21/c 1 Cell volume: 2675 Cell parameters: 7.8228; 19.98; 17.1179; 90; 91.087; 90; |
| COD ID: 4517011 | |
| CIF file | Formula: - C21 H18 N2 O2 S - Comments: Pigulski, Bartłomiej; Cichos, Jakub; Szafert, Sławomir Polyynes as Precursors of Photoluminescent Solvent Polarity Probes ACS Sustainable Chemistry & Engineering 5(8) (2017) 7077 Space group: P 1 21/c 1 Cell volume: 1769.6 Cell parameters: 16.376; 5.782; 19.03; 90; 100.86; 90; |
| COD ID: 4517012 | |
| CIF file | Formula: - C16 H20 N2 O5 S - Comments: Mehrotra, Sonam; Raje, Sakthi; Jain, Anant Kumar; Angamuthu, Raja Benzimidazolines Convert Sulfur Dioxide to Bisulfate at Room Temperature and Atmospheric Pressure Utilizing Aerial Oxygen ACS Sustainable Chemistry & Engineering 5(7) (2017) 6322 Space group: P n n a Cell volume: 1616.7 Cell parameters: 6.7039; 10.6697; 22.602; 90; 90; 90; |
| COD ID: 4517013 | |
| CIF file | Formula: - C20 H20 N5 O5 S - Comments: Mehrotra, Sonam; Raje, Sakthi; Jain, Anant Kumar; Angamuthu, Raja Benzimidazolines Convert Sulfur Dioxide to Bisulfate at Room Temperature and Atmospheric Pressure Utilizing Aerial Oxygen ACS Sustainable Chemistry & Engineering 5(7) (2017) 6322 Space group: P -1 Cell volume: 1564 Cell parameters: 10.8743; 12.9713; 13.3718; 64.0149; 71.014; 70.772; |
| COD ID: 4517014 | |
| CIF file | Formula: - C14 H14 Br N3 O4 S - Comments: Mehrotra, Sonam; Raje, Sakthi; Jain, Anant Kumar; Angamuthu, Raja Benzimidazolines Convert Sulfur Dioxide to Bisulfate at Room Temperature and Atmospheric Pressure Utilizing Aerial Oxygen ACS Sustainable Chemistry & Engineering 5(7) (2017) 6322 Space group: P -1 Cell volume: 779.1 Cell parameters: 7.907; 8.536; 11.911; 83.119; 78.561; 83.567; |
| COD ID: 4517015 | |
| CIF file | Formula: - C36 H34 Fe I2 N10 - Comments: Chen, Fei; Liu, Ning; Dai, Bin Iron(II) Bis-CNN Pincer Complex-Catalyzed Cyclic Carbonate Synthesis at Room Temperature ACS Sustainable Chemistry & Engineering 5(10) (2017) 9065 Space group: P b c a Cell volume: 7911 Cell parameters: 17.516; 19.233; 23.482; 90; 90; 90; |
| COD ID: 4517016 | |
| CIF file | Formula: - C13 H9 N2 O4 Zn - Comments: Senthilkumar, S.; Goswami, Ranadip; Obasi, Nnamdi Lawrence; Neogi, Subhadip Construction of Pillar-Layer Metal‒Organic Frameworks for CO2 Adsorption under Humid Climate: High Selectivity and Sensitive Detection of Picric Acid in Water ACS Sustainable Chemistry & Engineering 5(12) (2017) 11307 Space group: P 1 21/c 1 Cell volume: 1456.6 Cell parameters: 12.549; 7.632; 16.158; 90; 109.74; 90; |
| COD ID: 4517017 | |
| CIF file | Formula: - C13 H9 N3 O4 Zn - Comments: Senthilkumar, S.; Goswami, Ranadip; Obasi, Nnamdi Lawrence; Neogi, Subhadip Construction of Pillar-Layer Metal‒Organic Frameworks for CO2 Adsorption under Humid Climate: High Selectivity and Sensitive Detection of Picric Acid in Water ACS Sustainable Chemistry & Engineering 5(12) (2017) 11307 Space group: P 1 21/c 1 Cell volume: 1736.1 Cell parameters: 14.702; 7.736; 15.973; 90; 107.124; 90; |
| COD ID: 4517018 | |
| CIF file | Formula: - C14 H10 N2 O4 Zn - Comments: Senthilkumar, S.; Goswami, Ranadip; Obasi, Nnamdi Lawrence; Neogi, Subhadip Construction of Pillar-Layer Metal‒Organic Frameworks for CO2 Adsorption under Humid Climate: High Selectivity and Sensitive Detection of Picric Acid in Water ACS Sustainable Chemistry & Engineering 5(12) (2017) 11307 Space group: C 1 2/c 1 Cell volume: 4110.7 Cell parameters: 35.331; 7.6491; 16.0546; 90; 108.658; 90; |
| COD ID: 4517019 | |
| CIF file | Formula: - C11 H7 N5 O7 - Comments: Senthilkumar, S.; Goswami, Ranadip; Obasi, Nnamdi Lawrence; Neogi, Subhadip Construction of Pillar-Layer Metal‒Organic Frameworks for CO2 Adsorption under Humid Climate: High Selectivity and Sensitive Detection of Picric Acid in Water ACS Sustainable Chemistry & Engineering 5(12) (2017) 11307 Space group: P 1 21/n 1 Cell volume: 1254.1 Cell parameters: 5.535; 19.583; 11.673; 90; 97.599; 90; |
| COD ID: 4517020 | |
| CIF file | Formula: - C38 H36 N2 O7 - Comments: García-Montero, Angel; Rodriguez, Antonio M.; Juan, Alberto; Velders, Aldrik H.; Denisi, Antonio; Jiménez-Osés, Gonzalo; Gómez-Bengoa, Enrique; Cativiela, Carlos; Gómez, Maria Victoria; Urriolabeitia, Esteban P. Metal-Free [2 + 2]-Photocycloaddition of (Z)-4-Aryliden-5(4H)-Oxazolones as Straightforward Synthesis of 1,3-Diaminotruxillic Acid Precursors: Synthetic Scope and Mechanistic Studies ACS Sustainable Chemistry & Engineering 5(9) (2017) 8370 Space group: P -1 Cell volume: 1653.87 Cell parameters: 11.2185; 13.1576; 13.44; 111.204; 93.969; 112.787; |
| COD ID: 4517021 | |
| CIF file | Formula: - C34 H26 N2 O4 - Comments: García-Montero, Angel; Rodriguez, Antonio M.; Juan, Alberto; Velders, Aldrik H.; Denisi, Antonio; Jiménez-Osés, Gonzalo; Gómez-Bengoa, Enrique; Cativiela, Carlos; Gómez, Maria Victoria; Urriolabeitia, Esteban P. Metal-Free [2 + 2]-Photocycloaddition of (Z)-4-Aryliden-5(4H)-Oxazolones as Straightforward Synthesis of 1,3-Diaminotruxillic Acid Precursors: Synthetic Scope and Mechanistic Studies ACS Sustainable Chemistry & Engineering 5(9) (2017) 8370 Space group: P -1 Cell volume: 658.87 Cell parameters: 7.5802; 9.6279; 10.5678; 69.46; 73.023; 68.198; |
| COD ID: 4517022 | |
| CIF file | Formula: - C38 H34 Cl4 N2 O8 - Comments: García-Montero, Angel; Rodriguez, Antonio M.; Juan, Alberto; Velders, Aldrik H.; Denisi, Antonio; Jiménez-Osés, Gonzalo; Gómez-Bengoa, Enrique; Cativiela, Carlos; Gómez, Maria Victoria; Urriolabeitia, Esteban P. Metal-Free [2 + 2]-Photocycloaddition of (Z)-4-Aryliden-5(4H)-Oxazolones as Straightforward Synthesis of 1,3-Diaminotruxillic Acid Precursors: Synthetic Scope and Mechanistic Studies ACS Sustainable Chemistry & Engineering 5(9) (2017) 8370 Space group: P 1 21/c 1 Cell volume: 3800.8 Cell parameters: 13.9228; 17.8301; 16.472; 90; 111.643; 90; |
| COD ID: 4517023 | |
| CIF file | Formula: - C18 H15 N O4 - Comments: García-Montero, Angel; Rodriguez, Antonio M.; Juan, Alberto; Velders, Aldrik H.; Denisi, Antonio; Jiménez-Osés, Gonzalo; Gómez-Bengoa, Enrique; Cativiela, Carlos; Gómez, Maria Victoria; Urriolabeitia, Esteban P. Metal-Free [2 + 2]-Photocycloaddition of (Z)-4-Aryliden-5(4H)-Oxazolones as Straightforward Synthesis of 1,3-Diaminotruxillic Acid Precursors: Synthetic Scope and Mechanistic Studies ACS Sustainable Chemistry & Engineering 5(9) (2017) 8370 Space group: P 1 21/c 1 Cell volume: 1487.52 Cell parameters: 12.4183; 13.3678; 8.9785; 90; 93.613; 90; |
| COD ID: 4517024 | |
| CIF file | Formula: - C32 H34 F3 N3 O3 - Comments: Wang, Bao-Qu; Luo, Qin; Xiao, Qiang; Lin, Jun; Yan, Sheng-Jiao Synthesis of Quinone Methide Substituted Neonicotinoid Derivatives via 1,6-Conjugate Addition of N-Benzyl Nitro Ketene Aminals with para-Quinone Methides Accompanying Oxidation ACS Sustainable Chemistry & Engineering 5(9) (2017) 8382 Space group: P 1 21/c 1 Cell volume: 3793.1 Cell parameters: 13.96; 19.71; 15.38; 90; 116.32; 90; |
| COD ID: 4517025 | |
| CIF file | Formula: - C12 H14 O8 - Comments: Kumalaputri, Angela J.; Randolph, Caelan; Otten, Edwin; Heeres, Hero J.; Deuss, Peter J. Lewis Acid Catalyzed Conversion of 5-Hydroxymethylfurfural to 1,2,4-Benzenetriol, an Overlooked Biobased Compound. ACS sustainable chemistry & engineering 6(3) (2018) 3419-3425 Space group: P 1 2/n 1 Cell volume: 572.2 Cell parameters: 3.8541; 6.0625; 24.554; 90; 94.163; 90; |
| COD ID: 4517026 | |
| CIF file | Formula: - C21 H24 N2 O S - Comments: Dahiya, Anjali; Ali, Wajid; Patel, Bhisma K. Catalyst and Solvent Free Domino Ring Opening Cyclization: A Greener and Atom Economic Route to 2-Iminothiazolidines ACS Sustainable Chemistry & Engineering 6(3) (2018) 4272 Space group: P 21 21 21 Cell volume: 1986.9 Cell parameters: 5.6334; 17.0832; 20.6455; 90; 90; 90; |
| COD ID: 4517027 | |
| CIF file | Formula: - C24 H26 N2 O2 S2 - Comments: Janković, Nenad; Stefanović, Srđan; Petronijević, Jelena; Joksimović, Nenad; Novaković, Slađana B.; Bogdanović, Goran A.; Muškinja, Jovana; Vraneš, Milan; Ratković, Zoran; Bugarčić, Zorica Water-Tuned Tautomer-Selective Tandem Synthesis of the 5,6-Dihydropyrimidin-4(3H)-ones, Driven under the Umbrella of Sustainable Chemistry ACS Sustainable Chemistry & Engineering 6(10) (2018) 13358 Space group: P 1 21/c 1 Cell volume: 2223.26 Cell parameters: 16.0134; 9.3012; 16.3406; 90; 114.009; 90; |
| COD ID: 4517028 | |
| CIF file | Formula: - C14 H15 Cl N2 O S - Comments: Janković, Nenad; Stefanović, Srđan; Petronijević, Jelena; Joksimović, Nenad; Novaković, Slađana B.; Bogdanović, Goran A.; Muškinja, Jovana; Vraneš, Milan; Ratković, Zoran; Bugarčić, Zorica Water-Tuned Tautomer-Selective Tandem Synthesis of the 5,6-Dihydropyrimidin-4(3H)-ones, Driven under the Umbrella of Sustainable Chemistry ACS Sustainable Chemistry & Engineering 6(10) (2018) 13358 Space group: P -1 Cell volume: 1483.59 Cell parameters: 10.1382; 11.3042; 13.3643; 101.411; 93.392; 97.289; |
| COD ID: 4517029 | |
| CIF file | Formula: - C15 H18 N2 O S2 - Comments: Janković, Nenad; Stefanović, Srđan; Petronijević, Jelena; Joksimović, Nenad; Novaković, Slađana B.; Bogdanović, Goran A.; Muškinja, Jovana; Vraneš, Milan; Ratković, Zoran; Bugarčić, Zorica Water-Tuned Tautomer-Selective Tandem Synthesis of the 5,6-Dihydropyrimidin-4(3H)-ones, Driven under the Umbrella of Sustainable Chemistry ACS Sustainable Chemistry & Engineering 6(10) (2018) 13358 Space group: I 1 2/a 1 Cell volume: 6343.9 Cell parameters: 26.0519; 9.2061; 28.816; 90; 113.376; 90; |
| COD ID: 4517030 | |
| CIF file | Formula: - C19 H26 N2 O3 S - Comments: Janković, Nenad; Stefanović, Srđan; Petronijević, Jelena; Joksimović, Nenad; Novaković, Slađana B.; Bogdanović, Goran A.; Muškinja, Jovana; Vraneš, Milan; Ratković, Zoran; Bugarčić, Zorica Water-Tuned Tautomer-Selective Tandem Synthesis of the 5,6-Dihydropyrimidin-4(3H)-ones, Driven under the Umbrella of Sustainable Chemistry ACS Sustainable Chemistry & Engineering 6(10) (2018) 13358 Space group: P -1 Cell volume: 993.7 Cell parameters: 6.184; 9.994; 16.72; 77.369; 85.008; 80.707; |
| COD ID: 4517031 | |
| CIF file | Formula: - C13 H13 Cl N2 O S - Comments: Janković, Nenad; Stefanović, Srđan; Petronijević, Jelena; Joksimović, Nenad; Novaković, Slađana B.; Bogdanović, Goran A.; Muškinja, Jovana; Vraneš, Milan; Ratković, Zoran; Bugarčić, Zorica Water-Tuned Tautomer-Selective Tandem Synthesis of the 5,6-Dihydropyrimidin-4(3H)-ones, Driven under the Umbrella of Sustainable Chemistry ACS Sustainable Chemistry & Engineering 6(10) (2018) 13358 Space group: P 1 21/c 1 Cell volume: 2701.2 Cell parameters: 24.9132; 10.5411; 10.4984; 90; 101.545; 90; |
| COD ID: 4517032 | |
| CIF file | Formula: - C8 Ce F4 O6 - Comments: D’Amato, Roberto; Donnadio, Anna; Carta, Mariolino; Sangregorio, Claudio; Tiana, Davide; Vivani, Riccardo; Taddei, Marco; Costantino, Ferdinando Water-Based Synthesis and Enhanced CO2 Capture Performance of Perfluorinated Cerium-Based Metal‒Organic Frameworks with UiO-66 and MIL-140 Topology ACS Sustainable Chemistry & Engineering 7(1) (2018) 394 Space group: C 1 2/c 1 Cell volume: 2408.04 Cell parameters: 25.82; 11.60111; 8.0841; 90; 96.0474; 90; |
| COD ID: 4517033 | |
| CIF file | Formula: - C24 Ce3 F12 O16 - Comments: D’Amato, Roberto; Donnadio, Anna; Carta, Mariolino; Sangregorio, Claudio; Tiana, Davide; Vivani, Riccardo; Taddei, Marco; Costantino, Ferdinando Water-Based Synthesis and Enhanced CO2 Capture Performance of Perfluorinated Cerium-Based Metal‒Organic Frameworks with UiO-66 and MIL-140 Topology ACS Sustainable Chemistry & Engineering 7(1) (2018) 394 Space group: F m -3 m Cell volume: 9996.1 Cell parameters: 21.54155; 21.54155; 21.54155; 90; 90; 90; |
| COD ID: 4517140 | |
| CIF file | Formula: - C15 H15 N3 O2 - Comments: Zhang, Lei; Cole, Jacqueline M.; Waddell, Paul G.; Low, Kian S.; Liu, Xiaogang Relating Electron Donor and Carboxylic Acid Anchoring Substitution Effects in Azo Dyes to Dye-Sensitized Solar Cell Performance ACS Sustainable Chemistry & Engineering 1(11) (2013) 1440 Space group: P -1 Cell volume: 662.1 Cell parameters: 8.252; 8.511; 11.23; 92.512; 110.205; 113.719; |
| COD ID: 4517141 | |
| CIF file | Formula: - C17 H19 N3 O2 - Comments: Zhang, Lei; Cole, Jacqueline M.; Waddell, Paul G.; Low, Kian S.; Liu, Xiaogang Relating Electron Donor and Carboxylic Acid Anchoring Substitution Effects in Azo Dyes to Dye-Sensitized Solar Cell Performance ACS Sustainable Chemistry & Engineering 1(11) (2013) 1440 Space group: P 1 21/c 1 Cell volume: 1497.1 Cell parameters: 10.529; 17.052; 8.348; 90; 92.743; 90; |
| COD ID: 4517142 | |
| CIF file | Formula: - C19 H23 N3 O2 - Comments: Zhang, Lei; Cole, Jacqueline M.; Waddell, Paul G.; Low, Kian S.; Liu, Xiaogang Relating Electron Donor and Carboxylic Acid Anchoring Substitution Effects in Azo Dyes to Dye-Sensitized Solar Cell Performance ACS Sustainable Chemistry & Engineering 1(11) (2013) 1440 Space group: P 1 21/n 1 Cell volume: 1722.2 Cell parameters: 10.214; 13.482; 12.661; 90; 98.953; 90; |
| COD ID: 4517143 | |
| CIF file | Formula: - C20 H20 N4 O2 - Comments: Zhang, Lei; Cole, Jacqueline M.; Waddell, Paul G.; Low, Kian S.; Liu, Xiaogang Relating Electron Donor and Carboxylic Acid Anchoring Substitution Effects in Azo Dyes to Dye-Sensitized Solar Cell Performance ACS Sustainable Chemistry & Engineering 1(11) (2013) 1440 Space group: P 1 21/c 1 Cell volume: 1762 Cell parameters: 16.072; 7.325; 14.97; 90; 91.207; 90; |
| COD ID: 4517144 | |
| CIF file | Formula: - C17 H19 N3 O2 - Comments: Zhang, Lei; Cole, Jacqueline M.; Waddell, Paul G.; Low, Kian S.; Liu, Xiaogang Relating Electron Donor and Carboxylic Acid Anchoring Substitution Effects in Azo Dyes to Dye-Sensitized Solar Cell Performance ACS Sustainable Chemistry & Engineering 1(11) (2013) 1440 Space group: P 1 21/c 1 Cell volume: 1538.3 Cell parameters: 12.241; 8.264; 15.473; 90; 100.65; 90; |
| COD ID: 4517145 | |
| CIF file | Formula: - C17 H19 N3 O2 - Comments: Zhang, Lei; Cole, Jacqueline M.; Waddell, Paul G.; Low, Kian S.; Liu, Xiaogang Relating Electron Donor and Carboxylic Acid Anchoring Substitution Effects in Azo Dyes to Dye-Sensitized Solar Cell Performance ACS Sustainable Chemistry & Engineering 1(11) (2013) 1440 Space group: P -1 Cell volume: 1515.4 Cell parameters: 7.921; 14.169; 14.875; 110.092; 103.584; 90.916; |
| COD ID: 4517151 | |
| CIF file | Formula: - C13 H18 O6 - Comments: de la Cruz-Martínez, Felipe; Martínez de Sarasa Buchaca, Marc; Martínez, Javier; Fernández-Baeza, Juan; Sánchez-Barba, Luis F.; Rodríguez-Diéguez, Antonio; Castro-Osma, José A.; Lara-Sánchez, Agustín Synthesis of Bio-Derived Cyclic Carbonates from Renewable Resources ACS Sustainable Chemistry & Engineering (2019) Space group: P 1 21 1 Cell volume: 646.02 Cell parameters: 7.3993; 11.5801; 7.7694; 90; 103.973; 90; |
| COD ID: 4517152 | |
| CIF file | Formula: - C34 H49 Al N6 O - Comments: de la Cruz-Martínez, Felipe; Martínez de Sarasa Buchaca, Marc; Martínez, Javier; Fernández-Baeza, Juan; Sánchez-Barba, Luis F.; Rodríguez-Diéguez, Antonio; Castro-Osma, José A.; Lara-Sánchez, Agustín Synthesis of Bio-Derived Cyclic Carbonates from Renewable Resources ACS Sustainable Chemistry & Engineering (2019) Space group: P -1 Cell volume: 1835.8 Cell parameters: 9.512; 11.725; 17.418; 98.197; 104.309; 97.372; |
| COD ID: 4517153 | |
| CIF file | Formula: - C11 H14 O4 - Comments: de la Cruz-Martínez, Felipe; Martínez de Sarasa Buchaca, Marc; Martínez, Javier; Fernández-Baeza, Juan; Sánchez-Barba, Luis F.; Rodríguez-Diéguez, Antonio; Castro-Osma, José A.; Lara-Sánchez, Agustín Synthesis of Bio-Derived Cyclic Carbonates from Renewable Resources ACS Sustainable Chemistry & Engineering (2019) Space group: P 21 21 21 Cell volume: 1039.9 Cell parameters: 7.743; 5.358; 25.066; 90; 90; 90; |
| COD ID: 4517197 | |
| CIF file | Formula: - C29 H16 Cl2 N2 O6 S - Comments: Mukherjee, Sayan; Pramanik, Animesh Catalyst-Free One-Pot Three-Component Synthesis of 4-Hydroxy-3-pyrazolylcoumarins in Ethanol at Room Temperature: Enolisable Aroylhydrazones as Efficient Ambident Nucleophile ACS Sustainable Chemistry & Engineering (2019) Space group: C 1 2/c 1 Cell volume: 5830 Cell parameters: 32.917; 10.637; 22.889; 90; 133.331; 90; |
| COD ID: 4517198 | |
| CIF file | Formula: - C30 H20 N2 O4 S - Comments: Mukherjee, Sayan; Pramanik, Animesh Catalyst-Free One-Pot Three-Component Synthesis of 4-Hydroxy-3-pyrazolylcoumarins in Ethanol at Room Temperature: Enolisable Aroylhydrazones as Efficient Ambident Nucleophile ACS Sustainable Chemistry & Engineering (2019) Space group: P -1 Cell volume: 2582 Cell parameters: 10.124; 10.747; 23.73; 90.35; 90.15; 90.37; |
| COD ID: 4517485 | |
| CIF file | Formula: - C62 H44 Co N4 O6 - Comments: Xu, Dandan; Wu, Shijie; Xu, Xinxin; Wang, Qiang Hybrid Zn Battery with Coordination-Polymer-Derived, Oxygen-Vacancy-Rich Co3O4 as a Cathode Material ACS Sustainable Chemistry & Engineering (2020) Space group: C 1 2/c 1 Cell volume: 4853.8 Cell parameters: 13.8158; 18.9639; 18.5497; 90; 92.904; 90; |
| COD ID: 4517486 | |
| CIF file | Formula: - C16 H16 Cl Cu12 Mo12 N24 O47 P V3 - Comments: Yang, Xiya; Sha, Jingquan; Li, Wenjing; Tan, Zenglong; Hou, Liran; Jiang, Jianzhuang Ternary Cross-Vanadium Tetra-Capped POMOFs@PPy/RGO Nanocomposites with Hybrid Battery-Supercapacitor Behavior for Enhancing Lithium Battery Storage ACS Sustainable Chemistry & Engineering 8(11) (2020) 4667-4675 Space group: C 1 2/m 1 Cell volume: 3139.6 Cell parameters: 17.261; 14.564; 14.563; 90; 120.954; 90; |
| COD ID: 4517487 | |
| CIF file | Formula: - C16 H16 Cl Cu12 Mo12 N24 O42 P V2 - Comments: Yang, Xiya; Sha, Jingquan; Li, Wenjing; Tan, Zenglong; Hou, Liran; Jiang, Jianzhuang Ternary Cross-Vanadium Tetra-Capped POMOFs@PPy/RGO Nanocomposites with Hybrid Battery-Supercapacitor Behavior for Enhancing Lithium Battery Storage ACS Sustainable Chemistry & Engineering 8(11) (2020) 4667-4675 Space group: P 41 21 2 Cell volume: 6294 Cell parameters: 14.5374; 14.5374; 29.782; 90; 90; 90; |
| COD ID: 4517756 | |
| CIF file | Formula: - C18 H20 O6 - Comments: Wang, Zhihan; Scheuring, Mark; Mabin, Micah; Shahni, Rahul; Wang, Zijun D.; Ugrinov, Angel; Butz, Jonathan; Chu, Qianli R. Renewable Cyclobutane-1,3-dicarboxylic Acid (CBDA) Building Block Synthesized from Furfural via Photocyclization ACS Sustainable Chemistry & Engineering (2020) Space group: P 1 21/c 1 Cell volume: 1670.76 Cell parameters: 9.7398; 8.1494; 21.0519; 90; 90.893; 90; |
| COD ID: 4517757 | |
| CIF file | Formula: - C14 H12 O6 - Comments: Wang, Zhihan; Scheuring, Mark; Mabin, Micah; Shahni, Rahul; Wang, Zijun D.; Ugrinov, Angel; Butz, Jonathan; Chu, Qianli R. Renewable Cyclobutane-1,3-dicarboxylic Acid (CBDA) Building Block Synthesized from Furfural via Photocyclization ACS Sustainable Chemistry & Engineering (2020) Space group: P -1 Cell volume: 627.27 Cell parameters: 8.2085; 8.3297; 10.3384; 73.144; 68.207; 86.546; |
| COD ID: 4517768 | |
| CIF file | Formula: - C30 H45 Br N2 O2 - Comments: Pernak, Juliusz; Rzemieniecki, Tomasz; Klejdysz, Tomasz; Qu, Fengrui; Rogers, Robin D. Conversion of Quinine Derivatives into Biologically Active Ionic Liquids: Advantages, Multifunctionality, and Perspectives ACS Sustainable Chemistry & Engineering 8(25) (2020) 9263-9267 Space group: P 21 21 21 Cell volume: 2747.7 Cell parameters: 8.50945; 11.48583; 28.11292; 90; 90; 90; |
| COD ID: 4517769 | |
| CIF file | Formula: - C25 H37 Br N2 O3 - Comments: Pernak, Juliusz; Rzemieniecki, Tomasz; Klejdysz, Tomasz; Qu, Fengrui; Rogers, Robin D. Conversion of Quinine Derivatives into Biologically Active Ionic Liquids: Advantages, Multifunctionality, and Perspectives ACS Sustainable Chemistry & Engineering 8(25) (2020) 9263-9267 Space group: P 21 21 21 Cell volume: 2503.45 Cell parameters: 8.25467; 13.60583; 22.29025; 90; 90; 90; |
| COD ID: 4517960 | |
| CIF file | Formula: - C20 H18 N2 - Comments: Kumar, Inder; Gupta, Shiv Shankar; Kumar, Rakesh; Kumar, Rohit; Agrawal, Prakhar; Sahal, Dinkar; Sharma, Upendra Photocatalytic Unsymmetrical Coupling of 2-Substituted Quinolines: Synthesis and Evaluation of the Antiplasmodial Potential of β-Norbenzomorphan Frameworks ACS Sustainable Chemistry & Engineering (2020) Space group: P -1 Cell volume: 759.44 Cell parameters: 7.6889; 9.7991; 11.4575; 98.579; 100.505; 112.749; |
| COD ID: 4517985 | |
| CIF file | Formula: - C20 H22 O3 - Comments: d’Agostino, Simone; Azzali, Alessandra; Casali, Lucia; Taddei, Paola; Grepioni, Fabrizia Environmentally Friendly Sunscreens: Mechanochemical Synthesis and Characterization of β-CD Inclusion Complexes of Avobenzone and Octinoxate with Improved Photostability ACS Sustainable Chemistry & Engineering (2020) Space group: P b c a Cell volume: 3545.1 Cell parameters: 7.3175; 11.8808; 40.778; 90; 90; 90; |
| COD ID: 4518049 | |
| CIF file | Formula: - C32 H56 Cl8 N8 Pt2 S4 - Comments: Wang, Qi; Wang, Ning; Liu, Wenhui; Yan, Yan; Su, Hongmei; Wang, Min; Zhang, Guanju; Yang, Yanzhao ESP‒ALIE Analysis as a Theoretical Tool for Identifying the Coordination Atoms of Possible Multisite Extractants: Validation and Prediction ACS Sustainable Chemistry & Engineering 8(38) (2020) 14353-14364 Space group: P 1 21/c 1 Cell volume: 2451.98 Cell parameters: 15.7093; 11.6599; 14.4112; 90; 111.737; 90; |
| COD ID: 4518067 | |
| CIF file | Formula: - C91 H140 Cl2 N8 Nd2 O6 - Comments: Cole, Bren E.; Cheisson, Thibault; Nelson, Joshua J. M.; Higgins, Robert F.; Gau, Michael R.; Carroll, Patrick J.; Schelter, Eric J. Understanding Molecular Factors That Determine Performance in the Rare Earth (TriNOx) Separations System ACS Sustainable Chemistry & Engineering (2020) Space group: P -1 Cell volume: 4752.9 Cell parameters: 15.1068; 15.5306; 23.406; 81.311; 86.361; 61.117; |
| COD ID: 4518068 | |
| CIF file | Formula: - C48.75 H72.75 Cl11.25 Dy N4 O3 - Comments: Cole, Bren E.; Cheisson, Thibault; Nelson, Joshua J. M.; Higgins, Robert F.; Gau, Michael R.; Carroll, Patrick J.; Schelter, Eric J. Understanding Molecular Factors That Determine Performance in the Rare Earth (TriNOx) Separations System ACS Sustainable Chemistry & Engineering (2020) Space group: P 1 21/c 1 Cell volume: 6198.2 Cell parameters: 11.4186; 19.3718; 28.121; 90; 94.83; 90; |
| COD ID: 4518069 | |
| CIF file | Formula: - C44 H66 N4 Nd O3 - Comments: Cole, Bren E.; Cheisson, Thibault; Nelson, Joshua J. M.; Higgins, Robert F.; Gau, Michael R.; Carroll, Patrick J.; Schelter, Eric J. Understanding Molecular Factors That Determine Performance in the Rare Earth (TriNOx) Separations System ACS Sustainable Chemistry & Engineering (2020) Space group: P n m a Cell volume: 4396.1 Cell parameters: 37.0064; 16.7595; 7.0881; 90; 90; 90; |
| COD ID: 4518070 | |
| CIF file | Formula: - C39 H30 Br3 N - Comments: Cole, Bren E.; Cheisson, Thibault; Nelson, Joshua J. M.; Higgins, Robert F.; Gau, Michael R.; Carroll, Patrick J.; Schelter, Eric J. Understanding Molecular Factors That Determine Performance in the Rare Earth (TriNOx) Separations System ACS Sustainable Chemistry & Engineering (2020) Space group: P -1 Cell volume: 1558.6 Cell parameters: 9.3851; 11.778; 14.503; 102.267; 92.88; 94.271; |
| COD ID: 4518071 | |
| CIF file | Formula: - C45 H72 N4 O3 - Comments: Cole, Bren E.; Cheisson, Thibault; Nelson, Joshua J. M.; Higgins, Robert F.; Gau, Michael R.; Carroll, Patrick J.; Schelter, Eric J. Understanding Molecular Factors That Determine Performance in the Rare Earth (TriNOx) Separations System ACS Sustainable Chemistry & Engineering (2020) Space group: P 1 21/n 1 Cell volume: 4366.5 Cell parameters: 24.47; 7.2574; 24.738; 90; 96.321; 90; |
| COD ID: 4518072 | |
| CIF file | Formula: - C24 H15 Br3 F9 N - Comments: Cole, Bren E.; Cheisson, Thibault; Nelson, Joshua J. M.; Higgins, Robert F.; Gau, Michael R.; Carroll, Patrick J.; Schelter, Eric J. Understanding Molecular Factors That Determine Performance in the Rare Earth (TriNOx) Separations System ACS Sustainable Chemistry & Engineering (2020) Space group: P -1 Cell volume: 1289.72 Cell parameters: 8.7367; 10.4571; 15.233; 73.626; 80.35; 76.316; |
| COD ID: 4518073 | |
| CIF file | Formula: - C57 H69 N7 O3 - Comments: Cole, Bren E.; Cheisson, Thibault; Nelson, Joshua J. M.; Higgins, Robert F.; Gau, Michael R.; Carroll, Patrick J.; Schelter, Eric J. Understanding Molecular Factors That Determine Performance in the Rare Earth (TriNOx) Separations System ACS Sustainable Chemistry & Engineering (2020) Space group: P -1 Cell volume: 2597.7 Cell parameters: 13.7629; 13.7728; 15.5782; 66.403; 77.303; 75.695; |
| COD ID: 4518074 | |
| CIF file | Formula: - C40 H50 Dy F9 N4 O4 - Comments: Cole, Bren E.; Cheisson, Thibault; Nelson, Joshua J. M.; Higgins, Robert F.; Gau, Michael R.; Carroll, Patrick J.; Schelter, Eric J. Understanding Molecular Factors That Determine Performance in the Rare Earth (TriNOx) Separations System ACS Sustainable Chemistry & Engineering (2020) Space group: P 3 1 c Cell volume: 2234.4 Cell parameters: 14.5635; 14.5635; 12.1646; 90; 90; 120; |
| COD ID: 4518075 | |
| CIF file | Formula: - C36 H45 F9 N4 O3 - Comments: Cole, Bren E.; Cheisson, Thibault; Nelson, Joshua J. M.; Higgins, Robert F.; Gau, Michael R.; Carroll, Patrick J.; Schelter, Eric J. Understanding Molecular Factors That Determine Performance in the Rare Earth (TriNOx) Separations System ACS Sustainable Chemistry & Engineering (2020) Space group: R -3 c :H Cell volume: 11374 Cell parameters: 15.494; 15.494; 54.709; 90; 90; 120; |
| COD ID: 4518076 | |
| CIF file | Formula: - C63.25 H82 N4 Nd O5.75 - Comments: Cole, Bren E.; Cheisson, Thibault; Nelson, Joshua J. M.; Higgins, Robert F.; Gau, Michael R.; Carroll, Patrick J.; Schelter, Eric J. Understanding Molecular Factors That Determine Performance in the Rare Earth (TriNOx) Separations System ACS Sustainable Chemistry & Engineering (2020) Space group: P -1 Cell volume: 2908.1 Cell parameters: 9.8699; 14.7597; 22.1202; 103.709; 100.401; 105.739; |
| COD ID: 4518077 | |
| CIF file | Formula: - C40 H50 F9 N4 Nd O4 - Comments: Cole, Bren E.; Cheisson, Thibault; Nelson, Joshua J. M.; Higgins, Robert F.; Gau, Michael R.; Carroll, Patrick J.; Schelter, Eric J. Understanding Molecular Factors That Determine Performance in the Rare Earth (TriNOx) Separations System ACS Sustainable Chemistry & Engineering (2020) Space group: P 3 1 c Cell volume: 2235.2 Cell parameters: 14.5759; 14.5759; 12.1484; 90; 90; 120; |
| COD ID: 4518123 | |
| CIF file | Formula: - C48 H60 Cu2 N30 O46 Si W12 - Comments: Wang, Xiu-Li; Tian, Yuan; Chang, Zhi-Han; Lin, Hongyan A Series of Polyoxometalate-Based Metal‒Bis(pyridyl-tetrazole) Complexes with High Electrocatalytic Activity for Hydrogen Evolution Reaction in Alkaline and Acid Media ACS Sustainable Chemistry & Engineering (2020) Space group: P -1 Cell volume: 2261.7 Cell parameters: 12.2209; 14.4974; 14.8694; 111.642; 103.266; 101.58; |
| COD ID: 4518124 | |
| CIF file | Formula: - C34 H60 Cu2 N20 O52 Si W12 - Comments: Wang, Xiu-Li; Tian, Yuan; Chang, Zhi-Han; Lin, Hongyan A Series of Polyoxometalate-Based Metal‒Bis(pyridyl-tetrazole) Complexes with High Electrocatalytic Activity for Hydrogen Evolution Reaction in Alkaline and Acid Media ACS Sustainable Chemistry & Engineering (2020) Space group: P -1 Cell volume: 1895.4 Cell parameters: 12.2804; 12.5014; 14.7202; 67.243; 66.628; 87.759; |
| COD ID: 4518125 | |
| CIF file | Formula: - C54 H72 Cu2 N30 O46 Si W12 - Comments: Wang, Xiu-Li; Tian, Yuan; Chang, Zhi-Han; Lin, Hongyan A Series of Polyoxometalate-Based Metal‒Bis(pyridyl-tetrazole) Complexes with High Electrocatalytic Activity for Hydrogen Evolution Reaction in Alkaline and Acid Media ACS Sustainable Chemistry & Engineering (2020) Space group: P -1 Cell volume: 2386.4 Cell parameters: 12.358; 13.96; 15.641; 110.467; 104.354; 96.738; |
| COD ID: 4518408 | |
| CIF file | Formula: - C164 H312 N16 O19 Zn8 - Comments: Krupiński, Piotr; Grala, Agnieszka; Wolska-Pietkiewicz, Małgorzata; Danowski, Wojciech; Justyniak, Iwona; Lewiński, Janusz From Uncommon Ethylzinc Complexes Supported by Ureate Ligands to Water-Soluble ZnO Nanocrystals: A Mechanochemical Approach ACS Sustainable Chemistry & Engineering 9(4) (2021) 1540-1549 Space group: P 1 21/c 1 Cell volume: 9029.1 Cell parameters: 17.095; 14.339; 38.364; 90; 106.233; 90; |
| COD ID: 4518427 | |
| CIF file | Formula: - C12 H11 Au Cl4 N2 O4 - Comments: Nag, Abhijit; Islam, Md Rabiul; Pradeep, Thalappil Selective Extraction of Gold by Niacin ACS Sustainable Chemistry & Engineering (2021) Space group: P 1 21/n 1 Cell volume: 843.2 Cell parameters: 7.2567; 10.516; 11.444; 90; 105.095; 90; |
| COD ID: 4518428 | |
| CIF file | Formula: - C12 H16 Co Cu N2 O8 - Comments: Nag, Abhijit; Islam, Md Rabiul; Pradeep, Thalappil Selective Extraction of Gold by Niacin ACS Sustainable Chemistry & Engineering (2021) Space group: P -1 Cell volume: 347.9 Cell parameters: 6.997; 7.1062; 8.7084; 68.407; 68.867; 62.662; |
| COD ID: 4518484 | |
| CIF file | Formula: - C26 H45 N8 O30 Zn3.5 - Comments: Li, Yixing; Zhang, Xiao; Lan, Jianwen; Li, Dazhi; Wang, Zhijiang; Xu, Ping; Sun, Jianmin A High-Performance Zinc-Organic Framework with Accessible Open Metal Sites Catalyzes CO2 and Styrene Oxide into Styrene Carbonate under Mild Conditions ACS Sustainable Chemistry & Engineering 9(7) (2021) 2795-2803 Space group: P -1 Cell volume: 1010.7 Cell parameters: 7.272; 11.453; 12.792; 105.317; 97.72; 94.62; |
| COD ID: 4518547 | |
| CIF file | Formula: - C20 H27 N O2 - Comments: Zhou, Kun; Hao, Hong-Yan; Mao, Yang-Jie; Wu, Qiu-Zi; Chen, Lei; Wang, Shuang; Jin, Wu; Xu, Zhen-Yuan; Lou, Shao-Jie; Xu, Dan-Qian Solvent-less Dehydrogenative C‒H Etherification with Alcohols Using Mechanochemistry ACS Sustainable Chemistry & Engineering 9(12) (2021) 4433-4439 Space group: P -1 Cell volume: 847.74 Cell parameters: 7.9105; 10.1433; 12.1778; 68.787; 73.015; 71.871; |
| COD ID: 4518570 | |
| CIF file | Formula: - C14 H14 N4 O6 V2 Zn - Comments: Tian, Hongrui; Liu, Shumei; Zhang, Zhong; Dang, Tianyi; Lu, Ying; Liu, Shuxia Highly Stable Polyoxovanadate-Based Zn‒MOF with Dual Active Sites as a Solvent-free Catalyst for C‒C Bond Formation ACS Sustainable Chemistry & Engineering 9(12) (2021) 4660-4667 Space group: P 1 21/c 1 Cell volume: 1796.5 Cell parameters: 8.0272; 10.3866; 21.6398; 90; 95.314; 90; |
| COD ID: 4518575 | |
| CIF file | Formula: - C192 H192 Cl8 N24 O8 Ru8 - Comments: Ghosh, Rahul; Jana, Narayan Ch.; Panda, Surajit; Bagh, Bidraha Transfer Hydrogenation of Aldehydes and Ketones in Air with Methanol and Ethanol by an Air-Stable Ruthenium‒Triazole Complex ACS Sustainable Chemistry & Engineering (2021) Space group: P 1 21/c 1 Cell volume: 4915.1 Cell parameters: 22.8691; 11.8858; 19.9571; 90; 115.033; 90; |
| COD ID: 4518716 | |
| CIF file | Formula: - C12 H8 Br N O2 S2 - Comments: Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides ACS Sustainable Chemistry & Engineering 9(20) (2021) 7171-7178 Space group: P -1 Cell volume: 653.76 Cell parameters: 7.3124; 8.0674; 11.1844; 90.429; 96.849; 93.54; |
| COD ID: 4518717 | |
| CIF file | Formula: - C12 H8 Br N O2 S2 - Comments: Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides ACS Sustainable Chemistry & Engineering 9(20) (2021) 7171-7178 Space group: P -1 Cell volume: 666.8 Cell parameters: 7.5012; 7.6684; 12.37; 77.306; 82.115; 74.588; |
| COD ID: 4518718 | |
| CIF file | Formula: - C12 H8 Cl N O2 S2 - Comments: Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides ACS Sustainable Chemistry & Engineering 9(20) (2021) 7171-7178 Space group: P -1 Cell volume: 653.34 Cell parameters: 7.4862; 7.6173; 12.26; 77.313; 81.768; 74.085; |
| COD ID: 4518719 | |
| CIF file | Formula: - C13 H11 N O2 S2 - Comments: Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides ACS Sustainable Chemistry & Engineering 9(20) (2021) 7171-7178 Space group: P 1 21/c 1 Cell volume: 1287.4 Cell parameters: 6.637; 24.4347; 7.9539; 90; 93.577; 90; |
| COD ID: 4518720 | |
| CIF file | Formula: - C13 H9 Cl O2 S2 - Comments: Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides ACS Sustainable Chemistry & Engineering 9(20) (2021) 7171-7178 Space group: P 1 21/c 1 Cell volume: 1308 Cell parameters: 5.4415; 7.9266; 30.427; 90; 94.695; 90; |
| COD ID: 4518721 | |
| CIF file | Formula: - C13 H9 Br O2 S2 - Comments: Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides ACS Sustainable Chemistry & Engineering 9(20) (2021) 7171-7178 Space group: P 1 21/c 1 Cell volume: 1329.75 Cell parameters: 5.4811; 7.9282; 30.7236; 90; 95.134; 90; |
| COD ID: 4518722 | |
| CIF file | Formula: - C14 H14 O2 S2 - Comments: Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides ACS Sustainable Chemistry & Engineering 9(20) (2021) 7171-7178 Space group: P 21 21 21 Cell volume: 1371.99 Cell parameters: 5.9037; 12.98; 17.9041; 90; 90; 90; |
| COD ID: 4518723 | |
| CIF file | Formula: - C12 H8 F2 S2 - Comments: Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides ACS Sustainable Chemistry & Engineering 9(20) (2021) 7171-7178 Space group: P 21 21 21 Cell volume: 1086.36 Cell parameters: 5.7416; 13.0516; 14.497; 90; 90; 90; |
| COD ID: 4518724 | |
| CIF file | Formula: - C12 H8 Br2 S2 - Comments: Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides ACS Sustainable Chemistry & Engineering 9(20) (2021) 7171-7178 Space group: C c c 2 Cell volume: 1289.8 Cell parameters: 7.7242; 28.033; 5.9565; 90; 90; 90; |
| COD ID: 4519018 | |
| CIF file | Formula: - C19 H15 F N O2 P - Comments: Huke, Cameron D.; Taylor, Laurence J.; Argent, Stephen P.; Kays, Deborah L. Catalyst-free Hydrophosphinylation of Isocyanates and Isothiocyanates under Low-Added-Solvent Conditions ACS Sustainable Chemistry & Engineering 9(32) (2021) 10704-10709 Space group: P -1 Cell volume: 800.24 Cell parameters: 8.6254; 8.9016; 10.8499; 80.225; 85.954; 77.248; |
| COD ID: 4519019 | |
| CIF file | Formula: - C21 H20 N O4 P - Comments: Huke, Cameron D.; Taylor, Laurence J.; Argent, Stephen P.; Kays, Deborah L. Catalyst-free Hydrophosphinylation of Isocyanates and Isothiocyanates under Low-Added-Solvent Conditions ACS Sustainable Chemistry & Engineering 9(32) (2021) 10704-10709 Space group: P -1 Cell volume: 1886.37 Cell parameters: 11.1796; 12.4375; 14.5087; 102.974; 93.417; 104.758; |
| COD ID: 4519020 | |
| CIF file | Formula: - C15 H16 N O2 P - Comments: Huke, Cameron D.; Taylor, Laurence J.; Argent, Stephen P.; Kays, Deborah L. Catalyst-free Hydrophosphinylation of Isocyanates and Isothiocyanates under Low-Added-Solvent Conditions ACS Sustainable Chemistry & Engineering 9(32) (2021) 10704-10709 Space group: P -1 Cell volume: 1398.88 Cell parameters: 8.7838; 8.7951; 20.4442; 90.45; 93.891; 117.301; |
| COD ID: 4519021 | |
| CIF file | Formula: - C16 H18 N O2 P - Comments: Huke, Cameron D.; Taylor, Laurence J.; Argent, Stephen P.; Kays, Deborah L. Catalyst-free Hydrophosphinylation of Isocyanates and Isothiocyanates under Low-Added-Solvent Conditions ACS Sustainable Chemistry & Engineering 9(32) (2021) 10704-10709 Space group: P -1 Cell volume: 2961.45 Cell parameters: 13.2516; 14.607; 17.427; 108.164; 109.21; 94.747; |
| COD ID: 4519022 | |
| CIF file | Formula: - C47.01 H44.01 N2 O4 P2 - Comments: Huke, Cameron D.; Taylor, Laurence J.; Argent, Stephen P.; Kays, Deborah L. Catalyst-free Hydrophosphinylation of Isocyanates and Isothiocyanates under Low-Added-Solvent Conditions ACS Sustainable Chemistry & Engineering 9(32) (2021) 10704-10709 Space group: P -1 Cell volume: 1002.41 Cell parameters: 8.7408; 10.399; 11.263; 82.043; 85.124; 82.282; |
| COD ID: 4519023 | |
| CIF file | Formula: - C18 H16 N O3 P - Comments: Huke, Cameron D.; Taylor, Laurence J.; Argent, Stephen P.; Kays, Deborah L. Catalyst-free Hydrophosphinylation of Isocyanates and Isothiocyanates under Low-Added-Solvent Conditions ACS Sustainable Chemistry & Engineering 9(32) (2021) 10704-10709 Space group: P -1 Cell volume: 1571.67 Cell parameters: 8.4872; 11.6741; 16.8354; 108.405; 96.291; 90.405; |
| COD ID: 4519024 | |
| CIF file | Formula: - C19 H15 Cl N O P S - Comments: Huke, Cameron D.; Taylor, Laurence J.; Argent, Stephen P.; Kays, Deborah L. Catalyst-free Hydrophosphinylation of Isocyanates and Isothiocyanates under Low-Added-Solvent Conditions ACS Sustainable Chemistry & Engineering 9(32) (2021) 10704-10709 Space group: P 1 21/n 1 Cell volume: 1754.48 Cell parameters: 12.1934; 10.7695; 13.8808; 90; 105.735; 90; |
| COD ID: 4519025 | |
| CIF file | Formula: - C20 H18 N O2 P S - Comments: Huke, Cameron D.; Taylor, Laurence J.; Argent, Stephen P.; Kays, Deborah L. Catalyst-free Hydrophosphinylation of Isocyanates and Isothiocyanates under Low-Added-Solvent Conditions ACS Sustainable Chemistry & Engineering 9(32) (2021) 10704-10709 Space group: P 1 21/n 1 Cell volume: 1769.8 Cell parameters: 12.1983; 10.781; 13.9142; 90; 104.72; 90; |
| COD ID: 4519026 | |
| CIF file | Formula: - C19 H15 N2 O3 P S - Comments: Huke, Cameron D.; Taylor, Laurence J.; Argent, Stephen P.; Kays, Deborah L. Catalyst-free Hydrophosphinylation of Isocyanates and Isothiocyanates under Low-Added-Solvent Conditions ACS Sustainable Chemistry & Engineering 9(32) (2021) 10704-10709 Space group: C 1 2/c 1 Cell volume: 3535.47 Cell parameters: 18.8671; 11.7269; 16.0554; 90; 95.579; 90; |
| COD ID: 4519027 | |
| CIF file | Formula: - C16 H16 N O P S - Comments: Huke, Cameron D.; Taylor, Laurence J.; Argent, Stephen P.; Kays, Deborah L. Catalyst-free Hydrophosphinylation of Isocyanates and Isothiocyanates under Low-Added-Solvent Conditions ACS Sustainable Chemistry & Engineering 9(32) (2021) 10704-10709 Space group: P 1 21/c 1 Cell volume: 1506.31 Cell parameters: 9.0779; 16.1069; 10.5344; 90; 102.06; 90; |
| COD ID: 4519080 | |
| CIF file | Formula: - C18 H33 B F4 N2 O2 - Comments: del Río, Enrique; Vidil, Thomas; Gati, Wafa; Grau, Étienne; Taton, Daniel; Cramail, Henri Ester-Containing Imidazolium-Type Ionic Liquid Crystals Derived from Bio-based Fatty Alcohols ACS Sustainable Chemistry & Engineering 9(37) (2021) 12687-12698 Space group: P 1 21/c 1 Cell volume: 2125.7 Cell parameters: 17.223; 8.252; 15.149; 90; 99.137; 90; |
| COD ID: 4519192 | |
| CIF file | Formula: - C40 H70 Mo24 N8 O96 P2 Zn8 - Comments: Chen, Yanhong; Chang, Shenzhen; An, Haiyan; Li, Yanqin; Zhu, Qingshan; Luo, Huiyun; Huang, Yaohui Two Polymorphic Polyoxometalate-Based Metal–Organic Frameworks for the Efficient Synthesis of Functionalized Sulfoxides and Detoxification of Mustard Gas Simulants ACS Sustainable Chemistry & Engineering 9(46) (2021) 15683-15693 Space group: P 1 2/c 1 Cell volume: 2760.1 Cell parameters: 12.4443; 12.4258; 18.7974; 90; 108.271; 90; |
| COD ID: 4519193 | |
| CIF file | Formula: - C40 H70 Mo24 N8 O96 P2 Zn8 - Comments: Chen, Yanhong; Chang, Shenzhen; An, Haiyan; Li, Yanqin; Zhu, Qingshan; Luo, Huiyun; Huang, Yaohui Two Polymorphic Polyoxometalate-Based Metal–Organic Frameworks for the Efficient Synthesis of Functionalized Sulfoxides and Detoxification of Mustard Gas Simulants ACS Sustainable Chemistry & Engineering 9(46) (2021) 15683-15693 Space group: P 1 2/n 1 Cell volume: 2721.1 Cell parameters: 12.398; 12.41; 18.721; 90; 109.145; 90; |
| COD ID: 4519267 | |
| CIF file | Formula: - C22 H15 Cl N2 O - Comments: Cai, Chen; Lu, Yi; Yuan, Chengcheng; Fang, Zheng; Yang, Xiaobing; Liu, Chengkou; Guo, Kai Organocatalytic Electrosynthesis of Cinnolines through Cascade Radical Cyclization and Migration ACS Sustainable Chemistry & Engineering 9(50) (2021) 16989-16996 Space group: C 1 2/c 1 Cell volume: 3439.25 Cell parameters: 31.3976; 6.9692; 19.2078; 90; 125.086; 90; |
| COD ID: 4519268 | |
| CIF file | Formula: - C19 H20 F2 N2 O - Comments: Niu, Kaikai; Zhou, Pan; Ding, Ling; Hao, Yanke; Liu, Yuxiu; Song, Hongjian; Wang, Qingmin Photoelectrochemical Decarboxylative C–H Alkylation of Quinoxalin-2(1H)-ones ACS Sustainable Chemistry & Engineering 9(49) (2021) 16820-16828 Space group: P 1 21/c 1 Cell volume: 1555.04 Cell parameters: 11.1841; 11.7671; 12.2739; 90; 105.7; 90; |
| COD ID: 4519426 | |
| CIF file | Formula: - C25 H15 N O4 - Comments: Cai, Chen; Lu, Yi; Yuan, Chengcheng; Fang, Zheng; Yang, Xiaobing; Liu, Chengkou; Guo, Kai Metal-Free C–C Cross Coupling: Electrosynthesis of Azaheterocycles through Anodic Oxidation Cyclization of 1,6-Enynes ACS Sustainable Chemistry & Engineering 10(10) (2022) 3288-3294 Space group: P -1 Cell volume: 896.1 Cell parameters: 8.6432; 11.0448; 11.1069; 62.407; 72.632; 84.054; |
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