Crystallography Open Database

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7208130 CIFC18 H14 Ag N5 O5P 1 21/n 112.142; 10.509; 13.907
90; 106.101; 90
1704.9Sheykhan, Mehdi; Rashidi Ranjbar, Zohreh; Morsali, Ali; Heydari, Akbar
Minimisation of E-Factor in the synthesis of N-hydroxylamines: the role of silver(i)-based coordination polymers
Green Chemistry, 2012, 14, 1971
7208131 CIFC21 H18 F3 N O4P 1 21/c 113.6247; 8.6852; 17.0833
90; 112.949; 90
1861.5Reddy, T. Ram; Reddy, L. Srinivasula; Reddy, G. Rajeshwar; Yarbagi, Kaviraj; Lingappa, Y.; Rambabu, D.; Krishna, G. Rama; Reddy, C. Malla; Kumar, K. Shiva; Pal, Manojit
Construction of a quinoline ring via a 3-component reaction in water: crystal structure analysis and H-bonding patterns of a 2-aryl quinoline
Green Chemistry, 2012, 14, 1870
7208410 CIFC34 H28 Cl6 N2 O5P -111.373; 11.8524; 13.975
95.484; 112.666; 91.976
1725.1Khurana, Jitender M.; Chaudhary, Ankita; Lumb, Anshika; Nand, Bhaskara
An expedient four-component domino protocol for the synthesis of novel benzo[a]phenazine annulated heterocycles and their photophysical studies
Green Chemistry, 2012, 14, 2321
7208597 CIFC15 H13 N2 SI 4114.933; 14.933; 12.2771
90; 90; 90
2737.7Rout, Saroj Kumar; Guin, Srimanta; Nath, Jayashree; Patel, Bhisma K.
An “on-water” exploration of CuO nanoparticle catalysed synthesis of 2-aminobenzothiazoles
Green Chemistry, 2012, 14, 2491
7208598 CIFC11 H12 N2 S2P 1 21/c 110.13; 8.1511; 13.6
90; 93.902; 90
1120.4Rout, Saroj Kumar; Guin, Srimanta; Nath, Jayashree; Patel, Bhisma K.
An “on-water” exploration of CuO nanoparticle catalysed synthesis of 2-aminobenzothiazoles
Green Chemistry, 2012, 14, 2491
7208599 CIFC13 H18 N2 O SC 1 c 110.493; 14.6391; 9.0779
90; 113.021; 90
1283.39Štrukil, Vjekoslav; Igrc, Marina D.; Fábián, László; Eckert-Maksić, Mirjana; Childs, Scott L.; Reid, David G.; Duer, Melinda J.; Halasz, Ivan; Mottillo, Cristina; Friščić, Tomislav
A model for a solvent-free synthetic organic research laboratory: click-mechanosynthesis and structural characterization of thioureas without bulk solvents
Green Chemistry, 2012, 14, 2462
7208600 CIFC11 H14 N2 S2P 1 21/c 111.5813; 9.3856; 10.8926
90; 101.21; 90
1161.41Štrukil, Vjekoslav; Igrc, Marina D.; Fábián, László; Eckert-Maksić, Mirjana; Childs, Scott L.; Reid, David G.; Duer, Melinda J.; Halasz, Ivan; Mottillo, Cristina; Friščić, Tomislav
A model for a solvent-free synthetic organic research laboratory: click-mechanosynthesis and structural characterization of thioureas without bulk solvents
Green Chemistry, 2012, 14, 2462
7208601 CIFC13 H10 F2 N2 SP n m a8.3457; 26.4224; 5.3071
90; 90; 90
1170.29Štrukil, Vjekoslav; Igrc, Marina D.; Fábián, László; Eckert-Maksić, Mirjana; Childs, Scott L.; Reid, David G.; Duer, Melinda J.; Halasz, Ivan; Mottillo, Cristina; Friščić, Tomislav
A model for a solvent-free synthetic organic research laboratory: click-mechanosynthesis and structural characterization of thioureas without bulk solvents
Green Chemistry, 2012, 14, 2462
7208602 CIFC11 H13 N3 O3 SP 1 21/n 110.2252; 10.5172; 11.1949
90; 90.788; 90
1203.79Štrukil, Vjekoslav; Igrc, Marina D.; Fábián, László; Eckert-Maksić, Mirjana; Childs, Scott L.; Reid, David G.; Duer, Melinda J.; Halasz, Ivan; Mottillo, Cristina; Friščić, Tomislav
A model for a solvent-free synthetic organic research laboratory: click-mechanosynthesis and structural characterization of thioureas without bulk solvents
Green Chemistry, 2012, 14, 2462
7208603 CIFC11 H13 N3 O3 SP c a 2121.2213; 8.0908; 28.6471
90; 90; 90
4918.6Štrukil, Vjekoslav; Igrc, Marina D.; Fábián, László; Eckert-Maksić, Mirjana; Childs, Scott L.; Reid, David G.; Duer, Melinda J.; Halasz, Ivan; Mottillo, Cristina; Friščić, Tomislav
A model for a solvent-free synthetic organic research laboratory: click-mechanosynthesis and structural characterization of thioureas without bulk solvents
Green Chemistry, 2012, 14, 2462
7208604 CIFC15 H16 N2 SP 1 21/n 112.67213; 9.79731; 12.10093
90; 115.223; 90
1359.12Štrukil, Vjekoslav; Igrc, Marina D.; Fábián, László; Eckert-Maksić, Mirjana; Childs, Scott L.; Reid, David G.; Duer, Melinda J.; Halasz, Ivan; Mottillo, Cristina; Friščić, Tomislav
A model for a solvent-free synthetic organic research laboratory: click-mechanosynthesis and structural characterization of thioureas without bulk solvents
Green Chemistry, 2012, 14, 2462
7208605 CIFC14 H14 N2 O SP 1 21/c 128.4936; 5.55569; 8.14303
90; 90.7479; 90
1288.94Štrukil, Vjekoslav; Igrc, Marina D.; Fábián, László; Eckert-Maksić, Mirjana; Childs, Scott L.; Reid, David G.; Duer, Melinda J.; Halasz, Ivan; Mottillo, Cristina; Friščić, Tomislav
A model for a solvent-free synthetic organic research laboratory: click-mechanosynthesis and structural characterization of thioureas without bulk solvents
Green Chemistry, 2012, 14, 2462
7208606 CIFC14 H13 N3 O2 SP n a 2114.50439; 13.62318; 7.14076
90; 90; 90
1410.99Štrukil, Vjekoslav; Igrc, Marina D.; Fábián, László; Eckert-Maksić, Mirjana; Childs, Scott L.; Reid, David G.; Duer, Melinda J.; Halasz, Ivan; Mottillo, Cristina; Friščić, Tomislav
A model for a solvent-free synthetic organic research laboratory: click-mechanosynthesis and structural characterization of thioureas without bulk solvents
Green Chemistry, 2012, 14, 2462
7208607 CIFC31 H25 Br F N O7P -110.8539; 11.5075; 12.5661
97.508; 102.88; 113.095
1365.14Devi Bala, Balasubramanian; Michael Rajesh, Stephen; Perumal, Subbu
An eco-friendly sequential catalyst- and solvent-free four-component stereoselective synthesis of novel 1,4-pyranonaphthoquinones
Green Chemistry, 2012, 14, 2484
7208841 CIFC11 H10 N2 O5 SP 1 21/c 110.788; 16.5308; 7.1104
90; 106.861; 90
1213.52Paladhi, Sushovan; Chauhan, Ajay; Dhara, Kalyan; Tiwari, Ashwani Kumar; Dash, Jyotirmayee
An uncatalyzed aldol reaction of thiazolidinediones
Green Chemistry, 2012, 14, 2990
7208842 CIFC8 H6 Br2 N2 O4 S2P 1 21/c 120.804; 11.9934; 10.9684
90; 102.666; 90
2670.1Paladhi, Sushovan; Chauhan, Ajay; Dhara, Kalyan; Tiwari, Ashwani Kumar; Dash, Jyotirmayee
An uncatalyzed aldol reaction of thiazolidinediones
Green Chemistry, 2012, 14, 2990
7208843 CIFC27 H22 N2 O4P 1 21/n 117.188; 14.671; 17.44
90; 93.406; 90
4390Ghosh, Partha Pratim; Pal, Gargi; Paul, Sanjay; Das, Asish R.
Design and synthesis of benzylpyrazolyl coumarin derivatives via a four-component reaction in water: investigation of the weak interactions accumulating in the crystal structure of a signified compound
Green Chemistry, 2012, 14, 2691
7208844 CIFC25 H16 Cl2 F N O3P 1 21/n 110.017; 7.789; 27.003
90; 95.507; 90
2097.1Indumathi, Sethuraman; Perumal, Subbu; Anbananthan, Natarajan
A facile eco-friendly three-component protocol for the regio- and stereoselective synthesis of functionalized trans-dihydrofuro[3,2-c]-quinolin-4(2H)-ones
Green Chemistry, 2012, 14, 3361
7208845 CIFC25 H25 N3 O8P 1 21/c 110.8016; 23.0207; 9.9117
90; 111.566; 90
2292.11Lu, Qing; Song, Gonghua; Jasinski, Jerry P.; Keeley, Amanda C.; Zhang, Wei
One-pot double [3 + 2] cycloaddition for diastereoselective synthesis of tetracyclic pyrrolidine compounds
Green Chemistry, 2012, 14, 3010
7208846 CIFC28 H28 Cl2 N4 O8 SP 1 21/c 111.5934; 23.9267; 12.5474
90; 116.043; 90
3127.1Lu, Qing; Song, Gonghua; Jasinski, Jerry P.; Keeley, Amanda C.; Zhang, Wei
One-pot double [3 + 2] cycloaddition for diastereoselective synthesis of tetracyclic pyrrolidine compounds
Green Chemistry, 2012, 14, 3010
7208847 CIFC13 H7 F4 I N4 O2P 1 21 17.2406; 6.3111; 16.211
90; 98.719; 90
732.2Chen, Hao; Ni, Ben-Bo; Gao, Fan; Ma, Yuguo
Pressure-accelerated copper-free cycloaddition of azide and alkyne groups pre-organized in the crystalline state at room temperature
Green Chemistry, 2012, 14, 2703
7208848 CIFC15 H10 F4 N4 O3P -15.7206; 10.897; 12.306
86.6; 84.86; 80.87
753.6Chen, Hao; Ni, Ben-Bo; Gao, Fan; Ma, Yuguo
Pressure-accelerated copper-free cycloaddition of azide and alkyne groups pre-organized in the crystalline state at room temperature
Green Chemistry, 2012, 14, 2703
7208849 CIFC16 H14 F N O2P 1 21/c 19.5984; 9.3308; 14.7806
90; 100.934; 90
1299.73Griesbeck, Axel G.; Nazarov, Nestor; Neudörfl, Jörg M.; Heffen, Maria
Intermolecular photodecarboxylation of electron-deficient substrates by phthalimides in water: efficiency, selectivity and online monitoring
Green Chemistry, 2012, 14, 3004
7208850 CIFC17 H14 F3 N O2P 1 21/c 115.6286; 8.625; 10.8601
90; 96.661; 90
1454.02Griesbeck, Axel G.; Nazarov, Nestor; Neudörfl, Jörg M.; Heffen, Maria
Intermolecular photodecarboxylation of electron-deficient substrates by phthalimides in water: efficiency, selectivity and online monitoring
Green Chemistry, 2012, 14, 3004
7208851 CIFC10 H10 N2P c a 218.5482; 10.7471; 9.6662
90; 90; 90
888.02Zhang, Chun; Zhang, Liangren; Jiao, Ning
Catalyst free approach to benzimidazoles using air as the oxidant at room temperature
Green Chemistry, 2012, 14, 3273
7209200 CIFC10 H11 N O2P 21 21 215.955; 7.46; 19.878
90; 90; 90
883.1Ueno, Atsushi; Kayaki, Yoshihito; Ikariya, Takao
Cycloaddition of tertiary aziridines and carbon dioxide using a recyclable organocatalyst, 1,3-di-tert-butylimidazolium-2-carboxylate: straightforward access to 3-substituted 2-oxazolidones
Green Chemistry, 2013, 15, 425
7209250 CIFC25 H20 N2 O2C 1 2/c 120.8671; 10.4343; 18.53
90; 101.947; 90
3947.2Xu, Shengtao; Zhou, Yu; Xu, Jinyi; Jiang, Hualiang; Liu, Hong
Gold-catalyzed Michael addition/intramolecular annulation cascade: an effective pathway for the chemoselective- and regioselective synthesis of tetracyclic indole derivatives in water
Green Chemistry, 2013, 15, 718
7209293 CIFC37 H56 Cu I N4 O2P n m a16.9; 27.54; 8.179
90; 90; 90
3807Wang, Wenlong; Zhang, Guodong; Lang, Rui; Xia, Chungu; Li, Fuwei
pH-Responsive N-heterocyclic carbene copper(i) complexes: syntheses and recoverable applications in the carboxylation of arylboronic esters and benzoxazole with carbon dioxide
Green Chemistry, 2013, 15, 635
7209840 CIFC10 H8 N2 O S2P -17.4617; 7.5189; 9.84
109.76; 90.103; 90.706
519.5Singh, Maya Shankar; Nagaraju, Anugula; Verma, Girijesh Kumar; Shukla, Gaurav; Verma, Rajiv Kumar; Srivastava, Abhijeet; Raghuvanshi, Keshav
Eco-efficient, regioselective and rapid access to 4,5-disubstituted 1,2,3-thiadiazoles via [3 + 2] cycloaddition of α-enolicdithioesters with tosyl azide under solvent-free conditions
Green Chemistry, 2013, 15, 954
7209841 CIFC11 H10 N2 O2 S2P -18.0015; 8.1903; 9.1812
85.565; 75.327; 86.509
579.79Singh, Maya Shankar; Nagaraju, Anugula; Verma, Girijesh Kumar; Shukla, Gaurav; Verma, Rajiv Kumar; Srivastava, Abhijeet; Raghuvanshi, Keshav
Eco-efficient, regioselective and rapid access to 4,5-disubstituted 1,2,3-thiadiazoles via [3 + 2] cycloaddition of α-enolicdithioesters with tosyl azide under solvent-free conditions
Green Chemistry, 2013, 15, 954
7209842 CIFC16 H12 N2 OP 1 21/c 19.5564; 16.83; 7.9596
90; 98.532; 90
1266Shen, Shao-Chun; Sun, Xing-Wen; Lin, Guo-Qiang
An eco-benign and highly efficient access to 3-heterocyclic-substituted isoindolinones in ammonia water
Green Chemistry, 2013, 15, 896
7210021 CIFC21 H18 Br N O SP 1 21/n 15.569; 24.721; 13.606
90; 101.183; 90
1837.6Ray, Suman; Brown, Mike; Bhaumik, Asim; Dutta, Arghya; Mukhopadhyay, Chhanda
A new MCM-41 supported HPF6 catalyst for the library synthesis of highly substituted 1,4-dihydropyridines and oxidation to pyridines: report of one-dimensional packing towards LMSOMs and studies on their photophysical properties
Green Chemistry, 2013, 15, 1910
7210022 CIFC29 H26 N2 O3P 1 21/c 119.1534; 10.4617; 12.4228
90; 104.23; 90
2412.9Ray, Suman; Brown, Mike; Bhaumik, Asim; Dutta, Arghya; Mukhopadhyay, Chhanda
A new MCM-41 supported HPF6 catalyst for the library synthesis of highly substituted 1,4-dihydropyridines and oxidation to pyridines: report of one-dimensional packing towards LMSOMs and studies on their photophysical properties
Green Chemistry, 2013, 15, 1910
7210023 CIFC24 H23 N2 O3C 1 c 116.0558; 13.068; 11.5754
90; 122.419; 90
2050.2Ray, Suman; Brown, Mike; Bhaumik, Asim; Dutta, Arghya; Mukhopadhyay, Chhanda
A new MCM-41 supported HPF6 catalyst for the library synthesis of highly substituted 1,4-dihydropyridines and oxidation to pyridines: report of one-dimensional packing towards LMSOMs and studies on their photophysical properties
Green Chemistry, 2013, 15, 1910
7210450 CIFC8 H12 N4 O6 SP 21 21 216.4063; 8.1667; 23.311
90; 90; 90
1219.6Mottillo, Cristina; Lu, Yuneng; Pham, Minh-Hao; Cliffe, Matthew J.; Do, Trong-On; Friščić, Tomislav
Mineral neogenesis as an inspiration for mild, solvent-free synthesis of bulk microporous metal–organic frameworks from metal (Zn, Co) oxides
Green Chemistry, 2013, 15, 2121
7210451 CIFC8 H6 Cl N O2P 1 21/n 17.3073; 7.1368; 15.6263
90; 91.452; 90
814.66Deadman, Benjamin J.; Battilocchio, Claudio; Sliwinski, Eric; Ley, Steven V.
A prototype device for evaporation in batch and flow chemical processes
Green Chemistry, 2013, 15, 2050
7210452 CIFC9 H14 Cl3 N6 O P S3P b c a15.0238; 11.6122; 20.9195
90; 90; 90
3649.6García-Álvarez, Rocío; Zablocka, Maria; Crochet, Pascale; Duhayon, Carine; Majoral, Jean-Pierre; Cadierno, Victorio
Thiazolyl-phosphine hydrochloride salts: effective auxiliary ligands for ruthenium-catalyzed nitrile hydration reactions and related amide bond forming processes in water
Green Chemistry, 2013, 15, 2447
7211311 CIFC21 H21 N4 O5P -18.1356; 10.6065; 12.462
91.571; 105.781; 100.384
1014.5Prasanna, Pitchaimani; Perumal, Subbu; Menéndez, J. Carlos
Chemodivergent, multicomponent domino reactions in aqueous media: l-proline-catalyzed assembly of densely functionalized 4H-pyrano[2,3-c]pyrazoles and bispyrazolyl propanoates from simple, acyclic starting materials
Green Chemistry, 2013, 15, 1292
7211312 CIFC24 H23 N4 O4P 1 21/n 112.2016; 13.6995; 15.4526
90; 110.166; 90
2424.65Prasanna, Pitchaimani; Perumal, Subbu; Menéndez, J. Carlos
Chemodivergent, multicomponent domino reactions in aqueous media: l-proline-catalyzed assembly of densely functionalized 4H-pyrano[2,3-c]pyrazoles and bispyrazolyl propanoates from simple, acyclic starting materials
Green Chemistry, 2013, 15, 1292
7211313 CIFC30 H36 Cl6 O8P 21 21 219.7594; 18.5524; 18.8335
90; 90; 90
3410Haldar, Saikat; Kolet, Swati P.; Thulasiram, Hirekodathakallu V.
Biocatalysis: fungi mediated novel and selective 12β- or 17β-hydroxylation on the basic limonoid skeleton
Green Chemistry, 2013, 15, 1311
7211314 CIFC19 H33 Cl Ni O3 P2C 1 2/c 118.8143; 18.2714; 14.9031
90; 117.805; 90
4531.61Vabre, Boris; Lindeperg, Fabien; Zargarian, Davit
Direct, one-pot synthesis of POCOP-type pincer complexes from metallic nickel
Green Chemistry, 2013, 15, 3188
7211315 CIFC20 H33 Cl Ni O4 P2P 1 21/c 115.908; 13.0746; 11.134
90; 91.464; 90
2315Vabre, Boris; Lindeperg, Fabien; Zargarian, Davit
Direct, one-pot synthesis of POCOP-type pincer complexes from metallic nickel
Green Chemistry, 2013, 15, 3188
7211316 CIFC26 H47 Cl Ni O2 P2P 1 21/n 110.4275; 14.033; 20.573
90; 101.18; 90
2953.3Vabre, Boris; Lindeperg, Fabien; Zargarian, Davit
Direct, one-pot synthesis of POCOP-type pincer complexes from metallic nickel
Green Chemistry, 2013, 15, 3188
7211317 CIFC38 H38 O10P -110.293; 11.524; 15.213
78.18; 84.68; 76.56
1715.9Forsythe, W. Graham; Garrett, Mark D.; Hardacre, Christopher; Nieuwenhuyzen, Mark; Sheldrake, Gary N.
An efficient and flexible synthesis of model lignin oligomers
Green Chemistry, 2013, 15, 3031
7211318 CIFC33 H27 N9 O3P 1 21/n 116.032; 11.544; 32.695
90; 90.772; 90
6050Zhao, Chao-Wei; Ma, Jian-Ping; Liu, Qi-Kui; Yu, Yang; Wang, Peng; Li, Yan-An; Wang, Kui; Dong, Yu-Bin
A self-assembled Pd6L8 nanoball for Suzuki–Miyaura coupling reactions in both homogeneous and heterogeneous formats
Green Chemistry, 2013, 15, 3150
7211319 CIFC25 H20 Cl6 Fe N O4P b c a17.2201; 15.7615; 19.2134
90; 90; 90
5214.8Taherimehr, Masoumeh; Al-Amsyar, Syed M.; Whiteoak, Christopher J.; Kleij, Arjan W.; Pescarmona, Paolo P.
High activity and switchable selectivity in the synthesis of cyclic and polymeric cyclohexene carbonates with iron amino triphenolate catalysts
Green Chemistry, 2013, 15, 3083
7211320 CIFC16 H18 O4P 1 21/n 17.7968; 21.1512; 9.1046
90; 114.189; 90
1369.63Mitchell, Lorna J.; Lewis, William; Moody, Christopher J.
Solar photochemistry: optimisation of the photo Friedel–Crafts acylation of naphthoquinones
Green Chemistry, 2013, 15, 2830
7211321 CIFC15 H16 O4P b c a12.8287; 7.9789; 24.2643
90; 90; 90
2483.67Mitchell, Lorna J.; Lewis, William; Moody, Christopher J.
Solar photochemistry: optimisation of the photo Friedel–Crafts acylation of naphthoquinones
Green Chemistry, 2013, 15, 2830
7211322 CIFC16 H18 O5P 1 21/c 115.7243; 5.0123; 18.5815
90; 107.285; 90
1398.36Mitchell, Lorna J.; Lewis, William; Moody, Christopher J.
Solar photochemistry: optimisation of the photo Friedel–Crafts acylation of naphthoquinones
Green Chemistry, 2013, 15, 2830
7211491 CIFC32 H26 Cl N O7C 1 2/c 129.861; 10.2141; 21.675
90; 117.455; 90
5866.4Wang, Huiyan; Liu, Xuecheng; Feng, Xian; Huang, Zhibin; Shi, Daqing
GAP chemistry for pyrrolyl coumarin derivatives: a highly efficient one-pot synthesis under catalyst-free conditions
Green Chemistry, 2013, 15, 3307

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