Search results

Result: there are 10886 entries in the selection

Download all results as: list of COD numbers | list of CIF URLs | data in CSV format

We are unable to provide that many records as a single archive.
You can instead download the entire COD archive as a single .zip, .tgz or .txz archive.

Searching year of publication is 2023

First | Previous 300 | of 37 | Next 300 | Last | Display 5 20 50 100 200 300 500 1000 entries per page

COD ID	Links	Formula	Space group	Cell parameters	Cell volume	Bibliography
1568320	CIF	C45 H58 Cl2 N5 Sc	P 1 21/c 1	19.8888; 11.5941; 20.0988 90; 112.329; 90	4287.12	Wang, Shiyu; Zhu, Chenhao; Ning, Lichao; Li, Dawei; Feng, Xiaoming; Dong, Shunxi Regioselective C-H alkylation of anisoles with olefins by cationic imidazolin-2-iminato scandium(iii) alkyl complexes. Chemical science, 2023, 14, 3132-3139
1568321	CIF	C47 H64 Gd N5	P 1 21/n 1	11.7634; 18.4422; 19.7845 90; 93.583; 90	4283.7	Wang, Shiyu; Zhu, Chenhao; Ning, Lichao; Li, Dawei; Feng, Xiaoming; Dong, Shunxi Regioselective C-H alkylation of anisoles with olefins by cationic imidazolin-2-iminato scandium(iii) alkyl complexes. Chemical science, 2023, 14, 3132-3139
1568322	CIF	C47 H64 N5 Y	P -1	10.8628; 11.7806; 18.3075 86.193; 83.654; 71.048	2201.1	Wang, Shiyu; Zhu, Chenhao; Ning, Lichao; Li, Dawei; Feng, Xiaoming; Dong, Shunxi Regioselective C-H alkylation of anisoles with olefins by cationic imidazolin-2-iminato scandium(iii) alkyl complexes. Chemical science, 2023, 14, 3132-3139
1568323	CIF	C47 H64 N5 Sc	P 1 21/c 1	19.891; 11.624; 20.148 90; 112.715; 90	4297.2	Wang, Shiyu; Zhu, Chenhao; Ning, Lichao; Li, Dawei; Feng, Xiaoming; Dong, Shunxi Regioselective C-H alkylation of anisoles with olefins by cationic imidazolin-2-iminato scandium(iii) alkyl complexes. Chemical science, 2023, 14, 3132-3139
1568324	CIF	C4 H22 B20 I2 S2	P 1 21/n 1	14.149; 7.7293; 20.6546 90; 91.659; 90	2257.88	Jana, Arijit; Jash, Madhuri; Dar, Wakeel Ahmed; Roy, Jayoti; Chakraborty, Papri; Paramasivam, Ganesan; Lebedkin, Sergei; Kirakci, Kaplan; Manna, Sujan; Antharjanam, Sudhadevi; Machacek, Jan; Kucerakova, Monika; Ghosh, Sundargopal; Lang, Kamil; Kappes, Manfred M.; Base, Tomas; Pradeep, Thalappil Carborane-thiol protected copper nanoclusters: stimuli-responsive materials with tunable phosphorescence. Chemical science, 2023, 14, 1613-1626
1568325	CIF	C8 H44 B40 Cu4 S4	P 31 2 1	11.4344; 11.4344; 29.4398 90; 90; 120	3333.4	Jana, Arijit; Jash, Madhuri; Dar, Wakeel Ahmed; Roy, Jayoti; Chakraborty, Papri; Paramasivam, Ganesan; Lebedkin, Sergei; Kirakci, Kaplan; Manna, Sujan; Antharjanam, Sudhadevi; Machacek, Jan; Kucerakova, Monika; Ghosh, Sundargopal; Lang, Kamil; Kappes, Manfred M.; Base, Tomas; Pradeep, Thalappil Carborane-thiol protected copper nanoclusters: stimuli-responsive materials with tunable phosphorescence. Chemical science, 2023, 14, 1613-1626
1568326	CIF	C8 H41 B40 Cu4 I3 S4	P 43 21 2	12.716; 12.716; 39.812 90; 90; 90	6437	Jana, Arijit; Jash, Madhuri; Dar, Wakeel Ahmed; Roy, Jayoti; Chakraborty, Papri; Paramasivam, Ganesan; Lebedkin, Sergei; Kirakci, Kaplan; Manna, Sujan; Antharjanam, Sudhadevi; Machacek, Jan; Kucerakova, Monika; Ghosh, Sundargopal; Lang, Kamil; Kappes, Manfred M.; Base, Tomas; Pradeep, Thalappil Carborane-thiol protected copper nanoclusters: stimuli-responsive materials with tunable phosphorescence. Chemical science, 2023, 14, 1613-1626
1568327	CIF	C8 H44 B40 Cu4 S4	P 1 21/c 1	11.3989; 11.9482; 32.3144 90; 91.213; 90	4400.1	Jana, Arijit; Jash, Madhuri; Dar, Wakeel Ahmed; Roy, Jayoti; Chakraborty, Papri; Paramasivam, Ganesan; Lebedkin, Sergei; Kirakci, Kaplan; Manna, Sujan; Antharjanam, Sudhadevi; Machacek, Jan; Kucerakova, Monika; Ghosh, Sundargopal; Lang, Kamil; Kappes, Manfred M.; Base, Tomas; Pradeep, Thalappil Carborane-thiol protected copper nanoclusters: stimuli-responsive materials with tunable phosphorescence. Chemical science, 2023, 14, 1613-1626
1568328	CIF	C50 H63 Cl3 Cr2 O5 P2	C 1 2/c 1	21.584; 13.1523; 17.7764 90; 91.481; 90	5044.7	Ji, Li; Song, Ping; Zhou, Youyun; Sun, Xiu-Li; Gao, Yanshan; Tang, Yong A tridentate phenoxy-phosphine (POP) divalent chromium complex and its reactivities in olefin polymerization Polymer Chemistry, 2023, 14, 763-772
1568329	CIF	C12 H18 Br N	P 1 21/c 1	8.1655; 10.6042; 14.4716 90; 102.495; 90	1223.4	Stroek, Wowa; Hoareau, Lilian; Albrecht, Martin From the bottle: simple iron salts for the efficient synthesis of pyrrolidines <i>via</i> catalytic C-H bond amination. Catalysis science & technology, 2023, 13, 958-962
1568331	CIF	C20 H19 N O5	P 21 21 21	14.8529; 20.5937; 5.5853 90; 90; 90	1708.4	d’Aleman, Antoine; Gayraud, Oscar; Fressigné, Catherine; Petit, Emilie; Bailly, Laetitia; Maddaluno, Jacques; De Paolis, Michaël Organocatalyzed enantio- and diastereoselective isomerization of prochiral 1,3-cyclohexanediones into nonalactones bearing distant stereocenters Chemical Science, 2023, 14, 2107-2113
1568332	CIF	C77 H88 Dy N3 O22 P4	P -1	12.0582; 13.8579; 23.2328 90.646; 97.97; 86.033	3835.5	Huang, Xin-Da; Hong, Ben-Kun; Wen, Ge-Hua; Li, Shu-Hua; Zheng, Li-Min Photo-controllable heterostructured crystals of metal-organic frameworks <i>via</i> reversible photocycloaddition. Chemical science, 2023, 14, 1852-1860
1568333	CIF	C76 H84 Dy N3 O21 P4	P -1	12.0168; 13.485; 23.445 90.47; 97.255; 93.184	3762.5	Huang, Xin-Da; Hong, Ben-Kun; Wen, Ge-Hua; Li, Shu-Hua; Zheng, Li-Min Photo-controllable heterostructured crystals of metal-organic frameworks <i>via</i> reversible photocycloaddition. Chemical science, 2023, 14, 1852-1860
1568334	CIF	C76 H84 Dy N3 O21 P4	P -1	12.1321; 13.3341; 23.3083 90.473; 95.995; 92.718	3745.4	Huang, Xin-Da; Hong, Ben-Kun; Wen, Ge-Hua; Li, Shu-Hua; Zheng, Li-Min Photo-controllable heterostructured crystals of metal-organic frameworks <i>via</i> reversible photocycloaddition. Chemical science, 2023, 14, 1852-1860
1568335	CIF	C76 H84 Dy N3 O21 P4	P -1	12.0667; 13.4722; 23.4814 90.745; 97.128; 93.145	3781.3	Huang, Xin-Da; Hong, Ben-Kun; Wen, Ge-Hua; Li, Shu-Hua; Zheng, Li-Min Photo-controllable heterostructured crystals of metal-organic frameworks <i>via</i> reversible photocycloaddition. Chemical science, 2023, 14, 1852-1860
1568336	CIF	C24 H44 N4 Ni	P 1 21/c 1	15.5164; 9.4299; 17.7244 90; 108.412; 90	2460.64	Tendera, Lukas; Fantuzzi, Felipe; Marder, Todd B.; Radius, Udo Nickel boryl complexes and nickel-catalyzed alkyne borylation. Chemical science, 2023, 14, 2215-2228
1568337	CIF	C30 H54 N4 Ni	C 1 2/c 1	15.7119; 9.6716; 19.5224 90; 94.027; 90	2959.28	Tendera, Lukas; Fantuzzi, Felipe; Marder, Todd B.; Radius, Udo Nickel boryl complexes and nickel-catalyzed alkyne borylation. Chemical science, 2023, 14, 2215-2228
1568338	CIF	C16 H14 B2 O4	P -1	5.7823; 8.4295; 14.2439 87.274; 84.401; 89.585	690.18	Tendera, Lukas; Fantuzzi, Felipe; Marder, Todd B.; Radius, Udo Nickel boryl complexes and nickel-catalyzed alkyne borylation. Chemical science, 2023, 14, 2215-2228
1568339	CIF	C34 H64 B2 N4 Ni O4	P 1 21/c 1	12.0496; 19.7726; 16.7786 90; 110.877; 90	3735.09	Tendera, Lukas; Fantuzzi, Felipe; Marder, Todd B.; Radius, Udo Nickel boryl complexes and nickel-catalyzed alkyne borylation. Chemical science, 2023, 14, 2215-2228
1568340	CIF	C34 H48 B2 N4 Ni O4	P -1	10.8305; 18.882; 19.1567 62.566; 83.687; 81.606	3435.69	Tendera, Lukas; Fantuzzi, Felipe; Marder, Todd B.; Radius, Udo Nickel boryl complexes and nickel-catalyzed alkyne borylation. Chemical science, 2023, 14, 2215-2228
1568341	CIF	C26 H48 B2 N4 Ni O4	P -1	10.2981; 17.9201; 18.0389 116.089; 93.688; 93.509	2968.67	Tendera, Lukas; Fantuzzi, Felipe; Marder, Todd B.; Radius, Udo Nickel boryl complexes and nickel-catalyzed alkyne borylation. Chemical science, 2023, 14, 2215-2228
1568342	CIF	C21 H16 B2 O4	P -1	6.3585; 8.8436; 16.0653 100.552; 97.42; 93.988	876.64	Tendera, Lukas; Fantuzzi, Felipe; Marder, Todd B.; Radius, Udo Nickel boryl complexes and nickel-catalyzed alkyne borylation. Chemical science, 2023, 14, 2215-2228
1568343	CIF	C34 H22 B2 F6 O4	P -1	10.237; 11.4631; 13.66 113.599; 91.47; 93.724	1463.47	Tendera, Lukas; Fantuzzi, Felipe; Marder, Todd B.; Radius, Udo Nickel boryl complexes and nickel-catalyzed alkyne borylation. Chemical science, 2023, 14, 2215-2228
1568344	CIF	C31 H25 B4 O8	P -1	10.0336; 12.4047; 12.9515 62.329; 78.295; 83.938	1397.82	Tendera, Lukas; Fantuzzi, Felipe; Marder, Todd B.; Radius, Udo Nickel boryl complexes and nickel-catalyzed alkyne borylation. Chemical science, 2023, 14, 2215-2228
1568345	CIF	C28 H22 B2 O4	P -1	10.3698; 10.8321; 11.1405 94.791; 108.533; 103.715	1135.37	Tendera, Lukas; Fantuzzi, Felipe; Marder, Todd B.; Radius, Udo Nickel boryl complexes and nickel-catalyzed alkyne borylation. Chemical science, 2023, 14, 2215-2228
1568346	CIF	C39 H42 B2 N2 O4	P 1 21/c 1	10.3586; 16.2208; 20.3367 90; 94.882; 90	3404.67	Tendera, Lukas; Fantuzzi, Felipe; Marder, Todd B.; Radius, Udo Nickel boryl complexes and nickel-catalyzed alkyne borylation. Chemical science, 2023, 14, 2215-2228
1568347	CIF	C20 H20 B2 O4	P 1 21/c 1	12.9444; 15.0597; 9.5195 90; 98.503; 90	1835.32	Tendera, Lukas; Fantuzzi, Felipe; Marder, Todd B.; Radius, Udo Nickel boryl complexes and nickel-catalyzed alkyne borylation. Chemical science, 2023, 14, 2215-2228
1568348	CIF	C37 H35 B4 N O8 Si	P -1	9.7326; 10.1947; 19.1912 76.146; 86.927; 64.991	1672.98	Tendera, Lukas; Fantuzzi, Felipe; Marder, Todd B.; Radius, Udo Nickel boryl complexes and nickel-catalyzed alkyne borylation. Chemical science, 2023, 14, 2215-2228
1568349	CIF	C42 H62 B2 N4 Ni O4	P 1 21/n 1	11.2396; 19.3916; 19.4256 90; 97.714; 90	4195.57	Tendera, Lukas; Fantuzzi, Felipe; Marder, Todd B.; Radius, Udo Nickel boryl complexes and nickel-catalyzed alkyne borylation. Chemical science, 2023, 14, 2215-2228
1568350	CIF	C38 H54 B2 N4 Ni O4	P 1 21/c 1	12.3362; 17.5427; 17.1923 90; 97.966; 90	3684.69	Tendera, Lukas; Fantuzzi, Felipe; Marder, Todd B.; Radius, Udo Nickel boryl complexes and nickel-catalyzed alkyne borylation. Chemical science, 2023, 14, 2215-2228
1568351	CIF	C26 H18 B2 O4	P -1	9.8008; 11.1639; 20.6104 81.513; 82.36; 66.213	2034.2	Tendera, Lukas; Fantuzzi, Felipe; Marder, Todd B.; Radius, Udo Nickel boryl complexes and nickel-catalyzed alkyne borylation. Chemical science, 2023, 14, 2215-2228
1568352	CIF	C34 H34 N6 O2 Sn2	I 1 2/a 1	15.389; 8.8015; 23.005 90; 101.75; 90	3050.6	Sikora, Philipp; Naumann, Robert; Förster, Christoph; Heinze, Katja Excited state energy landscape of phosphorescent group 14 complexes. Chemical science, 2023, 14, 2489-2500
1568353	CIF	C15 H13 N3 Sn	R 3 :H	28.972; 28.972; 8.1427 90; 90; 120	5919.1	Sikora, Philipp; Naumann, Robert; Förster, Christoph; Heinze, Katja Excited state energy landscape of phosphorescent group 14 complexes. Chemical science, 2023, 14, 2489-2500
1568354	CIF	C60 H46 Cl6 N4 O8	P c a 21	14.475; 22.912; 31.837 90; 90; 90	10558.8	Mehra, Kundan Singh; Jha, Shivangee; Menon, Anila M.; Chopra, Deepak; Sankar, Jeyaraman The deeper it goes, the brighter it glows: NIR emissive nitro-terrylene diimides with deep LUMOs. Chemical science, 2023, 14, 3147-3153
1568355	CIF	C58 H43 N5 O10	P -1	8.7404; 9.8973; 15.641 100.242; 95.44; 96.856	1312.6	Mehra, Kundan Singh; Jha, Shivangee; Menon, Anila M.; Chopra, Deepak; Sankar, Jeyaraman The deeper it goes, the brighter it glows: NIR emissive nitro-terrylene diimides with deep LUMOs. Chemical science, 2023, 14, 3147-3153
1568356	CIF	C62 H46 Cl12 N6 O12	P -1	10.4617; 12.3933; 13.748 67.233; 88.114; 80.705	1621.2	Mehra, Kundan Singh; Jha, Shivangee; Menon, Anila M.; Chopra, Deepak; Sankar, Jeyaraman The deeper it goes, the brighter it glows: NIR emissive nitro-terrylene diimides with deep LUMOs. Chemical science, 2023, 14, 3147-3153
1568357	CIF	C58 H44 N4 O8	C 1 2/c 1	26.736; 16.294; 14.3851 90; 114.589; 90	5698.4	Mehra, Kundan Singh; Jha, Shivangee; Menon, Anila M.; Chopra, Deepak; Sankar, Jeyaraman The deeper it goes, the brighter it glows: NIR emissive nitro-terrylene diimides with deep LUMOs. Chemical science, 2023, 14, 3147-3153
1568358	CIF	C117 H89 Cl3 N8 O16	P -1	9.412; 23.109; 30.268 86.235; 85.355; 89.587	6548	Mehra, Kundan Singh; Jha, Shivangee; Menon, Anila M.; Chopra, Deepak; Sankar, Jeyaraman The deeper it goes, the brighter it glows: NIR emissive nitro-terrylene diimides with deep LUMOs. Chemical science, 2023, 14, 3147-3153
1568359	CIF	C8 H11 F4 N3 O4 S2	P -1	8.3226; 9.9577; 10.0572 91.536; 113.802; 111.884	692.05	Bejaoui, Younes K. J.; Philippi, Frederik; Stammler, Hans-Georg; Radacki, Krzysztof; Zapf, Ludwig; Schopper, Nils; Goloviznina, Kateryna; Maibom, Kristina A. M.; Graf, Roland; Sprenger, Jan A. P.; Bertermann, Rüdiger; Braunschweig, Holger; Welton, Tom; Ignat'ev, Nikolai V.; Finze, Maik Insights into structure-property relationships in ionic liquids using cyclic perfluoroalkylsulfonylimides. Chemical science, 2023, 14, 2200-2214
1568360	CIF	C7 H11 F2 N3 O4 S2	P -1	7.9455; 8.6095; 9.9932 95.988; 110.473; 105.27	603.04	Bejaoui, Younes K. J.; Philippi, Frederik; Stammler, Hans-Georg; Radacki, Krzysztof; Zapf, Ludwig; Schopper, Nils; Goloviznina, Kateryna; Maibom, Kristina A. M.; Graf, Roland; Sprenger, Jan A. P.; Bertermann, Rüdiger; Braunschweig, Holger; Welton, Tom; Ignat'ev, Nikolai V.; Finze, Maik Insights into structure-property relationships in ionic liquids using cyclic perfluoroalkylsulfonylimides. Chemical science, 2023, 14, 2200-2214
1568361	CIF	C9 H11 F6 N3 O4 S2	P -1	10.1756; 11.1177; 14.7584 71.995; 74.529; 89.874	1524.43	Bejaoui, Younes K. J.; Philippi, Frederik; Stammler, Hans-Georg; Radacki, Krzysztof; Zapf, Ludwig; Schopper, Nils; Goloviznina, Kateryna; Maibom, Kristina A. M.; Graf, Roland; Sprenger, Jan A. P.; Bertermann, Rüdiger; Braunschweig, Holger; Welton, Tom; Ignat'ev, Nikolai V.; Finze, Maik Insights into structure-property relationships in ionic liquids using cyclic perfluoroalkylsulfonylimides. Chemical science, 2023, 14, 2200-2214
1568362	CIF	C11 H15 F6 N3 O4 S2	P c a 21	18.1649; 8.3747; 23.0541 90; 90; 90	3507.12	Bejaoui, Younes K. J.; Philippi, Frederik; Stammler, Hans-Georg; Radacki, Krzysztof; Zapf, Ludwig; Schopper, Nils; Goloviznina, Kateryna; Maibom, Kristina A. M.; Graf, Roland; Sprenger, Jan A. P.; Bertermann, Rüdiger; Braunschweig, Holger; Welton, Tom; Ignat'ev, Nikolai V.; Finze, Maik Insights into structure-property relationships in ionic liquids using cyclic perfluoroalkylsulfonylimides. Chemical science, 2023, 14, 2200-2214
1568363	CIF	C10 H20 F2 N2 O4 S2	P 21 21 21	9.2307; 9.6375; 16.6863 90; 90; 90	1484.43	Bejaoui, Younes K. J.; Philippi, Frederik; Stammler, Hans-Georg; Radacki, Krzysztof; Zapf, Ludwig; Schopper, Nils; Goloviznina, Kateryna; Maibom, Kristina A. M.; Graf, Roland; Sprenger, Jan A. P.; Bertermann, Rüdiger; Braunschweig, Holger; Welton, Tom; Ignat'ev, Nikolai V.; Finze, Maik Insights into structure-property relationships in ionic liquids using cyclic perfluoroalkylsulfonylimides. Chemical science, 2023, 14, 2200-2214
1568364	CIF	C20 H30 F12 N6 O8 S4	P 1 21/n 1	12.0609; 8.4597; 34.0782 90; 93.118; 90	3471.91	Bejaoui, Younes K. J.; Philippi, Frederik; Stammler, Hans-Georg; Radacki, Krzysztof; Zapf, Ludwig; Schopper, Nils; Goloviznina, Kateryna; Maibom, Kristina A. M.; Graf, Roland; Sprenger, Jan A. P.; Bertermann, Rüdiger; Braunschweig, Holger; Welton, Tom; Ignat'ev, Nikolai V.; Finze, Maik Insights into structure-property relationships in ionic liquids using cyclic perfluoroalkylsulfonylimides. Chemical science, 2023, 14, 2200-2214
1568365	CIF	C11 H20 F4 N2 O4 S2	P 1 21/n 1	8.25097; 10.3115; 19.7803 90; 98.622; 90	1663.89	Bejaoui, Younes K. J.; Philippi, Frederik; Stammler, Hans-Georg; Radacki, Krzysztof; Zapf, Ludwig; Schopper, Nils; Goloviznina, Kateryna; Maibom, Kristina A. M.; Graf, Roland; Sprenger, Jan A. P.; Bertermann, Rüdiger; Braunschweig, Holger; Welton, Tom; Ignat'ev, Nikolai V.; Finze, Maik Insights into structure-property relationships in ionic liquids using cyclic perfluoroalkylsulfonylimides. Chemical science, 2023, 14, 2200-2214
1568366	CIF	C10 H15 Ag F4 N4 O8 S4	P 1 21 1	5.6676; 16.1685; 11.191 90; 98.415; 90	1014.46	Bejaoui, Younes K. J.; Philippi, Frederik; Stammler, Hans-Georg; Radacki, Krzysztof; Zapf, Ludwig; Schopper, Nils; Goloviznina, Kateryna; Maibom, Kristina A. M.; Graf, Roland; Sprenger, Jan A. P.; Bertermann, Rüdiger; Braunschweig, Holger; Welton, Tom; Ignat'ev, Nikolai V.; Finze, Maik Insights into structure-property relationships in ionic liquids using cyclic perfluoroalkylsulfonylimides. Chemical science, 2023, 14, 2200-2214
1568367	CIF	C9 H15 F2 N3 O4 S2	P b c a	8.9762; 18.0158; 35.4048 90; 90; 90	5725.43	Bejaoui, Younes K. J.; Philippi, Frederik; Stammler, Hans-Georg; Radacki, Krzysztof; Zapf, Ludwig; Schopper, Nils; Goloviznina, Kateryna; Maibom, Kristina A. M.; Graf, Roland; Sprenger, Jan A. P.; Bertermann, Rüdiger; Braunschweig, Holger; Welton, Tom; Ignat'ev, Nikolai V.; Finze, Maik Insights into structure-property relationships in ionic liquids using cyclic perfluoroalkylsulfonylimides. Chemical science, 2023, 14, 2200-2214
1568368	CIF	C8 H11 Ag F4 N4 O8 S4	P -1	5.9059; 8.225; 10.7395 103.427; 101.901; 107.938	460.501	Bejaoui, Younes K. J.; Philippi, Frederik; Stammler, Hans-Georg; Radacki, Krzysztof; Zapf, Ludwig; Schopper, Nils; Goloviznina, Kateryna; Maibom, Kristina A. M.; Graf, Roland; Sprenger, Jan A. P.; Bertermann, Rüdiger; Braunschweig, Holger; Welton, Tom; Ignat'ev, Nikolai V.; Finze, Maik Insights into structure-property relationships in ionic liquids using cyclic perfluoroalkylsulfonylimides. Chemical science, 2023, 14, 2200-2214
1568369	CIF	C10 H15 F4 N3 O4 S2	P -1	8.1326; 11.5911; 17.2771 104.234; 95.326; 92.313	1568.45	Bejaoui, Younes K. J.; Philippi, Frederik; Stammler, Hans-Georg; Radacki, Krzysztof; Zapf, Ludwig; Schopper, Nils; Goloviznina, Kateryna; Maibom, Kristina A. M.; Graf, Roland; Sprenger, Jan A. P.; Bertermann, Rüdiger; Braunschweig, Holger; Welton, Tom; Ignat'ev, Nikolai V.; Finze, Maik Insights into structure-property relationships in ionic liquids using cyclic perfluoroalkylsulfonylimides. Chemical science, 2023, 14, 2200-2214
1568370	CIF	C12 H20 F6 N2 O4 S2	P -1	8.981; 9.3656; 11.9008 70.207; 75.403; 71.869	882.98	Bejaoui, Younes K. J.; Philippi, Frederik; Stammler, Hans-Georg; Radacki, Krzysztof; Zapf, Ludwig; Schopper, Nils; Goloviznina, Kateryna; Maibom, Kristina A. M.; Graf, Roland; Sprenger, Jan A. P.; Bertermann, Rüdiger; Braunschweig, Holger; Welton, Tom; Ignat'ev, Nikolai V.; Finze, Maik Insights into structure-property relationships in ionic liquids using cyclic perfluoroalkylsulfonylimides. Chemical science, 2023, 14, 2200-2214
1568371	CIF	C11 H20 Ag F4 N3 O8 S4	P -1	9.5881; 10.8805; 11.469 87.979; 78.644; 64.936	1061.04	Bejaoui, Younes K. J.; Philippi, Frederik; Stammler, Hans-Georg; Radacki, Krzysztof; Zapf, Ludwig; Schopper, Nils; Goloviznina, Kateryna; Maibom, Kristina A. M.; Graf, Roland; Sprenger, Jan A. P.; Bertermann, Rüdiger; Braunschweig, Holger; Welton, Tom; Ignat'ev, Nikolai V.; Finze, Maik Insights into structure-property relationships in ionic liquids using cyclic perfluoroalkylsulfonylimides. Chemical science, 2023, 14, 2200-2214
1568372	CIF	C16 H20 Cl2 N2 O2 Pd	P 1 21/n 1	8.5369; 12.0251; 17.0606 90; 96.799; 90	1739.07	Shimomoto, Hiroaki; Miyano, Yuto; Kinoshita, Kaito; Itoh, Tomomichi; Ihara, Eiji Initiating abilities of diphosphine- and diamine-ligated Pd complexes/NaBPh4 systems for C1 polymerization of diazoacetates Polymer Chemistry, 2023, 14, 1007-1018
1568373	CIF	C17 H22 Cl2 N2 O2 Pd	C 1 2/c 1	16.7813; 8.4205; 26.3272 90; 103.427; 90	3618.5	Shimomoto, Hiroaki; Miyano, Yuto; Kinoshita, Kaito; Itoh, Tomomichi; Ihara, Eiji Initiating abilities of diphosphine- and diamine-ligated Pd complexes/NaBPh4 systems for C1 polymerization of diazoacetates Polymer Chemistry, 2023, 14, 1007-1018
1568374	CIF	C17 H22 Br2 N2 O2 Pd	C 1 2/m 1	12.3508; 14.1078; 10.6617 90; 101.286; 90	1821.8	Shimomoto, Hiroaki; Miyano, Yuto; Kinoshita, Kaito; Itoh, Tomomichi; Ihara, Eiji Initiating abilities of diphosphine- and diamine-ligated Pd complexes/NaBPh4 systems for C1 polymerization of diazoacetates Polymer Chemistry, 2023, 14, 1007-1018
1568375	CIF	C57 H52 Cl2 O5 P2 Pd	P -1	12.63; 13.0697; 16.0599 67.524; 81.219; 78.077	2388.82	Shimomoto, Hiroaki; Miyano, Yuto; Kinoshita, Kaito; Itoh, Tomomichi; Ihara, Eiji Initiating abilities of diphosphine- and diamine-ligated Pd complexes/NaBPh4 systems for C1 polymerization of diazoacetates Polymer Chemistry, 2023, 14, 1007-1018
1568376	CIF	C50.34 H42.68 Cl2 O3.45 P2 Pd	P 1 21/c 1	12.4623; 10.8537; 32.8318 90; 93.985; 90	4430.2	Shimomoto, Hiroaki; Miyano, Yuto; Kinoshita, Kaito; Itoh, Tomomichi; Ihara, Eiji Initiating abilities of diphosphine- and diamine-ligated Pd complexes/NaBPh4 systems for C1 polymerization of diazoacetates Polymer Chemistry, 2023, 14, 1007-1018
1568377	CIF	C45 H33 Cl5 Fe O2 P2 Pd	P n a 21	32.1117; 12.4315; 10.0614 90; 90; 90	4016.48	Shimomoto, Hiroaki; Miyano, Yuto; Kinoshita, Kaito; Itoh, Tomomichi; Ihara, Eiji Initiating abilities of diphosphine- and diamine-ligated Pd complexes/NaBPh4 systems for C1 polymerization of diazoacetates Polymer Chemistry, 2023, 14, 1007-1018
1568378	CIF	C63 H51 Cl2 O4 P2 Pd	P 1 21/n 1	20.2129; 13.654; 20.7338 90; 116.67; 90	5113.4	Shimomoto, Hiroaki; Miyano, Yuto; Kinoshita, Kaito; Itoh, Tomomichi; Ihara, Eiji Initiating abilities of diphosphine- and diamine-ligated Pd complexes/NaBPh4 systems for C1 polymerization of diazoacetates Polymer Chemistry, 2023, 14, 1007-1018
1568379	CIF	C422 H299 B11.5 F47 N72 O27.75 Zn8	P 1 21/c 1	27.5152; 48.566; 55.058 90; 91.649; 90	73544	Li, Danyang; Liu, Xin; Yang, Linlin; Li, Hechuan; Guo, Guoxu; Li, Xuezhao; He, Cheng Highly efficient Förster resonance energy transfer between an emissive tetraphenylethylene-based metal-organic cage and the encapsulated dye guest. Chemical science, 2023, 14, 2237-2244
1568380	CIF	C453.5 H351.5 B7.5 Br F30 N77.5 O62 Zn8	P -1	27.2167; 33.1187; 38.817 88.598; 88.357; 83.075	34712	Li, Danyang; Liu, Xin; Yang, Linlin; Li, Hechuan; Guo, Guoxu; Li, Xuezhao; He, Cheng Highly efficient Förster resonance energy transfer between an emissive tetraphenylethylene-based metal-organic cage and the encapsulated dye guest. Chemical science, 2023, 14, 2237-2244
1568381	CIF	C34 H26 Cl N O2	P 1 21 1	7.2214; 28.506; 13.0812 90; 92.638; 90	2690	Das, Saikat; Kondoh, Azusa; Terada, Masahiro Enantioselective direct Michael addition of cyanohydrin ether derivatives to enones catalyzed by chiral bis(guanidino)iminophosphorane organosuperbase. Chemical science, 2023, 14, 3154-3159
1568382	CIF	C60 H64 B F24 Fe N3 O2 P2	P 1 21/c 1	13.6976; 23.8148; 20.2227 90; 98.742; 90	6520.1	Schlenker, Kevin; Casselman, Lillee K.; VanderLinden, Ryan T.; Saouma, Caroline T. Large changes in hydricity as a function of charge and not metal in (PNP)M–H (de)hydrogenation catalysts that undergo metal–ligand cooperativity Catalysis Science & Technology, 2023, 13, 1358-1368
1568383	CIF	C36 H68 K N O4 P2 Ru	P 21 21 21	12.158; 17.5241; 19.0088 90; 90; 90	4050	Schlenker, Kevin; Casselman, Lillee K.; VanderLinden, Ryan T.; Saouma, Caroline T. Large changes in hydricity as a function of charge and not metal in (PNP)M–H (de)hydrogenation catalysts that undergo metal–ligand cooperativity Catalysis Science & Technology, 2023, 13, 1358-1368
1568384	CIF	C114 H226 Cr4 O28 Si7	P -1	18.0228; 18.6557; 24.1397 81.335; 80.527; 62.02	7044.8	Nobile, Anna Giorgia; Trummer, David; Berkson, Zachariah J.; Wörle, Michael; Copéret, Christophe; Payard, Pierre-Adrien Assigning 1H chemical shifts in paramagnetic mono- and bimetallic surface sites using DFT: a case study on the Union Carbide polymerization catalyst Chemical Science, 2023, 14, 2361-2368
1568385	CIF	C24 H21 F N2 O4	P 1 21/n 1	8.8055; 11.8006; 19.3349 90; 91.749; 90	2008.2	Zhang, Jingming; Liu, Chengkou; Qiao, Yaqi; Wei, Minghui; Guan, Wenjing; Mao, Ziren; Qin, Hong; Fang, Zheng; Guo, Kai Intramolecular trapping of spiro radicals to produce unusual cyclization products from usual migration substrates Chemical Science, 2023, 14, 2461-2466
1568386	CIF	Se3 Sn Zr	P n m a	9.5862; 3.84427; 14.3959 90; 90; 90	530.52	Kondrotas, Rokas; Juskenas, Remigijus; Krotkus, Arunas; Pakstas, Vidas; Suchodolskis, Arturas; Mekys, Algirdas; Franckevicius, Marius; Talaikis, Martynas; Muska, Katri; Li, Xiaofeng; Kauk-Kuusik Marit; Kravtsov Victor Synthesis and physical characteristics of narrow bandgap chalcogenide SnZrSe3 Open Research Europe, 2023, 2, 1-12
1568404	CIF	C74 H48.4 Cl15.6 Fe1.6 I2.4 N12	P -1	20.6469; 23.6627; 24.8965 64.38; 69.27; 68.88	9942.9	Yamada, Yasuyuki; Miwa, Yusuke; Toyoda, Yuka; Phung, Quan Manh; Oyama, Kin-ichi; Tanaka, Kentaro Evaluation of CH4 oxidation activity of high-valent iron-oxo species of a μ-nitrido-bridged heterodimer of iron porphycene and iron phthalocyanine Catalysis Science & Technology, 2023, 13, 1725-1734
1568405	CIF	C18 H18 N2 O3 S2	P 1 21 1	10.53468; 6.40021; 13.58053 90; 106.401; 90	878.396	Ma, Zhaoming; Sun, Lantian; Zhou, Jianrong Steve Catalytic enantioselective alkenylation-heteroarylation of olefins: stereoselective syntheses of 5-7 membered azacycles and oxacycles. Chemical science, 2023, 14, 3010-3017
1568406	CIF	C5 As Cl F11 N	P 1 21/n 1	6.2789; 21.884; 7.7197 90; 111.31; 90	988.22	Pröhm, Patrick; Berg, Willi; Rupf, Susanne Margot; Müller, Carsten; Riedel, Sebastian On pyridine chloronium cations Chemical Science, 2023, 14, 2325-2329
1568407	CIF	C5 H5 Cl2 N	P n m a	13.9435; 6.5593; 7.0669 90; 90; 90	646.34	Pröhm, Patrick; Berg, Willi; Rupf, Susanne Margot; Müller, Carsten; Riedel, Sebastian On pyridine chloronium cations Chemical Science, 2023, 14, 2325-2329
1568408	CIF	C26 H30 B2 Cl2 F8 N6	C 1 2 1	15.093; 14.455; 15.759 90; 108.451; 90	3261	Pröhm, Patrick; Berg, Willi; Rupf, Susanne Margot; Müller, Carsten; Riedel, Sebastian On pyridine chloronium cations Chemical Science, 2023, 14, 2325-2329
1568409	CIF	C14 H18 Cl4 N2	P 1 21/m 1	8.3507; 6.7026; 15.1667 90; 104.077; 90	823.41	Pröhm, Patrick; Berg, Willi; Rupf, Susanne Margot; Müller, Carsten; Riedel, Sebastian On pyridine chloronium cations Chemical Science, 2023, 14, 2325-2329
1568410	CIF	C26 H30 Ag B2 F8 N6	P b c n	13.6718; 15.798; 15.142 90; 90; 90	3270.5	Pröhm, Patrick; Berg, Willi; Rupf, Susanne Margot; Müller, Carsten; Riedel, Sebastian On pyridine chloronium cations Chemical Science, 2023, 14, 2325-2329
1568411	CIF	As Cl2 F7	P 1 21/n 1	5.3882; 15.2962; 7.9427 90; 105.459; 90	630.95	Pröhm, Patrick; Berg, Willi; Rupf, Susanne Margot; Müller, Carsten; Riedel, Sebastian On pyridine chloronium cations Chemical Science, 2023, 14, 2325-2329
1568412	CIF	C12 H8 Se2	P 1 21/c 1	12.1157; 6.2539; 14.6 90; 109.833; 90	1040.63	Yang, Zhiqiang; Fu, Zhiyuan; Liu, Haichao; Wu, Min; Li, Nan; Wang, Kai; Zhang, Shi-Tong; Zou, Bo; Yang, Bing Pressure-induced room-temperature phosphorescence enhancement based on purely organic molecules with a folded geometry. Chemical science, 2023, 14, 2640-2645
1568413	CIF	C22 H14 F5 N O3	P 1 21/c 1	41.4191; 6.5104; 14.0699 90; 98.7; 90	3750.4	Muller, Cyprien; Horký, Filip; Vayer, Marie; Golushko, Andrei; Lebœuf, David; Moran, Joseph Synthesis of functionalised isochromans: epoxides as aldehyde surrogates in hexafluoroisopropanol Chemical Science, 2023, 14, 2983-2989
1568414	CIF	C16 H15 N O3	P 1 c 1	7.9798; 10.8805; 8.421 90; 117.053; 90	651.15	Muller, Cyprien; Horký, Filip; Vayer, Marie; Golushko, Andrei; Lebœuf, David; Moran, Joseph Synthesis of functionalised isochromans: epoxides as aldehyde surrogates in hexafluoroisopropanol Chemical Science, 2023, 14, 2983-2989
1568415	CIF	C19 H19 N O3	P -1	7.9718; 9.2217; 11.1636 100.875; 90.02; 110.526	752.8	Muller, Cyprien; Horký, Filip; Vayer, Marie; Golushko, Andrei; Lebœuf, David; Moran, Joseph Synthesis of functionalised isochromans: epoxides as aldehyde surrogates in hexafluoroisopropanol Chemical Science, 2023, 14, 2983-2989
1568416	CIF	C20 H18 F6 O3	P 1 21/n 1	8.6103; 7.9713; 27.483 90; 91.244; 90	1885.9	Muller, Cyprien; Horký, Filip; Vayer, Marie; Golushko, Andrei; Lebœuf, David; Moran, Joseph Synthesis of functionalised isochromans: epoxides as aldehyde surrogates in hexafluoroisopropanol Chemical Science, 2023, 14, 2983-2989
1568417	CIF	C105 H121 N9 Ni2 O10	P 1 21/c 1	21.23; 28.36; 16.32 90; 105.11; 90	9486	Yamashita, Ken-Ichi; Takeuchi, Shouichi; Sugiura, Ken-Ichi Structurally well-defined conjugated <i>meso</i>-aminoporphyrin oligomers analogous to polyanilines. Chemical science, 2023, 14, 2735-2744
1568418	CIF	C51 H70 Fe N4	C 1 2/c 1	23.1585; 9.2604; 23.5718 90; 114.448; 90	4601.9	Xiong, Jin; Liu, Qing; Lavina, Barbara; Hu, Michael Y.; Zhao, Jiyong; Alp, Esen E.; Deng, Liang; Ye, Shengfa; Guo, Yisong Spin polarization assisted facile C-H activation by an <i>S</i> = 1 iron(iv)-bisimido complex: a comprehensive spectroscopic and theoretical investigation. Chemical science, 2023, 14, 2808-2820
1568419	CIF	C13 H10 Cl2 N2 O	P 1 2/c 1	14.5261; 4.3104; 20.361 90; 102.088; 90	1246.6	Bhattacharya, Biswajit; Michalchuk, Adam A. L.; Silbernagl, Dorothee; Yasuda, Nobuhiro; Feiler, Torvid; Sturm, Heinz; Emmerling, Franziska An atomistic mechanism for elasto-plastic bending in molecular crystals. Chemical science, 2023, 14, 3441-3450
1568420	CIF	C13 H10 Cl2 N2 O	P 1 2/c 1	14.3805; 4.2807; 20.0178 90; 101.319; 90	1208.3	Bhattacharya, Biswajit; Michalchuk, Adam A. L.; Silbernagl, Dorothee; Yasuda, Nobuhiro; Feiler, Torvid; Sturm, Heinz; Emmerling, Franziska An atomistic mechanism for elasto-plastic bending in molecular crystals. Chemical science, 2023, 14, 3441-3450
1568421	CIF	C31 H26 Cl3 N3 O5	P 21 21 21	9.9368; 17.0962; 17.1478 90; 90; 90	2913.09	Chen, Pengquan; Lv, Mei-Jun; Cheng, Jun Kee; Xiang, Shao-Hua; Ren, Xiang-Zhong; Zhang, Junmin; Tan, Bin Enantioselective construction of triaryl-substituted all-carbon quaternary stereocenters via organocatalytic arylation of oxindoles with azonaphthalenes Chemical Science, 2023, 14, 2330-2335
1568422	CIF	C27 H24 F3 N3 O2 S	P 21 21 21	7.4828; 18.3087; 18.4701 90; 90; 90	2530.41	Nilova, Aleksandra; Mannchen, Michael D.; Noel, Abdias N.; Semenova, Evgeniya; Grenning, Alexander J. Vicinal stereocenters <i>via</i> asymmetric allylic alkylation and Cope rearrangement: a straightforward route to functionally and stereochemically rich heterocycles. Chemical science, 2023, 14, 2755-2762
1568423	CIF	C23 H24 Cl N O4 S	P 1 21 1	11.1508; 6.3344; 15.0399 90; 99.417; 90	1048.01	Nilova, Aleksandra; Mannchen, Michael D.; Noel, Abdias N.; Semenova, Evgeniya; Grenning, Alexander J. Vicinal stereocenters <i>via</i> asymmetric allylic alkylation and Cope rearrangement: a straightforward route to functionally and stereochemically rich heterocycles. Chemical science, 2023, 14, 2755-2762
1568424	CIF	C20 H22 O4 Pd S2	P -1	9.0235; 10.1775; 11.8976 81.443; 73.982; 76.298	1016.25	Naksomboon, Kananat; Gómez-Bengoa, Enrique; Mehara, Jaya; Roithová, Jana; Otten, Edwin; Fernández-Ibáñez, M. Ángeles Mechanistic studies of the palladium-catalyzed S,O-ligand promoted C–H olefination of aromatic compounds Chemical Science, 2023, 14, 2943-2953
1568425	CIF	C30 H29 O4 P Pd S	P 1 21/c 1	10.1765; 28.3513; 9.7423 90; 106.951; 90	2688.7	Naksomboon, Kananat; Gómez-Bengoa, Enrique; Mehara, Jaya; Roithová, Jana; Otten, Edwin; Fernández-Ibáñez, M. Ángeles Mechanistic studies of the palladium-catalyzed S,O-ligand promoted C–H olefination of aromatic compounds Chemical Science, 2023, 14, 2943-2953
1568426	CIF	C34 H31 O2 P Pd S	P 21 21 21	9.7129; 11.885; 24.9669 90; 90; 90	2882.12	Naksomboon, Kananat; Gómez-Bengoa, Enrique; Mehara, Jaya; Roithová, Jana; Otten, Edwin; Fernández-Ibáñez, M. Ángeles Mechanistic studies of the palladium-catalyzed S,O-ligand promoted C–H olefination of aromatic compounds Chemical Science, 2023, 14, 2943-2953
1568427	CIF	C34 H31 O2 P Pd S	P 21 21 21	9.6976; 11.8942; 24.9749 90; 90; 90	2880.7	Naksomboon, Kananat; Gómez-Bengoa, Enrique; Mehara, Jaya; Roithová, Jana; Otten, Edwin; Fernández-Ibáñez, M. Ángeles Mechanistic studies of the palladium-catalyzed S,O-ligand promoted C–H olefination of aromatic compounds Chemical Science, 2023, 14, 2943-2953
1568428	CIF	C57 H83 Al N4 Si2	P 1 21/c 1	16.0038; 13.5032; 25.4153 90; 97.519; 90	5445.08	Liu, Han-Ying; Neale, Samuel E.; Hill, Michael S.; Mahon, Mary F.; McMullin, Claire L. Structural snapshots of an Al-Cu bond-mediated transformation of terminal acetylenes. Chemical science, 2023, 14, 2866-2876
1568429	CIF	C53 H88 Al Cu N4 Si2	C 1 c 1	21.4197; 13.5245; 19.6839 90; 103.151; 90	5552.7	Liu, Han-Ying; Neale, Samuel E.; Hill, Michael S.; Mahon, Mary F.; McMullin, Claire L. Structural snapshots of an Al-Cu bond-mediated transformation of terminal acetylenes. Chemical science, 2023, 14, 2866-2876
1568430	CIF	C86 H122 Al Cu N4 Si2	P -1	12.225; 12.4368; 27.9562 81.885; 86.337; 74.292	4049.28	Liu, Han-Ying; Neale, Samuel E.; Hill, Michael S.; Mahon, Mary F.; McMullin, Claire L. Structural snapshots of an Al-Cu bond-mediated transformation of terminal acetylenes. Chemical science, 2023, 14, 2866-2876
1568431	CIF	C46 H80 Al Cu N4 Si3	P 1 21/n 1	15.0696; 16.5798; 20.4317 90; 91.457; 90	5103.2	Liu, Han-Ying; Neale, Samuel E.; Hill, Michael S.; Mahon, Mary F.; McMullin, Claire L. Structural snapshots of an Al-Cu bond-mediated transformation of terminal acetylenes. Chemical science, 2023, 14, 2866-2876
1568432	CIF	C188 H320 Al4 Cu4 N16 Si8	P 1 21/c 1	16.2074; 12.7848; 24.4265 90; 100.576; 90	4975.39	Liu, Han-Ying; Neale, Samuel E.; Hill, Michael S.; Mahon, Mary F.; McMullin, Claire L. Structural snapshots of an Al-Cu bond-mediated transformation of terminal acetylenes. Chemical science, 2023, 14, 2866-2876
1568433	CIF	C75 H104 Al Cu N4 Si2	P b c n	15.0236; 21.9618; 21.1294 90; 90; 90	6971.55	Liu, Han-Ying; Neale, Samuel E.; Hill, Michael S.; Mahon, Mary F.; McMullin, Claire L. Structural snapshots of an Al-Cu bond-mediated transformation of terminal acetylenes. Chemical science, 2023, 14, 2866-2876
1568434	CIF	C160 H220 Al2 Cu4 N6 Si4	P -1	13.2732; 17.1411; 34.2337 97.978; 98.341; 96.908	7553	Liu, Han-Ying; Neale, Samuel E.; Hill, Michael S.; Mahon, Mary F.; McMullin, Claire L. Structural snapshots of an Al-Cu bond-mediated transformation of terminal acetylenes. Chemical science, 2023, 14, 2866-2876
1568435	CIF	C57 H80 Al Cu N4 Si2	C 1 c 1	20.8885; 13.8728; 19.6118 90; 101.347; 90	5572.06	Liu, Han-Ying; Neale, Samuel E.; Hill, Michael S.; Mahon, Mary F.; McMullin, Claire L. Structural snapshots of an Al-Cu bond-mediated transformation of terminal acetylenes. Chemical science, 2023, 14, 2866-2876
1568436	CIF	C74 H112 Al Cu N6 Si2	P 1 21/c 1	12.40965; 23.21981; 25.09012 90; 92.1704; 90	7224.52	Liu, Han-Ying; Neale, Samuel E.; Hill, Michael S.; Mahon, Mary F.; McMullin, Claire L. Structural snapshots of an Al-Cu bond-mediated transformation of terminal acetylenes. Chemical science, 2023, 14, 2866-2876
1568437	CIF	C74 H114 Al Cu N6 Si2	P 1 21/n 1	13.5126; 23.3252; 23.6673 90; 105.075; 90	7202.84	Liu, Han-Ying; Neale, Samuel E.; Hill, Michael S.; Mahon, Mary F.; McMullin, Claire L. Structural snapshots of an Al-Cu bond-mediated transformation of terminal acetylenes. Chemical science, 2023, 14, 2866-2876
1568438	CIF	C51 H88 Al Cu N4 Si4	P 1 21/n 1	12.6138; 20.7585; 22.1325 90; 93.689; 90	5783.2	Liu, Han-Ying; Neale, Samuel E.; Hill, Michael S.; Mahon, Mary F.; McMullin, Claire L. Structural snapshots of an Al-Cu bond-mediated transformation of terminal acetylenes. Chemical science, 2023, 14, 2866-2876
1568439	CIF	C40 H52 Ga P	P 1 21/c 1	10.1214; 22.1032; 16.8012 90; 106.045; 90	3612.27	Taeufer, T.; Dankert, F.; Michalik, D.; Pospech, J.; Bresien, J.; Hering-Junghans, C Photochemical formation and reversible base-induced cleavage of a phosphagallene. Chemical science, 2023, 14, 3018-3023
1568440	CIF	C46 H64 Ga P	P -1	10.6093; 12.7651; 20.7583 80.862; 81.858; 65.926	2524.94	Taeufer, T.; Dankert, F.; Michalik, D.; Pospech, J.; Bresien, J.; Hering-Junghans, C Photochemical formation and reversible base-induced cleavage of a phosphagallene. Chemical science, 2023, 14, 3018-3023
1568441	CIF	C31 H37 O P	P 1 21/n 1	11.9426; 18.1472; 12.6846 90; 98.094; 90	2721.7	Taeufer, T.; Dankert, F.; Michalik, D.; Pospech, J.; Bresien, J.; Hering-Junghans, C Photochemical formation and reversible base-induced cleavage of a phosphagallene. Chemical science, 2023, 14, 3018-3023
1568442	CIF	C19 H19 Br N P	P -1	9.4139; 9.7021; 10.4201 63.457; 80.694; 85.381	840.16	Ong, How Chee; Coimbra, João T S; Ramos, Maria J.; Xing, Bengang; Fernandes, Pedro A.; García, Felipe Beyond the TPP<sup>+</sup> "gold standard": a new generation mitochondrial delivery vector based on extended PN frameworks. Chemical science, 2023, 14, 4126-4133
1568443	CIF	C21 H22 Br P	P 1 21/n 1	10.6424; 12.4166; 14.4706 90; 93.167; 90	1909.3	Ong, How Chee; Coimbra, João T S; Ramos, Maria J.; Xing, Bengang; Fernandes, Pedro A.; García, Felipe Beyond the TPP<sup>+</sup> "gold standard": a new generation mitochondrial delivery vector based on extended PN frameworks. Chemical science, 2023, 14, 4126-4133
1568444	CIF	C23 H29 Br N O P	P b c a	13.9907; 14.6428; 21.7567 90; 90; 90	4457.1	Ong, How Chee; Coimbra, João T S; Ramos, Maria J.; Xing, Bengang; Fernandes, Pedro A.; García, Felipe Beyond the TPP<sup>+</sup> "gold standard": a new generation mitochondrial delivery vector based on extended PN frameworks. Chemical science, 2023, 14, 4126-4133
1568445	CIF	C32 H30.5 Br N O0.25 P2	P -1	10.3306; 10.6126; 13.3397 82.341; 72.934; 82.482	1379.1	Ong, How Chee; Coimbra, João T S; Ramos, Maria J.; Xing, Bengang; Fernandes, Pedro A.; García, Felipe Beyond the TPP<sup>+</sup> "gold standard": a new generation mitochondrial delivery vector based on extended PN frameworks. Chemical science, 2023, 14, 4126-4133
1568446	CIF	C24 H23 N O2 S	P 21 21 21	8.3434; 9.5869; 25.257 90; 90; 90	2020.24	Liu, Xin-Lian; Lin, Han-Ze; Tan, Lu-Qi; Peng, Jin-Bao Palladium- and Brønsted acid-catalyzed enantio-, site- and E/Z-selective addition of alkylidenecyclopropanes with imines Chemical Science, 2023, 14, 2348-2352
1568447	CIF	C44 H56 Fe2 N4	P -1	11.1005; 11.3249; 18.9146 103.931; 93.575; 116.835	2018.76	McWilliams, Sean F.; Mercado, Brandon Q.; MacLeod, K. Cory; Fataftah, Majed S.; Tarrago, Maxime; Wang, Xiaoping; Bill, Eckhard; Ye, Shengfa; Holland, Patrick L. Dynamic effects on ligand field from rapid hydride motion in an iron(ii) dimer with an S = 3 ground state Chemical Science, 2023, 14, 2303-2312
1568448	CIF	C51 H64 Fe2 N4	P 1 21 1	11.9085; 11.0443; 17.499 90; 94.175; 90	2295.38	McWilliams, Sean F.; Mercado, Brandon Q.; MacLeod, K. Cory; Fataftah, Majed S.; Tarrago, Maxime; Wang, Xiaoping; Bill, Eckhard; Ye, Shengfa; Holland, Patrick L. Dynamic effects on ligand field from rapid hydride motion in an iron(ii) dimer with an S = 3 ground state Chemical Science, 2023, 14, 2303-2312
1568449	CIF	C51 H62.15 D1.85 Fe2 N4	P 1 21 1	11.8009; 10.9639; 17.4087 90; 94.329; 90	2245.98	McWilliams, Sean F.; Mercado, Brandon Q.; MacLeod, K. Cory; Fataftah, Majed S.; Tarrago, Maxime; Wang, Xiaoping; Bill, Eckhard; Ye, Shengfa; Holland, Patrick L. Dynamic effects on ligand field from rapid hydride motion in an iron(ii) dimer with an S = 3 ground state Chemical Science, 2023, 14, 2303-2312
1568450	CIF	C51 H64 Fe2 N4	P 1 21 1	11.8026; 10.9628; 17.4178 90; 94.36; 90	2247.16	McWilliams, Sean F.; Mercado, Brandon Q.; MacLeod, K. Cory; Fataftah, Majed S.; Tarrago, Maxime; Wang, Xiaoping; Bill, Eckhard; Ye, Shengfa; Holland, Patrick L. Dynamic effects on ligand field from rapid hydride motion in an iron(ii) dimer with an S = 3 ground state Chemical Science, 2023, 14, 2303-2312
1568451	CIF	C9 H8 N2 O2	P 1 21/n 1	9.1643; 9.1814; 10.4783 90; 115.381; 90	796.56	Koleda, Olesja; Prenzel, Tobias; Winter, Johannes; Hirohata, Tomoki; de Jesús Gálvez-Vázquez, María; Schollmeyer, Dieter; Inagi, Shinsuke; Suna, Edgars; Waldvogel, Siegfried R. Simple and scalable electrosynthesis of 1H-1-hydroxy-quinazolin-4-ones Chemical Science, 2023, 14, 2669-2675
1568452	CIF	C35 H34 N2 O	P 1 21/n 1	9.3198; 11.1833; 26.6506 90; 99.812; 90	2737.06	Tan, Guangying; Paulus, Fritz; Petti, Alessia; Wiethoff, Maxim-Aleksa; Lauer, Anna; Daniliuc, Constantin; Glorius, Frank Metal-free photosensitized radical relay 1,4-carboimination across two distinct olefins Chemical Science, 2023, 14, 2447-2454
1568453	CIF	C8 H2 F3 I3 N	P 1 21/c 1	9.1685; 7.7161; 16.7661 90; 99.439; 90	1170.06	Kumar, Lavanya; Leko, Katarina; Nemec, Vinko; Trzybiński, Damian; Bregović, Nikola; Cinčić, Dominik; Arhangelskis, Mihails Computational evaluation of halogen-bonded cocrystals enables prediction of their mechanochemical interconversion reactions Chemical Science, 2023, 14, 3140-3146
1568454	CIF	C25 H28 B F4 N O2	P 21 21 2	14.3154; 26.4615; 6.2605 90; 90; 90	2371.52	Wu, Fu-Peng; Gu, Xing-Wei; Geng, Hui-Qing; Wu, Xiao-Feng Copper-catalyzed defluorinative arylboration of vinylarenes with polyfluoroarenes Chemical Science, 2023, 14, 2342-2347
1568455	CIF	C33 H26 Au F7 N3 O4 P S2	P -1	8.6133; 14.6051; 15.5136 62.663; 79.227; 82.934	1701.53	Dhara, Ayan; Fadler, Rachel E.; Chen, Yusheng; Köttner, Laura A; Van Craen, David; Carta, Veronica; Flood, Amar H. Orthogonal, modular anion-cation and cation-anion self-assembly using pre-programmed anion binding sites. Chemical science, 2023, 14, 2585-2595
1568456	CIF	C88 H78 Br4 N4 O2 S8	P -1	8.7612; 13.2409; 17.624 93.211; 98.646; 97.221	1999.4	Zhu, Weigang; Li, Guoping; Mukherjee, Subhrangsu; Powers-Riggs, Natalia E.; Jones, Leighton O.; Gann, Eliot; Kline, R. Joseph; Herzing, Andrew; Logsdon, Jenna L.; Flagg, Lucas; Stern, Charlotte L.; Young, Ryan M.; Kohlstedt, Kevin L.; Schatz, George C.; DeLongchamp, Dean M.; Wasielewski, Michael R.; Melkonyan, Ferdinand S.; Facchetti, Antonio; Marks, Tobin J. Quantitative relationships between film morphology, charge carrier dynamics, and photovoltaic performance in bulk-heterojunction binary vs. ternary acceptor blends Energy & Environmental Science, 2023, 16, 1234-1250
1568457	CIF	C19 H13 N3 O8 Pt	I b a m	35.828; 18.4081; 6.6356 90; 90; 90	4376.3	Bryant, Mathew J.; Fuertes, Sara; Hatcher, Lauren E.; Thomas, Lynne H.; Raithby, Paul R. Structural modifications to platinum(II) pincer complexes resulting in changes in their vapochromic and solvatochromic properties. Faraday discussions, 2023, 244, 411-433
1568458	CIF	C19 H13 N3 O Pt	P 1 21/c 1	6.8945; 15.5988; 14.7127 90; 102.975; 90	1541.89	Bryant, Mathew J.; Fuertes, Sara; Hatcher, Lauren E.; Thomas, Lynne H.; Raithby, Paul R. Structural modifications to platinum(II) pincer complexes resulting in changes in their vapochromic and solvatochromic properties. Faraday discussions, 2023, 244, 411-433
1568459	CIF	C41 H32 Cl2 N6 O4 Pt2	P -1	7.273; 11.5993; 21.8397 87.882; 85.973; 83.861	1826.54	Bryant, Mathew J.; Fuertes, Sara; Hatcher, Lauren E.; Thomas, Lynne H.; Raithby, Paul R. Structural modifications to platinum(II) pincer complexes resulting in changes in their vapochromic and solvatochromic properties. Faraday discussions, 2023, 244, 411-433
1568460	CIF	C81 H90 Cl2 Ni5 S10	P -1	16.3158; 17.0494; 17.7725 61.57; 70.355; 68.327	3961.72	Funaki, Sota; Kawawaki, Tokuhisa; Okada, Tomoshige; Takemae, Kana; Hossain, Sakiat; Niihori, Yoshiki; Naito, Takumi; Takagi, Makito; Shimazaki, Tomomi; Kikkawa, Soichi; Yamazoe, Seiji; Tachikawa, Masanori; Negishi, Yuichi Improved activity for the oxygen evolution reaction using a tiara-like thiolate-protected nickel nanocluster. Nanoscale, 2023, 15, 5201-5208
1568461	CIF	C17 H16 O2 S2	P 21 21 21	3.9473; 11.3841; 32.7877 90; 90; 90	1473.36	Mang, André; Rotthowe, Nils; Beltako, Katawoura; Linseis, Michael; Pauly, Fabian; Winter, Rainer F. Single-molecule conductance studies on quasi- and metallaaromatic dibenzoylmethane coordination compounds and their aromatic analogs. Nanoscale, 2023, 15, 5305-5316
1568462	CIF	C25 H27 O2 Rh S2	P n m a	9.4517; 23.2662; 10.4808 90; 90; 90	2304.78	Mang, André; Rotthowe, Nils; Beltako, Katawoura; Linseis, Michael; Pauly, Fabian; Winter, Rainer F. Single-molecule conductance studies on quasi- and metallaaromatic dibenzoylmethane coordination compounds and their aromatic analogs. Nanoscale, 2023, 15, 5305-5316
1568463	CIF	C37 H60 Cl2 O3 P2 Ru S2	P -1	9.9782; 12.4346; 17.8296 73.003; 80.029; 78.029	2054.55	Mang, André; Rotthowe, Nils; Beltako, Katawoura; Linseis, Michael; Pauly, Fabian; Winter, Rainer F. Single-molecule conductance studies on quasi- and metallaaromatic dibenzoylmethane coordination compounds and their aromatic analogs. Nanoscale, 2023, 15, 5305-5316
1568464	CIF	C65 H46 B2 F20 O4 S4	P 1 21/n 1	8.7932; 21.5764; 32.252 90; 95.172; 90	6094.1	Mang, André; Rotthowe, Nils; Beltako, Katawoura; Linseis, Michael; Pauly, Fabian; Winter, Rainer F. Single-molecule conductance studies on quasi- and metallaaromatic dibenzoylmethane coordination compounds and their aromatic analogs. Nanoscale, 2023, 15, 5305-5316
1568465	CIF	C105 Br19 Mn2 N6 Pb3	P -3 1 c	15.233; 15.233; 31.8165 90; 90; 120	6393.7	Zhang, Zhipeng; Liao, Jin-Feng; Xing, Guichuan Regulating the coordination geometry of polyhedra in zero-dimensional metal halides for tunable emission. Nanoscale, 2023, 15, 5241-5248
1568466	CIF	C60 Br19 N6 Pb3 Zn2	P -3 1 c	15.1977; 15.1977; 31.6698 90; 90; 120	6334.78	Zhang, Zhipeng; Liao, Jin-Feng; Xing, Guichuan Regulating the coordination geometry of polyhedra in zero-dimensional metal halides for tunable emission. Nanoscale, 2023, 15, 5241-5248
1568467	CIF	C20 H44 Br4 N2 Pb	C 1 2/c 1	20.4084; 8.4516; 18.5924 90; 122.186; 90	2714.1	Zhang, Zhipeng; Liao, Jin-Feng; Xing, Guichuan Regulating the coordination geometry of polyhedra in zero-dimensional metal halides for tunable emission. Nanoscale, 2023, 15, 5241-5248
1568468	CIF	C16 H21 Al N2	P 1 21/n 1	8.3546; 10.7094; 17.5246 90; 97.648; 90	1554.03	Tang, Jian; Xu, Zijian; Liu, Zelong; Fu, Yuan; Hua, Jing Pyridine-amido aluminum catalyst precursors for 1,3-butadiene transition-metal-free stereospecific polymerization Polymer Chemistry, 2023, 14, 980-989
1568469	CIF	C18 H25 Al N2	P 21 21 21	8.8305; 12.0231; 16.87 90; 90; 90	1791.1	Tang, Jian; Xu, Zijian; Liu, Zelong; Fu, Yuan; Hua, Jing Pyridine-amido aluminum catalyst precursors for 1,3-butadiene transition-metal-free stereospecific polymerization Polymer Chemistry, 2023, 14, 980-989
1568470	CIF	C22 H33 Al N2	P 1 21/n 1	8.6071; 16.636; 15.272 90; 91.136; 90	2186.3	Tang, Jian; Xu, Zijian; Liu, Zelong; Fu, Yuan; Hua, Jing Pyridine-amido aluminum catalyst precursors for 1,3-butadiene transition-metal-free stereospecific polymerization Polymer Chemistry, 2023, 14, 980-989
1568471	CIF	C16 H16 Al F5 N2	P 1 21/n 1	14.4175; 8.7391; 14.9864 90; 110.192; 90	1772.2	Tang, Jian; Xu, Zijian; Liu, Zelong; Fu, Yuan; Hua, Jing Pyridine-amido aluminum catalyst precursors for 1,3-butadiene transition-metal-free stereospecific polymerization Polymer Chemistry, 2023, 14, 980-989
1568472	CIF	C19 H27 Al N2	P 21 21 21	8.0744; 12.6305; 18.8429 90; 90; 90	1921.67	Tang, Jian; Xu, Zijian; Liu, Zelong; Fu, Yuan; Hua, Jing Pyridine-amido aluminum catalyst precursors for 1,3-butadiene transition-metal-free stereospecific polymerization Polymer Chemistry, 2023, 14, 980-989
1568473	CIF	C18 H19 Al F6 N2	P -1	8.5573; 8.8128; 13.3517 87.309; 77.928; 89.453	983.55	Tang, Jian; Xu, Zijian; Liu, Zelong; Fu, Yuan; Hua, Jing Pyridine-amido aluminum catalyst precursors for 1,3-butadiene transition-metal-free stereospecific polymerization Polymer Chemistry, 2023, 14, 980-989
1568474	CIF	C30 H42 N4 O4 S2	P -1	5.177; 10.4037; 15.1011 100.491; 97.244; 96.51	785.58	Yang, Wei; Zhang, Dayong; Yu, Junsheng; Zhang, Qing Carboxamide and carbamate substituted π-conjugated polymers: the effect of hydrogen bonding on photovoltaic properties Polymer Chemistry, 2023, 14, 839-847
1568475	CIF	C60 H82 N8 O4 S4	P -1	5.1062; 15.6416; 18.7651 82.251; 89.811; 86.607	1482.45	Yang, Wei; Zhang, Dayong; Yu, Junsheng; Zhang, Qing Carboxamide and carbamate substituted π-conjugated polymers: the effect of hydrogen bonding on photovoltaic properties Polymer Chemistry, 2023, 14, 839-847
1568476	CIF	C36 H30 B P	P 63 c m	9.8279; 9.8279; 8.0179 90; 90; 120	670.68	Zapf, Ludwig; Riethmann, Melanie; Föhrenbacher, Steffen A.; Finze, Maik; Radius, Udo An easy-to-perform evaluation of steric properties of Lewis acids Chemical Science, 2023, 14, 2275-2288
1568477	CIF	C17 H15 N5 Pd	P 1 21/c 1	10.4114; 8.5418; 17.017 90; 92.924; 90	1511.4	Cemortan, Valeriu; Simler, Thomas; Moutet, Jules; Jaoul, Arnaud; Clavaguéra, Carine; Nocton, Grégory Structure and bonding patterns in heterometallic organometallics with linear Ln–Pd–Ln motifs Chemical Science, 2023, 14, 2676-2685
1568478	CIF	C98 H138 N10 O6 Pd2 Yb2	P -1	14.758; 17.469; 20.212 101.902; 102.431; 113.691	4403	Cemortan, Valeriu; Simler, Thomas; Moutet, Jules; Jaoul, Arnaud; Clavaguéra, Carine; Nocton, Grégory Structure and bonding patterns in heterometallic organometallics with linear Ln–Pd–Ln motifs Chemical Science, 2023, 14, 2676-2685
1568479	CIF	C95 H114 N10 Pd2 Yb2	P 1 21/n 1	14.7945; 34.6792; 17.851 90; 111.427; 90	8525.6	Cemortan, Valeriu; Simler, Thomas; Moutet, Jules; Jaoul, Arnaud; Clavaguéra, Carine; Nocton, Grégory Structure and bonding patterns in heterometallic organometallics with linear Ln–Pd–Ln motifs Chemical Science, 2023, 14, 2676-2685
1568480	CIF	C32 H51 Pd Yb	P 1 21/n 1	8.508; 16.1094; 21.445 90; 91.493; 90	2938.2	Cemortan, Valeriu; Simler, Thomas; Moutet, Jules; Jaoul, Arnaud; Clavaguéra, Carine; Nocton, Grégory Structure and bonding patterns in heterometallic organometallics with linear Ln–Pd–Ln motifs Chemical Science, 2023, 14, 2676-2685
1568481	CIF	C64 H84 N2 Pd Yb2	C 1 2/c 1	15.7166; 13.6208; 26.5397 90; 91.637; 90	5679.1	Cemortan, Valeriu; Simler, Thomas; Moutet, Jules; Jaoul, Arnaud; Clavaguéra, Carine; Nocton, Grégory Structure and bonding patterns in heterometallic organometallics with linear Ln–Pd–Ln motifs Chemical Science, 2023, 14, 2676-2685
1568482	CIF	C64 H84 N2 Pd Sm2	C 1 2/c 1	15.7006; 13.8198; 26.6978 90; 91.602; 90	5790.6	Cemortan, Valeriu; Simler, Thomas; Moutet, Jules; Jaoul, Arnaud; Clavaguéra, Carine; Nocton, Grégory Structure and bonding patterns in heterometallic organometallics with linear Ln–Pd–Ln motifs Chemical Science, 2023, 14, 2676-2685
1568483	CIF	C12 H33 Cu I8 N4 O0.5 Sb	P 1 21/n 1	16.934; 19.721; 18.703 90; 90.809; 90	6245	Li, Qian-Wen; Bi, Le-Yu; Lassoued, Mohamed Saber; Luo, Qian-Cheng; Yan, Rong; Ding, Xin-Kai; Gou, Gao-Yang; Zheng, Yan-Zhen Two-dimensional semiconducting Cu(I)/Sb(III) bimetallic hybrid iodides with a double perovskite structure and photocurrent response. Nanoscale, 2023, 15, 5265-5273
1568484	CIF	C24 H58 Cu I8 N4 O Sb	C 1 2/c 1	32.362; 8.491; 19.599 90; 125.168; 90	4402	Li, Qian-Wen; Bi, Le-Yu; Lassoued, Mohamed Saber; Luo, Qian-Cheng; Yan, Rong; Ding, Xin-Kai; Gou, Gao-Yang; Zheng, Yan-Zhen Two-dimensional semiconducting Cu(I)/Sb(III) bimetallic hybrid iodides with a double perovskite structure and photocurrent response. Nanoscale, 2023, 15, 5265-5273
1568485	CIF	C124 H102 O2	C 1 2/c 1	16.1038; 24.54; 26.56 90; 95.069; 90	10455.1	Li, Shengtao; Li, Ranran; Zhang, Yi-Kang; Wang, Shutao; Ma, Bin; Zhang, Bin; An, Peng BINOL-like atropisomeric chiral nanographene. Chemical science, 2023, 14, 3286-3292
1568486	CIF	C24 H31 N O6	C 1 c 1	22.0386; 13.2446; 11.5475 90; 137.586; 90	2273.4	Li, Longbo; Matsuo, Bianca; Levitre, Guillaume; McClain, Edward J.; Voight, Eric A.; Crane, Erika A.; Molander, Gary A. Dearomative intermolecular [2 + 2] photocycloaddition for construction of C(sp<sup>3</sup>)-rich heterospirocycles on-DNA. Chemical science, 2023, 14, 2713-2720
1568487	CIF	C31 H25 Cl N4 O3 S	P 1 21 1	11.6897; 8.7462; 27.9426 90; 97.984; 90	2829.2	Li, Kuan; Zhen, Shuo; Wang, Wang; Du, Juan; Yu, Songcheng; Wu, Yongjun; Guo, Hongchao Fungicide-inspired precursors of π-allylpalladium intermediates for palladium-catalyzed decarboxylative cycloadditions. Chemical science, 2023, 14, 3024-3029
1568488	CIF	C27 H21 N3 O2	P 1 21 1	8.30066; 8.18447; 16.4485 90; 104.387; 90	1082.41	Li, Kuan; Zhen, Shuo; Wang, Wang; Du, Juan; Yu, Songcheng; Wu, Yongjun; Guo, Hongchao Fungicide-inspired precursors of π-allylpalladium intermediates for palladium-catalyzed decarboxylative cycloadditions. Chemical science, 2023, 14, 3024-3029
1568489	CIF	C27 H25 N3 O2	P 21 21 21	9.7606; 10.331; 21.9651 90; 90; 90	2214.89	Li, Kuan; Zhen, Shuo; Wang, Wang; Du, Juan; Yu, Songcheng; Wu, Yongjun; Guo, Hongchao Fungicide-inspired precursors of π-allylpalladium intermediates for palladium-catalyzed decarboxylative cycloadditions. Chemical science, 2023, 14, 3024-3029
1568490	CIF	C6 Cs2 Mn2 N6 S6	P 1 21/n 1	12.7468; 13.2446; 5.6541 90; 95.839; 90	949.61	Geers, Madeleine; Lee, Jie Yie; Ling, Sanliang; Fabelo, Oscar; Cañadillas-Delgado, Laura; Cliffe, Matthew J. Non-collinear magnetism in the post-perovskite thiocyanate frameworks CsM(NCS)<sub>3</sub>. Chemical science, 2023, 14, 3531-3540
1568491	CIF	C6 Cs2 Mn2 N6 S6	P 1 21/n 1	12.8159; 13.3648; 5.6774 90; 95.999; 90	967.11	Geers, Madeleine; Lee, Jie Yie; Ling, Sanliang; Fabelo, Oscar; Cañadillas-Delgado, Laura; Cliffe, Matthew J. Non-collinear magnetism in the post-perovskite thiocyanate frameworks CsM(NCS)<sub>3</sub>. Chemical science, 2023, 14, 3531-3540
1568492	CIF	C6 Cs2 N6 Ni2 S6	P 1 21/n 1	12.5261; 13.0853; 5.5409 90; 96.56; 90	902.3	Geers, Madeleine; Lee, Jie Yie; Ling, Sanliang; Fabelo, Oscar; Cañadillas-Delgado, Laura; Cliffe, Matthew J. Non-collinear magnetism in the post-perovskite thiocyanate frameworks CsM(NCS)<sub>3</sub>. Chemical science, 2023, 14, 3531-3540
1568493	CIF	C6 Cs2 Mn2 N6 S6	P 1 21/n 1	12.7661; 13.2731; 5.6588 90; 95.9037; 90	953.77	Geers, Madeleine; Lee, Jie Yie; Ling, Sanliang; Fabelo, Oscar; Cañadillas-Delgado, Laura; Cliffe, Matthew J. Non-collinear magnetism in the post-perovskite thiocyanate frameworks CsM(NCS)<sub>3</sub>. Chemical science, 2023, 14, 3531-3540
1568494	CIF	C6 Cs2 Mn2 N6 S6	P 1 21/n 1	12.8136; 13.4916; 5.6692 90; 96.346; 90	974.06	Geers, Madeleine; Lee, Jie Yie; Ling, Sanliang; Fabelo, Oscar; Cañadillas-Delgado, Laura; Cliffe, Matthew J. Non-collinear magnetism in the post-perovskite thiocyanate frameworks CsM(NCS)<sub>3</sub>. Chemical science, 2023, 14, 3531-3540
1568495	CIF	C6 Co2 Cs2 N6 S6	P 1 21/n 1	12.6103; 13.2395; 5.5786 90; 96.445; 90	925.48	Geers, Madeleine; Lee, Jie Yie; Ling, Sanliang; Fabelo, Oscar; Cañadillas-Delgado, Laura; Cliffe, Matthew J. Non-collinear magnetism in the post-perovskite thiocyanate frameworks CsM(NCS)<sub>3</sub>. Chemical science, 2023, 14, 3531-3540
1568496	CIF	C6 Cs2 Mn2 N6 S6	P 1 21/n 1	12.7463; 13.2447; 5.654 90; 95.8382; 90	949.56	Geers, Madeleine; Lee, Jie Yie; Ling, Sanliang; Fabelo, Oscar; Cañadillas-Delgado, Laura; Cliffe, Matthew J. Non-collinear magnetism in the post-perovskite thiocyanate frameworks CsM(NCS)<sub>3</sub>. Chemical science, 2023, 14, 3531-3540
1568497	CIF	C6 Cs2 Mn2 N6 S6	P 1 21/n 1	12.7469; 13.2457; 5.6542 90; 95.8446; 90	949.7	Geers, Madeleine; Lee, Jie Yie; Ling, Sanliang; Fabelo, Oscar; Cañadillas-Delgado, Laura; Cliffe, Matthew J. Non-collinear magnetism in the post-perovskite thiocyanate frameworks CsM(NCS)<sub>3</sub>. Chemical science, 2023, 14, 3531-3540
1568498	CIF	C33 H33 N3 O	P n m a	27.4526; 6.8462; 18.7535 90; 90; 90	3524.6	Miao, Fang; Ji, Yu; Han, Bo; Quintero, Sergio Moles; Chen, Hanjiao; Xue, Guodong; Cai, Lulu; Casado, Juan; Zheng, Yonghao Asymmetric and zwitterionic Blatter diradicals. Chemical science, 2023, 14, 2698-2705
1568499	CIF	C33 H33 N3 O	P 1 21/c 1	15.527; 10.1852; 18.02 90; 108.352; 90	2704.8	Miao, Fang; Ji, Yu; Han, Bo; Quintero, Sergio Moles; Chen, Hanjiao; Xue, Guodong; Cai, Lulu; Casado, Juan; Zheng, Yonghao Asymmetric and zwitterionic Blatter diradicals. Chemical science, 2023, 14, 2698-2705
1568500	CIF	C25 H22 N O4 S2	P 1 21/c 1	8.0803; 17.2484; 16.5592 90; 90.883; 90	2307.6	Zhang, Yan; Cai, Zhenzhi; Zhao, Chunhang; Zheng, Hanliang; Ackermann, Lutz Electrosynthesis of bridged or fused sulfonamides through complex radical cascade reactions: divergence in medium-sized ring formation. Chemical science, 2023, 14, 3541-3547
1568501	CIF	C19 H19 N O4 S2	P 1 21/c 1	23.4887; 5.6869; 14.3647 90; 107.81; 90	1826.8	Zhang, Yan; Cai, Zhenzhi; Zhao, Chunhang; Zheng, Hanliang; Ackermann, Lutz Electrosynthesis of bridged or fused sulfonamides through complex radical cascade reactions: divergence in medium-sized ring formation. Chemical science, 2023, 14, 3541-3547
1568502	CIF	C49 H43 N7	P 1 21/n 1	14.5275; 8.9371; 31.1191 90; 102.802; 90	3939.87	Tripathi, Shivani; Halder, Sayan; Prusti, Banchhanidhi; Chakraborty, Chanchal; Chakravarty, Manab Flexibility-driven 1D-structural preference in a bis-terpyridine-Fe(ii)-metallo-supramolecular polymer possessing potential tricolor electrochromism Polymer Chemistry, 2023, 14, 1359-1368
1568503	CIF	C39.25 H45.25 N14.75 O22.75 V6 Zn	P 1 21/c 1	13.2016; 27.457; 18.236 90; 105.503; 90	6369.6	Palacios-Corella, Mario; García-López, Víctor; Waerenborgh, Joao Carlos; Vieira, Bruno J. C.; Mínguez Espallargas, Guillermo; Clemente-León, Miguel; Coronado, Eugenio Redox and guest tunable spin-crossover properties in a polymeric polyoxometalate. Chemical science, 2023, 14, 3048-3055
1568504	CIF	C60 H64 Co2 N16 O21 V6	P -1	9.8603; 12.1228; 17.2505 79.422; 80.163; 76.369	1952.25	Palacios-Corella, Mario; García-López, Víctor; Waerenborgh, Joao Carlos; Vieira, Bruno J. C.; Mínguez Espallargas, Guillermo; Clemente-León, Miguel; Coronado, Eugenio Redox and guest tunable spin-crossover properties in a polymeric polyoxometalate. Chemical science, 2023, 14, 3048-3055
1568505	CIF	C42 H47 Co N12 O25 V6 Zn	P 1 21/c 1	13.0369; 27.261; 18.467 90; 105.569; 90	6322.3	Palacios-Corella, Mario; García-López, Víctor; Waerenborgh, Joao Carlos; Vieira, Bruno J. C.; Mínguez Espallargas, Guillermo; Clemente-León, Miguel; Coronado, Eugenio Redox and guest tunable spin-crossover properties in a polymeric polyoxometalate. Chemical science, 2023, 14, 3048-3055
1568506	CIF	C72 H120 N16 O23 V6	P 1 21/c 1	17.1948; 15.4967; 18.288 90; 116.713; 90	4352.96	Palacios-Corella, Mario; García-López, Víctor; Waerenborgh, Joao Carlos; Vieira, Bruno J. C.; Mínguez Espallargas, Guillermo; Clemente-León, Miguel; Coronado, Eugenio Redox and guest tunable spin-crossover properties in a polymeric polyoxometalate. Chemical science, 2023, 14, 3048-3055
1568507	CIF	C36 H53 O2 U	P 21 21 21	10.7675; 17.3155; 17.5438 90; 90; 90	3270.95	Ward, Robert J.; Rosal, Iker del; Kelley, Steven P.; Maron, Laurent; Walensky, Justin R. Isolation of C1 through C4 derivatives from CO using heteroleptic uranium(iii) metallocene aryloxide complexes Chemical Science, 2023, 14, 2024-2032
1568508	CIF	C59.95 H82 I0.03 O3.95 U2	P -1	9.4109; 10.8091; 14.131 94.671; 103.949; 92.409	1387.6	Ward, Robert J.; Rosal, Iker del; Kelley, Steven P.; Maron, Laurent; Walensky, Justin R. Isolation of C1 through C4 derivatives from CO using heteroleptic uranium(iii) metallocene aryloxide complexes Chemical Science, 2023, 14, 2024-2032
1568509	CIF	C86 H96 O6 U2	P 1 21/n 1	17.9293; 10.2778; 19.647 90; 101.133; 90	3552.3	Ward, Robert J.; Rosal, Iker del; Kelley, Steven P.; Maron, Laurent; Walensky, Justin R. Isolation of C1 through C4 derivatives from CO using heteroleptic uranium(iii) metallocene aryloxide complexes Chemical Science, 2023, 14, 2024-2032
1568510	CIF	C38 H52 O2 U	P 1 21/c 1	13.266; 16.193; 15.544 90; 97.637; 90	3309.5	Ward, Robert J.; Rosal, Iker del; Kelley, Steven P.; Maron, Laurent; Walensky, Justin R. Isolation of C1 through C4 derivatives from CO using heteroleptic uranium(iii) metallocene aryloxide complexes Chemical Science, 2023, 14, 2024-2032
1568511	CIF	C66 H94 O5 U2	P 1 21/c 1	10.5339; 26.165; 21.8935 90; 90.283; 90	6034.2	Ward, Robert J.; Rosal, Iker del; Kelley, Steven P.; Maron, Laurent; Walensky, Justin R. Isolation of C1 through C4 derivatives from CO using heteroleptic uranium(iii) metallocene aryloxide complexes Chemical Science, 2023, 14, 2024-2032
1568512	CIF	C70.5 H94 O6 S U2	R -3 :H	56.6846; 56.6846; 10.2786 90; 90; 120	28601.9	Ward, Robert J.; Rosal, Iker del; Kelley, Steven P.; Maron, Laurent; Walensky, Justin R. Isolation of C1 through C4 derivatives from CO using heteroleptic uranium(iii) metallocene aryloxide complexes Chemical Science, 2023, 14, 2024-2032
1568513	CIF	C69.5 H90 O7 U2	C 1 2/c 1	43.0997; 14.4756; 20.4007 90; 100.911; 90	12497.8	Ward, Robert J.; Rosal, Iker del; Kelley, Steven P.; Maron, Laurent; Walensky, Justin R. Isolation of C1 through C4 derivatives from CO using heteroleptic uranium(iii) metallocene aryloxide complexes Chemical Science, 2023, 14, 2024-2032
1568514	CIF	C55 H78 N2 O3 Sm	P 1 21 1	13.5817; 14.3505; 13.9019 90; 116.465; 90	2425.6	Hauser, Adrian; Münzfeld, Luca; Schlittenhardt, Sören; Köppe, Ralf; Uhlmann, Cedric; Rauska, Ulf-Christian; Ruben, Mario; Roesky, Peter W. Molecular cyclo-P3 complexes of the rare-earth elements via a one-pot reaction and selective reduction Chemical Science, 2023, 14, 2149-2158
1568515	CIF	C55 H78 N2 O3 Yb	P b c a	18.5124; 15.2519; 35.298 90; 90; 90	9966.4	Hauser, Adrian; Münzfeld, Luca; Schlittenhardt, Sören; Köppe, Ralf; Uhlmann, Cedric; Rauska, Ulf-Christian; Ruben, Mario; Roesky, Peter W. Molecular cyclo-P3 complexes of the rare-earth elements via a one-pot reaction and selective reduction Chemical Science, 2023, 14, 2149-2158
1568516	CIF	C55 H82 B N2 O3 Y	P 1 21/c 1	13.749; 14.0841; 26.9502 90; 98.698; 90	5158.7	Hauser, Adrian; Münzfeld, Luca; Schlittenhardt, Sören; Köppe, Ralf; Uhlmann, Cedric; Rauska, Ulf-Christian; Ruben, Mario; Roesky, Peter W. Molecular cyclo-P3 complexes of the rare-earth elements via a one-pot reaction and selective reduction Chemical Science, 2023, 14, 2149-2158
1568517	CIF	C55 H82 B N2 O3 Sm	P 1 21/c 1	13.8154; 14.2166; 26.9732 90; 99.004; 90	5232.5	Hauser, Adrian; Münzfeld, Luca; Schlittenhardt, Sören; Köppe, Ralf; Uhlmann, Cedric; Rauska, Ulf-Christian; Ruben, Mario; Roesky, Peter W. Molecular cyclo-P3 complexes of the rare-earth elements via a one-pot reaction and selective reduction Chemical Science, 2023, 14, 2149-2158
1568518	CIF	C117 H164 N4 O6 P4 Sm2	P b a n :2	32.7745; 12.3366; 14.1237 90; 90; 90	5710.6	Hauser, Adrian; Münzfeld, Luca; Schlittenhardt, Sören; Köppe, Ralf; Uhlmann, Cedric; Rauska, Ulf-Christian; Ruben, Mario; Roesky, Peter W. Molecular cyclo-P3 complexes of the rare-earth elements via a one-pot reaction and selective reduction Chemical Science, 2023, 14, 2149-2158
1568519	CIF	C114 H164 N4 O7 P4 Yb2	P b a n :2	32.1927; 12.2887; 14.1317 90; 90; 90	5590.6	Hauser, Adrian; Münzfeld, Luca; Schlittenhardt, Sören; Köppe, Ralf; Uhlmann, Cedric; Rauska, Ulf-Christian; Ruben, Mario; Roesky, Peter W. Molecular cyclo-P3 complexes of the rare-earth elements via a one-pot reaction and selective reduction Chemical Science, 2023, 14, 2149-2158
1568520	CIF	C116 H156 K N4 O4 P3 Sm2	C 1 2/c 1	31.686; 23.6758; 16.4497 90; 119.805; 90	10708.1	Hauser, Adrian; Münzfeld, Luca; Schlittenhardt, Sören; Köppe, Ralf; Uhlmann, Cedric; Rauska, Ulf-Christian; Ruben, Mario; Roesky, Peter W. Molecular cyclo-P3 complexes of the rare-earth elements via a one-pot reaction and selective reduction Chemical Science, 2023, 14, 2149-2158
1568521	CIF	C116 H156 Dy2 K N4 O4 P3	C 1 2/c 1	31.3677; 23.7878; 16.3094 90; 119.275; 90	10615.3	Hauser, Adrian; Münzfeld, Luca; Schlittenhardt, Sören; Köppe, Ralf; Uhlmann, Cedric; Rauska, Ulf-Christian; Ruben, Mario; Roesky, Peter W. Molecular cyclo-P3 complexes of the rare-earth elements via a one-pot reaction and selective reduction Chemical Science, 2023, 14, 2149-2158
1568522	CIF	C55 H82 B Dy N2 O3	P 1 21/c 1	13.797; 14.1608; 27.0491 90; 98.959; 90	5220.3	Hauser, Adrian; Münzfeld, Luca; Schlittenhardt, Sören; Köppe, Ralf; Uhlmann, Cedric; Rauska, Ulf-Christian; Ruben, Mario; Roesky, Peter W. Molecular cyclo-P3 complexes of the rare-earth elements via a one-pot reaction and selective reduction Chemical Science, 2023, 14, 2149-2158
1568523	CIF	C116 H156 K N4 O4 P3 Y2	C 1 2/c 1	31.5819; 24.1585; 16.5122 90; 119.726; 90	10940.5	Hauser, Adrian; Münzfeld, Luca; Schlittenhardt, Sören; Köppe, Ralf; Uhlmann, Cedric; Rauska, Ulf-Christian; Ruben, Mario; Roesky, Peter W. Molecular cyclo-P3 complexes of the rare-earth elements via a one-pot reaction and selective reduction Chemical Science, 2023, 14, 2149-2158
1568524	CIF	C22 H24 Ag Cl N2 O4	P n m a	11.4539; 15.5189; 11.6854 90; 90; 90	2077.1	Fahrenhorst-Jones, Tyler; Marshall, David L.; Burns, Jed M.; Pierens, Gregory K.; Hormann, Robert E.; Fisher, Allison M.; Bernhardt, Paul V.; Blanksby, Stephen J.; Savage, G. Paul; Eaton, Philip E.; Williams, Craig M. 1-Azahomocubane. Chemical science, 2023, 14, 2821-2825
1568525	CIF	C9 H8 Br N O	P 1 21/c 1	12.0681; 4.8252; 15.0066 90; 94.654; 90	870.97	Finkelstein, Patrick; Reisenbauer, Julia C.; Botlik, Bence B.; Green, Ori; Florin, Andri; Morandi, Bill Nitrogen atom insertion into indenes to access isoquinolines. Chemical science, 2023, 14, 2954-2959
1568526	CIF	C22 H15 N O	P 1 21/c 1	9.8089; 8.7371; 18.3869 90; 104.498; 90	1525.6	Finkelstein, Patrick; Reisenbauer, Julia C.; Botlik, Bence B.; Green, Ori; Florin, Andri; Morandi, Bill Nitrogen atom insertion into indenes to access isoquinolines. Chemical science, 2023, 14, 2954-2959
1568527	CIF	C13 H28 F3 Fe N5 O5 S	P 1 21/c 1	16.1966; 16.5801; 16.2444 90; 100.654; 90	4287.1	Kulbir, ?; Das, Sandip; Devi, Tarali; Ghosh, Somnath; Chandra Sahoo, Subash; Kumar, Pankaj Acid-induced nitrite reduction of nonheme iron(ii)-nitrite: mimicking biological Fe-NiR reactions. Chemical science, 2023, 14, 2935-2942
1568528	CIF	C16 H31 F6 Fe N6 O7 S2	P 1 21/c 1	11.791; 14.711; 15.692 90; 104.111; 90	2639.8	Kulbir, ?; Das, Sandip; Devi, Tarali; Ghosh, Somnath; Chandra Sahoo, Subash; Kumar, Pankaj Acid-induced nitrite reduction of nonheme iron(ii)-nitrite: mimicking biological Fe-NiR reactions. Chemical science, 2023, 14, 2935-2942
1568529	CIF	C23 H21 N O5	P 1 21/n 1	7.7248; 23.0566; 12.1391 90; 103.515; 90	2102.2	Bakthadoss, Manickam; Reddy, Tadiparthi Thirupathi Distal <i>meta</i>-C-H functionalization of α-substituted cinnamates. Chemical science, 2023, 14, 5880-5886
1568530	CIF	C27 H23 N O5 S	P -1	8.2408; 10.2565; 15.3407 88.527; 77.996; 72.445	1208.25	Bakthadoss, Manickam; Reddy, Tadiparthi Thirupathi Distal <i>meta</i>-C-H functionalization of α-substituted cinnamates. Chemical science, 2023, 14, 5880-5886
1568531	CIF	C24 H20 N2 O5	P 1 21/n 1	10.811; 8.0573; 24.254 90; 92.718; 90	2110.3	Bakthadoss, Manickam; Reddy, Tadiparthi Thirupathi Distal <i>meta</i>-C-H functionalization of α-substituted cinnamates. Chemical science, 2023, 14, 5880-5886
1568532	CIF	C44 H58.03 Cl4.03 Cu6 N12 S6	P -1	9.2167; 13.7793; 23.2892 78.74; 88.981; 86.659	2895.8	Wu, Haiming; Anumula, Rajini; Andrew, Gaya N.; Luo, Zhixun A stable superatomic Cu<sub>6</sub>(SMPP)<sub>6</sub> nanocluster with dual emission. Nanoscale, 2023, 15, 4137-4142
1568533	CIF	C31 H64 La N3 O Si6	P 1 21/n 1	11.6736; 18.459; 20.0226 90; 93.092; 90	4308.25	Rothbaum, Jacob O.; Motta, Alessandro; Kratish, Yosi; Marks, Tobin J. Mechanistic study of homoleptic trisamidolanthanide-catalyzed aldehyde and ketone hydroboration. Chemically non-innocent ligand participation. Chemical science, 2023, 14, 3247-3256
1568534	CIF	C22 H50 La N3 O Si5	P 1 21/c 1	21.1647; 15.1053; 21.1116 90; 90.8294; 90	6748.65	Rothbaum, Jacob O.; Motta, Alessandro; Kratish, Yosi; Marks, Tobin J. Mechanistic study of homoleptic trisamidolanthanide-catalyzed aldehyde and ketone hydroboration. Chemically non-innocent ligand participation. Chemical science, 2023, 14, 3247-3256
1568535	CIF	C55 H140 B6 La2 N4 O8 Si8	C 1 c 1	27.6404; 15.2264; 24.752 90; 123.939; 90	8642.5	Rothbaum, Jacob O.; Motta, Alessandro; Kratish, Yosi; Marks, Tobin J. Mechanistic study of homoleptic trisamidolanthanide-catalyzed aldehyde and ketone hydroboration. Chemically non-innocent ligand participation. Chemical science, 2023, 14, 3247-3256
1568536	CIF	C18 H10 N5 O5 Pb	P -1	8.2616; 9.3161; 10.9658 99.275; 93.184; 96.722	824.85	Kamal, Samrah; Khalid, Mohd; Khan, M. Shahnawaz; Shahid, M.; Ahmad, Musheer A bifunctionalised Pb-based MOF for iodine capture and dye removal Dalton Transactions, 2023, 52, 4501-4516
1568537	CIF	C4 H10 N2 O10 Zn	C 1 c 1	13.678; 7.1156; 9.883 90; 91.07; 90	961.7	Xu, Xin; Yan, Bing Bioinspired HOF-based luminescent skin sensor with triple mechanochromism responses for the recognition and collection of human biophysical signals. Materials horizons, 2023, 10, 2062-2074
1568538	CIF	C13 H12 N2 O	P 1 21/n 1	6.401; 7.613; 22.401 90; 92.679; 90	1090.4	Nan, Jiang; Ren, Xin; Yan, Qiang; Liu, Shilei; Wang, Jing; Ma, Yangmin; Szostak, Michal Hypervalent iodine-promoted twofold oxidative coupling of amines with amides and thioamides: chemoselective pathway to oxazoles and thiazoles. Chemical science, 2023, 14, 3338-3345
1568539	CIF	C24 H18 N2 S2	P 1 21/n 1	7.5785; 19.2356; 13.4588 90; 92.817; 90	1959.6	Nan, Jiang; Ren, Xin; Yan, Qiang; Liu, Shilei; Wang, Jing; Ma, Yangmin; Szostak, Michal Hypervalent iodine-promoted twofold oxidative coupling of amines with amides and thioamides: chemoselective pathway to oxazoles and thiazoles. Chemical science, 2023, 14, 3338-3345
1568540	CIF	C23 H30 O7 Si	P b c a	18.2041; 12.7693; 19.5076 90; 90; 90	4534.6	Kerkovius, Jeff; Wong, Alice; Mak, Victor; Reisman, Sarah E. A convergent fragment coupling strategy to access quaternary stereogenic centers Chemical Science, 2023
1568541	CIF	C9 H0 La0.67 N O4 S	P -3	16.454; 16.454; 9.7316 90; 90; 120	2281.7	Zhao, Xu; Sun, Lu; Zhai, Zhouxiao; Tian, Di; Wang, Ying; Zou, Xiaoqin; Min, Chungang; Zhuang, Changfu An ultrastable La-MOF for catalytic hydrogen transfer of furfural: <i>in situ</i> activation of the surface. Nanoscale, 2023, 15, 6645-6654
1568542	CIF	C8 H9 Br N2 O2	P c c n	13.263; 24.954; 5.6399 90; 90; 90	1866.6	Ji, Peng; Meng, Xiang; Chen, Jing; Gao, Feng; Xu, Hang; Wang, Wei Combining photoredox catalysis and hydrogen atom transfer for dearomative functionalization of electron rich heteroarenes. Chemical science, 2023, 14, 3332-3337
1568543	CIF	C25 H21 N O4 S	P 1 21 1	9.1898; 7.9984; 14.9186 90; 94.829; 90	1092.68	Zhou, Ji-Jia; Meng, Ya-Nan; Liu, Li-Gao; Liu, Yi-Xi; Xu, Zhou; Lu, Xin; Zhou, Bo; Ye, Long-Wu Copper-catalyzed enantioselective diyne cyclization <i>via</i> C(sp<sup>2</sup>)-O bond cleavage. Chemical science, 2023, 14, 3493-3500
1568544	CIF	C50 H56 N14 O12 S2 Zn	C 1 2/c 1	45.81; 9.357; 34.484 90; 129.632; 90	11384	Feng, Zhihui; Zhang, Dongxue; Guo, Hui; Su, Wenqing; Tian, Yupeng; Tian, Xiaohe Lighting up RNA-specific multi-photon and super-resolution imaging using a novel zinc complex. Nanoscale, 2023, 15, 5486-5493
1568545	CIF	C54 H36 O8	P 1 21/n 1	9.6319; 26.669; 18.8824 90; 94.412; 90	4836	Wang, Ning; Feng, Hui-Wei; Hao, Xinhui; Cao, Yang; Xu, Xing-Dong; Feng, Shengyu Dynamic covalent bond and metal coordination bond-cross-linked silicone elastomers with excellent mechanical and aggregation-induced emission properties Polymer Chemistry, 2023, 14, 1396-1403
1568546	CIF	C66 H64 N4 O4	P -1	9.3439; 17.753; 18.6225 83.662; 76.429; 87.119	2983.6	Wang, Ning; Feng, Hui-Wei; Hao, Xinhui; Cao, Yang; Xu, Xing-Dong; Feng, Shengyu Dynamic covalent bond and metal coordination bond-cross-linked silicone elastomers with excellent mechanical and aggregation-induced emission properties Polymer Chemistry, 2023, 14, 1396-1403
1568547	CIF	C18 H13 Cl N O2 P S	P 1 21/n 1	9.2183; 34.7939; 10.2564 90; 91.784; 90	3288.05	König, Nils; Godínez-Loyola, Yokari; Yang, Fangshun; Laube, Christian; Laue, Michael; Lönnecke, Peter; Strassert, Cristian A.; Hey-Hawkins, Evamarie Facile modification of phosphole-based aggregation-induced emission luminogens with sulfonyl isocyanates Chemical Science, 2023, 14, 2267-2274
1568548	CIF	C26 H19 Cl N O2 P S	P b c a	15.6906; 14.9491; 18.9271 90; 90; 90	4439.55	König, Nils; Godínez-Loyola, Yokari; Yang, Fangshun; Laube, Christian; Laue, Michael; Lönnecke, Peter; Strassert, Cristian A.; Hey-Hawkins, Evamarie Facile modification of phosphole-based aggregation-induced emission luminogens with sulfonyl isocyanates Chemical Science, 2023, 14, 2267-2274
1568549	CIF	C25 H20 N O2 P S	P b c a	17.9194; 12.2042; 18.6576 90; 90; 90	4080.27	König, Nils; Godínez-Loyola, Yokari; Yang, Fangshun; Laube, Christian; Laue, Michael; Lönnecke, Peter; Strassert, Cristian A.; Hey-Hawkins, Evamarie Facile modification of phosphole-based aggregation-induced emission luminogens with sulfonyl isocyanates Chemical Science, 2023, 14, 2267-2274
1568550	CIF	C41 H32 N O2 P S	P n a 21	50.1288; 10.1911; 18.7459 90; 90; 90	9576.7	König, Nils; Godínez-Loyola, Yokari; Yang, Fangshun; Laube, Christian; Laue, Michael; Lönnecke, Peter; Strassert, Cristian A.; Hey-Hawkins, Evamarie Facile modification of phosphole-based aggregation-induced emission luminogens with sulfonyl isocyanates Chemical Science, 2023, 14, 2267-2274
1568551	CIF	C25 H22 N O2 P S	P -1	8.8731; 10.5634; 12.9478 106.562; 99.86; 107.702	1063.05	König, Nils; Godínez-Loyola, Yokari; Yang, Fangshun; Laube, Christian; Laue, Michael; Lönnecke, Peter; Strassert, Cristian A.; Hey-Hawkins, Evamarie Facile modification of phosphole-based aggregation-induced emission luminogens with sulfonyl isocyanates Chemical Science, 2023, 14, 2267-2274
1568552	CIF	C29 H24 N O2 P S	P 1 21/n 1	11.1666; 17.1521; 12.847 90; 103.054; 90	2397.01	König, Nils; Godínez-Loyola, Yokari; Yang, Fangshun; Laube, Christian; Laue, Michael; Lönnecke, Peter; Strassert, Cristian A.; Hey-Hawkins, Evamarie Facile modification of phosphole-based aggregation-induced emission luminogens with sulfonyl isocyanates Chemical Science, 2023, 14, 2267-2274
1568553	CIF	C33 H26 N O2 P S	P 1 21/c 1	15.6578; 11.5015; 15.1026 90; 101.945; 90	2660.91	König, Nils; Godínez-Loyola, Yokari; Yang, Fangshun; Laube, Christian; Laue, Michael; Lönnecke, Peter; Strassert, Cristian A.; Hey-Hawkins, Evamarie Facile modification of phosphole-based aggregation-induced emission luminogens with sulfonyl isocyanates Chemical Science, 2023, 14, 2267-2274
1568554	CIF	C23 H18.5 Cl N1.5 O2 P S	C 1 c 1	8.0545; 27.2503; 18.9144 90; 91.813; 90	4149.4	König, Nils; Godínez-Loyola, Yokari; Yang, Fangshun; Laube, Christian; Laue, Michael; Lönnecke, Peter; Strassert, Cristian A.; Hey-Hawkins, Evamarie Facile modification of phosphole-based aggregation-induced emission luminogens with sulfonyl isocyanates Chemical Science, 2023, 14, 2267-2274
1568555	CIF	C34 H25 Cl N O2 P S	P 1 21/c 1	16.434; 15.6804; 22.1748 90; 92.558; 90	5708.57	König, Nils; Godínez-Loyola, Yokari; Yang, Fangshun; Laube, Christian; Laue, Michael; Lönnecke, Peter; Strassert, Cristian A.; Hey-Hawkins, Evamarie Facile modification of phosphole-based aggregation-induced emission luminogens with sulfonyl isocyanates Chemical Science, 2023, 14, 2267-2274
1568556	CIF	C20 H24 O4	P 1 21 1	7.73185; 5.91229; 19.8978 90; 92.4788; 90	908.736	Xu, Qi; Lu, Chuan-Jun; Guo, Chang-Qiu; Feng, Jia; Liu, Ren-Rong Palladium-catalyzed enantioselective rearrangement of dienyl cyclopropanes. Chemical science, 2023, 14, 3346-3351
1568557	CIF	C43 H46 B1.5 Cu1.5 F6 N8 O2	C 1 2/c 1	29.3549; 14.3817; 21.2892 90; 106.304; 90	8626.3	Kim, Heechan; Shin, Juhwan; Kim, Seyong; Lee, Dongwhan Helical fluxionality: numerical frustration drives concerted low-barrier screw motions of a tricopper cluster. Chemical science, 2023, 14, 3265-3269
1568558	CIF	C114 H158 Ag12 Au5 F12 O14 P13 S14	P 1 21/c 1	30.034; 27.879; 18.1905 90; 97.624; 90	15097	Liao, Jian-Hong; Chiu, Tzu-Hao; Liang, Hao; Kahlal, Samia; Saillard, Jean-Yves; Liu, C. W. Galvanic replacement-induced introduction of a heteroligand into bimetallic and trimetallic nanoclusters. Nanoscale, 2023, 15, 6121-6125
1568559	CIF	C114 H158 Ag10.75 Au4.25 O14 P11 Pt S14	P -1	15.878; 17.651; 27.489 89.453; 84.379; 70.43	7222	Liao, Jian-Hong; Chiu, Tzu-Hao; Liang, Hao; Kahlal, Samia; Saillard, Jean-Yves; Liu, C. W. Galvanic replacement-induced introduction of a heteroligand into bimetallic and trimetallic nanoclusters. Nanoscale, 2023, 15, 6121-6125
1568560	CIF	C16 H24 I N3 O5 Ru	P b c a	14.031; 14.473; 19.564 90; 90; 90	3973	Colaiezzi, Roberta; Saviozzi, Chiara; di Nicola, Nicola; Zacchini, Stefano; Pampaloni, Guido; Crucianelli, Marcello; Marchetti, Fabio; Di Giuseppe, Andrea; Biancalana, Lorenzo Ruthenium(ii) arene complexes bearing simple dioxime ligands: effective catalysts for the one-pot transfer hydrogenation/N-methylation of nitroarenes with methanol Catalysis Science & Technology, 2023, 13, 2160-2183
1568561	CIF	C16 H28 Cl N3 O6 Ru	P c a 21	10.1596; 11.7047; 16.363 90; 90; 90	1945.8	Colaiezzi, Roberta; Saviozzi, Chiara; di Nicola, Nicola; Zacchini, Stefano; Pampaloni, Guido; Crucianelli, Marcello; Marchetti, Fabio; Di Giuseppe, Andrea; Biancalana, Lorenzo Ruthenium(ii) arene complexes bearing simple dioxime ligands: effective catalysts for the one-pot transfer hydrogenation/N-methylation of nitroarenes with methanol Catalysis Science & Technology, 2023, 13, 2160-2183
1568562	CIF	C16 H28 Cl N2 O3.5 Ru	P 1 21/c 1	15.4589; 13.1592; 17.7332 90; 98.356; 90	3569.1	Colaiezzi, Roberta; Saviozzi, Chiara; di Nicola, Nicola; Zacchini, Stefano; Pampaloni, Guido; Crucianelli, Marcello; Marchetti, Fabio; Di Giuseppe, Andrea; Biancalana, Lorenzo Ruthenium(ii) arene complexes bearing simple dioxime ligands: effective catalysts for the one-pot transfer hydrogenation/N-methylation of nitroarenes with methanol Catalysis Science & Technology, 2023, 13, 2160-2183
1568563	CIF	C53 H56 B Cl4 N3	P -1	11.4044; 11.659; 18.3508 77.642; 77.549; 83.582	2321.88	Zou, Yang; Yu, Mingxin; Miao, Jingsheng; Huang, Taian; Liao, Shuokun; Cao, Xiaosong; Yang, Chuluo Dynamic bond interactions fine-tune the properties of multiple resonance emitters towards highly efficient narrowband green OLEDs. Chemical science, 2023, 14, 3326-3331
1568564	CIF	C53 H56 B Cl4 N3	P 1 21/c 1	29.338; 11.2565; 16.2958 90; 90.366; 90	5381.5	Zou, Yang; Yu, Mingxin; Miao, Jingsheng; Huang, Taian; Liao, Shuokun; Cao, Xiaosong; Yang, Chuluo Dynamic bond interactions fine-tune the properties of multiple resonance emitters towards highly efficient narrowband green OLEDs. Chemical science, 2023, 14, 3326-3331
1568565	CIF	C350 H336 N62 O71 Se2	P -1	27.1355; 29.0697; 33.4936 67.428; 80.522; 62.942	21724.7	Menke, Friedericke S.; Wicher, Barbara; Allmendinger, Lars; Maurizot, Victor; Huc, Ivan An abiotic, tetrameric, eight-helix bundle. Chemical science, 2023, 14, 3742-3751
1568566	CIF	C42 H60 B2 K2 O6	P -1	9.5281; 11.0226; 11.2386 102.796; 97.883; 112.732	1028.54	Prey, Sven E.; Gilmer, Jannik; Teichmann, Samira V.; Čaić, Luis; Wenisch, Mischa; Bolte, Michael; Virovets, Alexander; Lerner, Hans-Wolfram; Fantuzzi, Felipe; Wagner, Matthias Synthesis, bridgehead functionalization, and photoisomerization of 9,10-diboratatriptycene dianions. Chemical science, 2023, 14, 5316-5322
1568567	CIF	C30 H44 B2 K2 O6	P 21 21 21	12.8057; 14.5978; 17.7056 90; 90; 90	3309.8	Prey, Sven E.; Gilmer, Jannik; Teichmann, Samira V.; Čaić, Luis; Wenisch, Mischa; Bolte, Michael; Virovets, Alexander; Lerner, Hans-Wolfram; Fantuzzi, Felipe; Wagner, Matthias Synthesis, bridgehead functionalization, and photoisomerization of 9,10-diboratatriptycene dianions. Chemical science, 2023, 14, 5316-5322
1568568	CIF	C23 H26 B2 Cl2 S2	P 1 21/n 1	12.793; 10.3041; 18.528 90; 108.578; 90	2315.1	Prey, Sven E.; Gilmer, Jannik; Teichmann, Samira V.; Čaić, Luis; Wenisch, Mischa; Bolte, Michael; Virovets, Alexander; Lerner, Hans-Wolfram; Fantuzzi, Felipe; Wagner, Matthias Synthesis, bridgehead functionalization, and photoisomerization of 9,10-diboratatriptycene dianions. Chemical science, 2023, 14, 5316-5322
1568569	CIF	C28 H34 B2 I Li O2	P -1	8.4929; 9.7032; 16.0667 85.041; 82.312; 84.756	1302.94	Prey, Sven E.; Gilmer, Jannik; Teichmann, Samira V.; Čaić, Luis; Wenisch, Mischa; Bolte, Michael; Virovets, Alexander; Lerner, Hans-Wolfram; Fantuzzi, Felipe; Wagner, Matthias Synthesis, bridgehead functionalization, and photoisomerization of 9,10-diboratatriptycene dianions. Chemical science, 2023, 14, 5316-5322
1568570	CIF	C48 H64 B2 K2 O6	P 1 21/n 1	9.451; 27.0259; 18.235 90; 102.177; 90	4552.8	Prey, Sven E.; Gilmer, Jannik; Teichmann, Samira V.; Čaić, Luis; Wenisch, Mischa; Bolte, Michael; Virovets, Alexander; Lerner, Hans-Wolfram; Fantuzzi, Felipe; Wagner, Matthias Synthesis, bridgehead functionalization, and photoisomerization of 9,10-diboratatriptycene dianions. Chemical science, 2023, 14, 5316-5322
1568571	CIF	C23 H33 O3.5	P c c n	36.4809; 14.42217; 7.54283 90; 90; 90	3968.54	Chong, Chuanke; Chang, Le; Grimm, Isabelle; Zhang, Qunlong; Kuang, Yang; Wang, Bingjian; Kang, Jingyi; Liu, Wenhui; Baars, Julian; Guo, Yuanqiang; Schmalz, Hans-Günther; Lu, Zhaoyong Divergent total synthesis of the revised structures of marine anti-cancer meroterpenoids (+)-dysiherbols A-E. Chemical science, 2023, 14, 3302-3310
1568572	CIF	C21 H26 O3	P b c a	7.46953; 17.2423; 25.6766 90; 90; 90	3306.94	Chong, Chuanke; Chang, Le; Grimm, Isabelle; Zhang, Qunlong; Kuang, Yang; Wang, Bingjian; Kang, Jingyi; Liu, Wenhui; Baars, Julian; Guo, Yuanqiang; Schmalz, Hans-Günther; Lu, Zhaoyong Divergent total synthesis of the revised structures of marine anti-cancer meroterpenoids (+)-dysiherbols A-E. Chemical science, 2023, 14, 3302-3310
1568573	CIF	C23 H30 O2	C 1 c 1	9.6931; 25.8093; 7.4931 90; 102.745; 90	1828.38	Chong, Chuanke; Chang, Le; Grimm, Isabelle; Zhang, Qunlong; Kuang, Yang; Wang, Bingjian; Kang, Jingyi; Liu, Wenhui; Baars, Julian; Guo, Yuanqiang; Schmalz, Hans-Günther; Lu, Zhaoyong Divergent total synthesis of the revised structures of marine anti-cancer meroterpenoids (+)-dysiherbols A-E. Chemical science, 2023, 14, 3302-3310
1568574	CIF	C21 H28 O3	P 1 21/c 1	13.3523; 7.5495; 16.8408 90; 98.785; 90	1677.69	Chong, Chuanke; Chang, Le; Grimm, Isabelle; Zhang, Qunlong; Kuang, Yang; Wang, Bingjian; Kang, Jingyi; Liu, Wenhui; Baars, Julian; Guo, Yuanqiang; Schmalz, Hans-Günther; Lu, Zhaoyong Divergent total synthesis of the revised structures of marine anti-cancer meroterpenoids (+)-dysiherbols A-E. Chemical science, 2023, 14, 3302-3310
1568575	CIF	C23 H30 O3	P 21 21 21	9.484; 13.8807; 14.0827 90; 90; 90	1853.91	Chong, Chuanke; Chang, Le; Grimm, Isabelle; Zhang, Qunlong; Kuang, Yang; Wang, Bingjian; Kang, Jingyi; Liu, Wenhui; Baars, Julian; Guo, Yuanqiang; Schmalz, Hans-Günther; Lu, Zhaoyong Divergent total synthesis of the revised structures of marine anti-cancer meroterpenoids (+)-dysiherbols A-E. Chemical science, 2023, 14, 3302-3310
1568576	CIF	C10 H10 N2 S6 Zn	C 1 2/c 1	13.6639; 9.0204; 14.8989 90; 115.024; 90	1664	Zhou, Pan-Ke; Lin, Xiao-Li; Chee, Mun Yin; Lew, Wen Siang; Zeng, Tao; Li, Hao-Hong; Chen, Xiong; Chen, Zhi-Rong; Zheng, Hui-Dong Switching the memory behaviour from binary to ternary by triggering S<sub>6</sub><sup>2-</sup> relaxation in polysulfide-bearing zinc-organic complex molecular memories. Materials horizons, 2023, 10, 2535-2541
1568577	CIF	C12 H8 N2 S6 Zn	P -1	8.1617; 9.4765; 12.0105 109.535; 99.066; 100.714	835.64	Zhou, Pan-Ke; Lin, Xiao-Li; Chee, Mun Yin; Lew, Wen Siang; Zeng, Tao; Li, Hao-Hong; Chen, Xiong; Chen, Zhi-Rong; Zheng, Hui-Dong Switching the memory behaviour from binary to ternary by triggering S<sub>6</sub><sup>2-</sup> relaxation in polysulfide-bearing zinc-organic complex molecular memories. Materials horizons, 2023, 10, 2535-2541
1568578	CIF	C12 H14 N2 S6 Zn	P -1	9.175; 9.797; 11.3263 83.744; 75.751; 62.164	872.6	Zhou, Pan-Ke; Lin, Xiao-Li; Chee, Mun Yin; Lew, Wen Siang; Zeng, Tao; Li, Hao-Hong; Chen, Xiong; Chen, Zhi-Rong; Zheng, Hui-Dong Switching the memory behaviour from binary to ternary by triggering S<sub>6</sub><sup>2-</sup> relaxation in polysulfide-bearing zinc-organic complex molecular memories. Materials horizons, 2023, 10, 2535-2541
1568579	CIF	C10 H8 N2 S6 Zn	C 1 2/c 1	18.958; 7.3171; 22.257 90; 101.81; 90	3022.1	Zhou, Pan-Ke; Lin, Xiao-Li; Chee, Mun Yin; Lew, Wen Siang; Zeng, Tao; Li, Hao-Hong; Chen, Xiong; Chen, Zhi-Rong; Zheng, Hui-Dong Switching the memory behaviour from binary to ternary by triggering S<sub>6</sub><sup>2-</sup> relaxation in polysulfide-bearing zinc-organic complex molecular memories. Materials horizons, 2023, 10, 2535-2541
1568580	CIF	C30 H28 N2	P -1	8.916; 11.0941; 12.5663 94.783; 103.724; 107.064	1138.58	Viana, Maria S.; Gomes, Clara S. B.; Rosa, Vitor Heteroleptic Copper Complexes as Catalysts for the CuAAC Reaction: Counter-Ion Influence in Catalyst Efficiency Catalysts, 2023, 13, 386
1568581	CIF	C63 H52 B Cl2 Cu F4 N2 P2	P b c a	17.4954; 23.7716; 26.188 90; 90; 90	10891.4	Viana, Maria S.; Gomes, Clara S. B.; Rosa, Vitor Heteroleptic Copper Complexes as Catalysts for the CuAAC Reaction: Counter-Ion Influence in Catalyst Efficiency Catalysts, 2023, 13, 386
1568582	CIF	C63 H50 Cu F3 N2 O3 P2 S	P -1	15.2564; 16.0253; 23.0757 90.355; 93.137; 98.235	5574.6	Viana, Maria S.; Gomes, Clara S. B.; Rosa, Vitor Heteroleptic Copper Complexes as Catalysts for the CuAAC Reaction: Counter-Ion Influence in Catalyst Efficiency Catalysts, 2023, 13, 386
1568583	CIF	C63 H51 Cl3 Cu N3 O3 P2	P 1 21/c 1	16.7053; 14.7608; 22.8229 90; 95.361; 90	5603.1	Viana, Maria S.; Gomes, Clara S. B.; Rosa, Vitor Heteroleptic Copper Complexes as Catalysts for the CuAAC Reaction: Counter-Ion Influence in Catalyst Efficiency Catalysts, 2023, 13, 386
1568584	CIF	C67 H59 Cl3 Cu N3 O3 P2	P b c a	17.979; 24.99; 27.167 90; 90; 90	12206	Viana, Maria S.; Gomes, Clara S. B.; Rosa, Vitor Heteroleptic Copper Complexes as Catalysts for the CuAAC Reaction: Counter-Ion Influence in Catalyst Efficiency Catalysts, 2023, 13, 386
1568585	CIF	C69 H61 Cl9 Cu N3 O3 P2	P 41	13.2253; 13.2253; 40.325 90; 90; 90	7053.2	Viana, Maria S.; Gomes, Clara S. B.; Rosa, Vitor Heteroleptic Copper Complexes as Catalysts for the CuAAC Reaction: Counter-Ion Influence in Catalyst Efficiency Catalysts, 2023, 13, 386
1568586	CIF	In O3 Tb	P 63 c m	6.3088; 6.3088; 12.3067 90; 90; 120	424.195	Min, Chang; Wu, You; Li, Yanbin; Zhou, Chunming; Cheong, Sang-Wook; Lu, Xiaosong; Zhou, Tianyuan; Zhang, Le Structural and Improper Ferroelectric Properties of TbInO3 Single Crystal Grown by Laser Floating Zone Crystals, 2023, 13, 287
1568587	CIF	Cl2 Cu H4 O2	P m n a	8.0553; 3.7295; 7.3674 90; 90; 90	221.333	Boeré, René T. Crystal Structures of CuCl2·2H2O (Eriochalcite) and NiCl2∙6H2O (Nickelbischofite) at Low Temperature: Full Refinement of Hydrogen Atoms Using Non-Spherical Atomic Scattering Factors Crystals, 2023, 13, 293
1568588	CIF	Cl2 Cu H4 O2	P m n a	8.0405; 3.7238; 7.3585 90; 90; 90	220.32	Boeré, René T. Crystal Structures of CuCl2·2H2O (Eriochalcite) and NiCl2∙6H2O (Nickelbischofite) at Low Temperature: Full Refinement of Hydrogen Atoms Using Non-Spherical Atomic Scattering Factors Crystals, 2023, 13, 293
1568589	CIF	Cl2 H12 Ni O6	I 1 2/m 1	6.5628; 7.033; 8.7326 90; 96.723; 90	400.29	Boeré, René T. Crystal Structures of CuCl2·2H2O (Eriochalcite) and NiCl2∙6H2O (Nickelbischofite) at Low Temperature: Full Refinement of Hydrogen Atoms Using Non-Spherical Atomic Scattering Factors Crystals, 2023, 13, 293
1568590	CIF	Cl2 H12 Ni O6	I 1 2/m 1	6.5579; 7.0244; 8.7291 90; 96.702; 90	399.36	Boeré, René T. Crystal Structures of CuCl2·2H2O (Eriochalcite) and NiCl2∙6H2O (Nickelbischofite) at Low Temperature: Full Refinement of Hydrogen Atoms Using Non-Spherical Atomic Scattering Factors Crystals, 2023, 13, 293
1568591	CIF	C10 H18 Ca O5	P -1	5.8633; 6.8363; 16.0587 79.338; 81.318; 82.834	622.21	Lopresti, Mattia; Milanesio, Marco; Palin, Luca The Crystal Structure of Calcium Sebacate by X-ray Powder Diffraction Data Crystals, 2023, 13, 261
1568592	CIF	C6 H5 N O2	C 1 2/c 1	21.211; 3.7625; 13.9555 90; 107.653; 90	1061.29	Baptista, Diogo S.; Piedade, M. Fátima M.; Esteves, Catarina V. Solubility and Crystallization Studies of Picolinic Acid Crystals, 2023, 13, 392
1568593	CIF	C96 H110 Cl42 Mo18 O97	P 1	17.8167; 17.9076; 19.7519 116.936; 116.807; 90.012	4846	Ivanov, Anton A.; Abramov, Pavel A.; Haouas, Mohamed; Molard, Yann; Cordier, Stéphane; Falaise, Clément; Cadot, Emmanuel; Shestopalov, Michael A. Supramolecular Host–Guest Assemblies of [M6Cl14]2–, M = Mo, W, Clusters with γ-Cyclodextrin for the Development of CLUSPOMs Inorganics, 2023, 11, 77
1568594	CIF	C144 H168 Cl14 Mo6 O140	P 4 21 2	23.806; 23.806; 22.831 90; 90; 90	12938.9	Ivanov, Anton A.; Abramov, Pavel A.; Haouas, Mohamed; Molard, Yann; Cordier, Stéphane; Falaise, Clément; Cadot, Emmanuel; Shestopalov, Michael A. Supramolecular Host–Guest Assemblies of [M6Cl14]2–, M = Mo, W, Clusters with γ-Cyclodextrin for the Development of CLUSPOMs Inorganics, 2023, 11, 77
1568595	CIF	C192 H224 Cl42 O189.6 W18	I 4 2 2	35.7254; 35.7254; 34.3472 90; 90; 90	43837.5	Ivanov, Anton A.; Abramov, Pavel A.; Haouas, Mohamed; Molard, Yann; Cordier, Stéphane; Falaise, Clément; Cadot, Emmanuel; Shestopalov, Michael A. Supramolecular Host–Guest Assemblies of [M6Cl14]2–, M = Mo, W, Clusters with γ-Cyclodextrin for the Development of CLUSPOMs Inorganics, 2023, 11, 77
1568596	CIF	C27 H36 Br2 Mo5 N18 O2 Se5	C 2 2 21	15.632; 25.5634; 12.2766 90; 90; 90	4905.8	Savina, Iulia V.; Ivanov, Anton A.; Evtushok, Darya V.; Gayfulin, Yakov M.; Komarovskikh, Andrey Y.; Syrokvashin, Mikhail M.; Ivanova, Mariia N.; Asanov, Igor P.; Eltsov, Ilia V.; Kuratieva, Natalia V.; Mironov, Yuri V.; Shestopalov, Michael A. Unusual Square Pyramidal Chalcogenide Mo<sub>5</sub> Cluster with Bridging Pyrazolate-Ligands. International journal of molecular sciences, 2023, 24, 3440
1568597	CIF	C39 H48 Br Mo5 N26 Se5	P 4/n :2	15.6443; 15.6443; 11.3058 90; 90; 90	2767.03	Savina, Iulia V.; Ivanov, Anton A.; Evtushok, Darya V.; Gayfulin, Yakov M.; Komarovskikh, Andrey Y.; Syrokvashin, Mikhail M.; Ivanova, Mariia N.; Asanov, Igor P.; Eltsov, Ilia V.; Kuratieva, Natalia V.; Mironov, Yuri V.; Shestopalov, Michael A. Unusual Square Pyramidal Chalcogenide Mo<sub>5</sub> Cluster with Bridging Pyrazolate-Ligands. International journal of molecular sciences, 2023, 24, 3440
1568598	CIF	Fe16 O128 P12 S4	P 1	13.3722; 13.3488; 21.585 92.345; 90.153; 120.34	3321.3	Mauro, Daniela; Biagioni, Cristian New Crystal-Structure Data on Bohuslavite, Fe3+4(PO4)3(SO4)(OH)(H2O)10·nH2O Minerals, 2023, 13, 286
1568599	CIF	C12 H9 N5	I 1 2/a 1	20.845; 4.6353; 22.7163 90; 107.329; 90	2095.29	Ershov, Ivan S.; Esikov, Kirill A.; Nesterova, Olga M.; Skryl’nikova, Mariya A.; Khramchikhin, Andrey V.; Shmaneva, Nadezda T.; Chernov, Ivan S.; Chernova, Ekaterina N.; Puzyk, Aleksandra M.; Sivtsov, Eugene V.; Pavlyukova, Yuliya N.; Trifonov, Rostislav E.; Ostrovskii, Vladimir A. 3-(5-Phenyl-2H-tetrazol-2-yl)pyridine Molbank, 2023, 2023, M1598
1568600	CIF	C22 H16 Mn N2 O4 S2	P -1	10.5007; 10.5738; 11.029 102.277; 91.709; 117.108	1053.76	Dubskikh, Vadim A.; Kolosov, Aleksei A.; Lysova, Anna A.; Samsonenko, Denis G.; Lavrov, Alexander N.; Kovalenko, Konstantin A.; Dybtsev, Danil N.; Fedin, Vladimir P. A Series of Metal–Organic Frameworks with 2,2′-Bipyridyl Derivatives: Synthesis vs. Structure Relationships, Adsorption, and Magnetic Studies Molecules, 2023, 28, 2139
1568601	CIF	C62 H40 Mn3 N4 O12 S6	P 1 21/c 1	10.88; 25.477; 12.919 90; 109.29; 90	3380	Dubskikh, Vadim A.; Kolosov, Aleksei A.; Lysova, Anna A.; Samsonenko, Denis G.; Lavrov, Alexander N.; Kovalenko, Konstantin A.; Dybtsev, Danil N.; Fedin, Vladimir P. A Series of Metal–Organic Frameworks with 2,2′-Bipyridyl Derivatives: Synthesis vs. Structure Relationships, Adsorption, and Magnetic Studies Molecules, 2023, 28, 2139
1568602	CIF	C34.5 H26.5 Mn2 N3.5 O9.5 S4	P 1 2/c 1	16.206; 11.501; 22.561 90; 107.876; 90	4002	Dubskikh, Vadim A.; Kolosov, Aleksei A.; Lysova, Anna A.; Samsonenko, Denis G.; Lavrov, Alexander N.; Kovalenko, Konstantin A.; Dybtsev, Danil N.; Fedin, Vladimir P. A Series of Metal–Organic Frameworks with 2,2′-Bipyridyl Derivatives: Synthesis vs. Structure Relationships, Adsorption, and Magnetic Studies Molecules, 2023, 28, 2139
1568603	CIF	C38 H34 Mn2 N4 O10 S4	P 1 21/n 1	14.9591; 17.085; 17.8936 90; 104.678; 90	4423.9	Dubskikh, Vadim A.; Kolosov, Aleksei A.; Lysova, Anna A.; Samsonenko, Denis G.; Lavrov, Alexander N.; Kovalenko, Konstantin A.; Dybtsev, Danil N.; Fedin, Vladimir P. A Series of Metal–Organic Frameworks with 2,2′-Bipyridyl Derivatives: Synthesis vs. Structure Relationships, Adsorption, and Magnetic Studies Molecules, 2023, 28, 2139
1568604	CIF	C69 H71 Mn3 N9 O17 S6	P 1 21/n 1	16.4304; 25.1354; 18.4058 90; 94.705; 90	7575.7	Dubskikh, Vadim A.; Kolosov, Aleksei A.; Lysova, Anna A.; Samsonenko, Denis G.; Lavrov, Alexander N.; Kovalenko, Konstantin A.; Dybtsev, Danil N.; Fedin, Vladimir P. A Series of Metal–Organic Frameworks with 2,2′-Bipyridyl Derivatives: Synthesis vs. Structure Relationships, Adsorption, and Magnetic Studies Molecules, 2023, 28, 2139
1568605	CIF	C62 H56 Mn3 N8 O16 S6	P 1 21/c 1	10.9298; 25.5452; 13.0284 90; 111.044; 90	3395	Dubskikh, Vadim A.; Kolosov, Aleksei A.; Lysova, Anna A.; Samsonenko, Denis G.; Lavrov, Alexander N.; Kovalenko, Konstantin A.; Dybtsev, Danil N.; Fedin, Vladimir P. A Series of Metal–Organic Frameworks with 2,2′-Bipyridyl Derivatives: Synthesis vs. Structure Relationships, Adsorption, and Magnetic Studies Molecules, 2023, 28, 2139
1568606	CIF	C13 H8 Br N S	P 1 21/n 1	3.9619; 24.465; 12.6409 90; 96.409; 90	1217.6	Ye, Dongnai; Liu, Lei; Zhang, Yujie; Qiu, Jiabin; Tan, Zhirong; Xing, Yuqin; Liu, Shiyong Tunable Donor–Acceptor Linear Conjugated Polymers Involving Cyanostyrylthiophene Linkages for Visible-Light-Driven Hydrogen Production Molecules, 2023, 28, 2203
1568607	CIF	C20 H21 O7	P 1	8.78; 8.92; 11.62 84.56; 81.25; 76.39	872.6	Mathew, Shintu; Zhang, Kenneth; Zhou, Xian; Münch, Gerald; Bodkin, Francis; Li, Feng; Raju, Ritesh Myrtinols A–F: New Anti-Inflammatory Peltogynoid Flavonoid Derivatives from the Leaves of Australian Indigenous Plant Backhousia myrtifolia Molecules, 2023, 28, 2160
1568608	CIF	C44 H32 Fe N8 O4	P 1 21/c 1	9.8772; 9.1364; 20.2948 90; 103.341; 90	1782.02	Li, Qing; Xu, Bo-Wei; Zou, Yi-Ming; Niu, Ru-Jie; Chen, Jin-Xiang; Zhang, Wen-Hua; Young, David James. Nanoscale Two-Dimensional FeII- and CoII-Based Metal–Organic Frameworks of Porphyrin Ligand for the Photodynamic Therapy of Breast Cancer Molecules, 2023, 28, 2125
1568609	CIF	C23 H49 B10 N O2	P 1 21/n 1	10.2162; 15.0449; 19.1173 90; 90.438; 90	2938.28	Klyukin, Ilya N.; Kolbunova, Anastasia V.; Novikov, Alexander S.; Nelyubin, Alexey V.; Zhdanov, Andrey P.; Kubasov, Alexey S.; Selivanov, Nikita A.; Bykov, Alexander Yu; Zhizhin, Konstantin Yu; Kuznetsov, Nikolay T. Synthesis of Disubstituted Carboxonium Derivatives of <i>Closo</i>-Decaborate Anion [2,6-B<sub>10</sub>H<sub>8</sub>O<sub>2</sub>CC<sub>6</sub>H<sub>5</sub>]<sup>-</sup>: Theoretical and Experimental Study. Molecules (Basel, Switzerland), 2023, 28, 1757
1568610	CIF	C112 H70 N8 O59 Y8	P -4 21 m	33.7993; 33.7993; 7.9398 90; 90; 90	9070.4	Li, Juan; Wang, Airong; Qiu, Shiming; Wang, Xiaoli; Li, Jiaming A 12-Connected [Y<sub>4</sub>((<i>μ</i><sub>3</sub>-OH)<sub>4</sub>]<sup>8+</sup> Cluster-Based Luminescent Metal-Organic Framework for Selective Turn-on Detection of F<sup>-</sup> in H<sub>2</sub>O. Molecules (Basel, Switzerland), 2023, 28, 1893
1568611	CIF	C18 H8 Br Cl F2 O3	P -1	8.3118; 8.452; 12.0667 80.772; 79.03; 72.149	787.41	Linde, Sif T.; Corti, Vasco; Lauridsen, Vibeke H.; Lamhauge, Johannes N.; Jørgensen, Karl Anker; Rezayee, Nomaan M. Atroposelective brominations to access chiral biaryl scaffolds using high-valent Pd-catalysis. Chemical science, 2023, 14, 3676-3681
1568612	CIF	C9.714 H9.143 Br1.143 O1.143	P 21 21 21	10.6752; 11.971; 12.2865 90; 90; 90	1570.13	Linde, Sif T.; Corti, Vasco; Lauridsen, Vibeke H.; Lamhauge, Johannes N.; Jørgensen, Karl Anker; Rezayee, Nomaan M. Atroposelective brominations to access chiral biaryl scaffolds using high-valent Pd-catalysis. Chemical science, 2023, 14, 3676-3681
1568613	CIF	Cl12 Cs4 Mo2 Na2	F m -3 m	10.4129; 10.4129; 10.4129 90; 90; 90	1129.06	Binwal, Devesh Chandra; Mudoi, Prashurya Pritam; Panda, Debendra Prasad; Vishnoi, Pratap Molybdenum chloride double perovskites: dimensionality control of optical and magnetic properties. Chemical science, 2023, 14, 3982-3989
1568614	CIF	C2 H12 Ag Cl6 Mo N2	P -3 m 1	7.3359; 7.3359; 6.8017 90; 90; 120	316.997	Binwal, Devesh Chandra; Mudoi, Prashurya Pritam; Panda, Debendra Prasad; Vishnoi, Pratap Molybdenum chloride double perovskites: dimensionality control of optical and magnetic properties. Chemical science, 2023, 14, 3982-3989
1568615	CIF	C8 H28 Ag Cl8 Mo N4	P -1	7.636; 7.671; 9.789 80.191; 88.082; 89.402	564.7	Binwal, Devesh Chandra; Mudoi, Prashurya Pritam; Panda, Debendra Prasad; Vishnoi, Pratap Molybdenum chloride double perovskites: dimensionality control of optical and magnetic properties. Chemical science, 2023, 14, 3982-3989
1568616	CIF	C8 H28 Ag Cl8 Mo N4	P -1	7.6668; 7.7072; 9.449 102.229; 91.183; 90.127	545.54	Binwal, Devesh Chandra; Mudoi, Prashurya Pritam; Panda, Debendra Prasad; Vishnoi, Pratap Molybdenum chloride double perovskites: dimensionality control of optical and magnetic properties. Chemical science, 2023, 14, 3982-3989
1568617	CIF	C4 H24 Cl7 Mo N4	P 1 2/n 1	16.0647; 7.3477; 16.1264 90; 103.599; 90	1850.17	Binwal, Devesh Chandra; Mudoi, Prashurya Pritam; Panda, Debendra Prasad; Vishnoi, Pratap Molybdenum chloride double perovskites: dimensionality control of optical and magnetic properties. Chemical science, 2023, 14, 3982-3989
1568618	CIF	C18 H22 Au B Cl F N6 O2 W	P 1 21/c 1	11.6629; 10.2338; 20.6113 90; 105.744; 90	2367.8	Manzano, Richard A.; Hill, Anthony F. Fluorocarbyne complexes <i>via</i> electrophilic fluorination of carbido ligands. Chemical science, 2023, 14, 3776-3781
1568619	CIF	C18 H22 B F Mo N6 O2	P 1 21/c 1	7.9256; 13.8329; 19.194 90; 96.493; 90	2090.82	Manzano, Richard A.; Hill, Anthony F. Fluorocarbyne complexes <i>via</i> electrophilic fluorination of carbido ligands. Chemical science, 2023, 14, 3776-3781
1568620	CIF	C90 H51 B3 Br6	P 1	10.2031; 11.8054; 16.122 74.925; 89.781; 89.984	1875.08	Guo, Jing; Zhang, Kaihua; Wang, Yanpei; Wei, Haipeng; Xiao, Wang; Yang, Kun; Zeng, Zebing Fully-fused boron-doped olympicenes: modular synthesis, tunable optoelectronic properties, and one-electron reduction. Chemical science, 2023, 14, 4158-4165
1568621	CIF	C37 H22 B Br2 Cl3	P -1	9.6748; 10.1293; 17.5132 97.089; 94.219; 117.91	1488.08	Guo, Jing; Zhang, Kaihua; Wang, Yanpei; Wei, Haipeng; Xiao, Wang; Yang, Kun; Zeng, Zebing Fully-fused boron-doped olympicenes: modular synthesis, tunable optoelectronic properties, and one-electron reduction. Chemical science, 2023, 14, 4158-4165
1568622	CIF	C68 H86 B2 N6	P -1	9.3498; 11.4321; 15.5813 69.242; 84.549; 77.162	1518.2	Dai, Yuyang; Xie, Zhuofeng; Bao, Manling; Liu, Chunmeng; Su, Yuanting Multiple stable redox states and tunable ground states <i>via</i> the marriage of viologens and Chichibabin's hydrocarbon. Chemical science, 2023, 14, 3548-3553
1568623	CIF	C62 H80 B2 F6 N6 Sb	P -1	9.7065; 10.4206; 16.6116 73.769; 73.502; 79.487	1537.1	Dai, Yuyang; Xie, Zhuofeng; Bao, Manling; Liu, Chunmeng; Su, Yuanting Multiple stable redox states and tunable ground states <i>via</i> the marriage of viologens and Chichibabin's hydrocarbon. Chemical science, 2023, 14, 3548-3553
1568624	CIF	C66 H88 B2 N6	C 1 2/c 1	32.041; 12.9784; 16.7286 90; 117.642; 90	6162.5	Dai, Yuyang; Xie, Zhuofeng; Bao, Manling; Liu, Chunmeng; Su, Yuanting Multiple stable redox states and tunable ground states <i>via</i> the marriage of viologens and Chichibabin's hydrocarbon. Chemical science, 2023, 14, 3548-3553
1568625	CIF	C108 H96 Al2 B2 F72 N6 O8	P 1 21/c 1	24.71; 21.2756; 24.7191 90; 98.219; 90	12861.9	Dai, Yuyang; Xie, Zhuofeng; Bao, Manling; Liu, Chunmeng; Su, Yuanting Multiple stable redox states and tunable ground states <i>via</i> the marriage of viologens and Chichibabin's hydrocarbon. Chemical science, 2023, 14, 3548-3553
1568626	CIF	C27 H20 Co O5 P2	F d d 2	41.7016; 15.1215; 19.8592 90; 90; 90	12523	Huang, Weiheng; Jackstell, Ralf; Spannenberg, Anke; Beller, Matthias An improved cobalt-catalysed alkoxycarbonylation of olefins using secondary phosphine oxide promotors Catalysis Science & Technology, 2023, 13, 2475-2479
1568627	CIF	C58 H46 N2 O6 S2	P 1 21/c 1	13.3238; 20.1104; 16.9292 90; 96.463; 90	4507.3	Kawai, Yuya; Nogami, Juntaro; Nagashima, Yuki; Tanaka, Ken Stereoselective synthesis of [2.2]triphenylenophanes <i>via</i> intramolecular double [2 + 2 + 2] cycloadditions. Chemical science, 2023, 14, 3963-3972
1568628	CIF	C70 H52 O2	P 1 21/c 1	12.9227; 24.0368; 17.132 90; 97.506; 90	5275.9	Kawai, Yuya; Nogami, Juntaro; Nagashima, Yuki; Tanaka, Ken Stereoselective synthesis of [2.2]triphenylenophanes <i>via</i> intramolecular double [2 + 2 + 2] cycloadditions. Chemical science, 2023, 14, 3963-3972
1568629	CIF	C26 H32 N4 Pd	P 21 21 21	8.9688; 15.8749; 16.3925 90; 90; 90	2333.94	Bouley, Bailey S.; Tang, Fengzhi; Bae, Dae Young; Mirica, Liviu M. C-H bond activation <i>via</i> concerted metalation-deprotonation at a palladium(iii) center. Chemical science, 2023, 14, 3800-3808
1568630	CIF	C30 H38 Cl2 N6 O8 Pd	P m n 21	17.1932; 11.4548; 8.6473 90; 90; 90	1703.04	Bouley, Bailey S.; Tang, Fengzhi; Bae, Dae Young; Mirica, Liviu M. C-H bond activation <i>via</i> concerted metalation-deprotonation at a palladium(iii) center. Chemical science, 2023, 14, 3800-3808
1568631	CIF	C34 H51 Cl3 Li N4 O11 Pd	P 1 21/c 1	14.0733; 18.7386; 15.869 90; 109.564; 90	3943.3	Bouley, Bailey S.; Tang, Fengzhi; Bae, Dae Young; Mirica, Liviu M. C-H bond activation <i>via</i> concerted metalation-deprotonation at a palladium(iii) center. Chemical science, 2023, 14, 3800-3808
1568632	CIF	C28 H35 Cl N5 O4 Pd	P 21 21 21	11.34; 12.2808; 20.326 90; 90; 90	2830.7	Bouley, Bailey S.; Tang, Fengzhi; Bae, Dae Young; Mirica, Liviu M. C-H bond activation <i>via</i> concerted metalation-deprotonation at a palladium(iii) center. Chemical science, 2023, 14, 3800-3808
1568633	CIF	C26 H33 Cl N4 Pd	P 1 21/c 1	8.7777; 30.6361; 9.7205 90; 113.69; 90	2393.71	Bouley, Bailey S.; Tang, Fengzhi; Bae, Dae Young; Mirica, Liviu M. C-H bond activation <i>via</i> concerted metalation-deprotonation at a palladium(iii) center. Chemical science, 2023, 14, 3800-3808
1568634	CIF	C16 H27 Br2 Fe P5	P 1 21/c 1	13.3548; 14.7155; 11.9066 90; 105.491; 90	2254.91	Reichl, Stephan; Balázs, Gábor; Scheer, Manfred Novel synthetic route for (parent) phosphetanes, phospholanes, phosphinanes and phosphepanes. Chemical science, 2023, 14, 3834-3838
1568635	CIF	C15 H25 Fe P5	P 21 21 21	9.1712; 14.2201; 14.903 90; 90; 90	1943.58	Reichl, Stephan; Balázs, Gábor; Scheer, Manfred Novel synthetic route for (parent) phosphetanes, phospholanes, phosphinanes and phosphepanes. Chemical science, 2023, 14, 3834-3838
1568636	CIF	C14 H23 Fe P5	P -1	9.4353; 13.7981; 15.3668 69.087; 77.735; 89.91	1820.09	Reichl, Stephan; Balázs, Gábor; Scheer, Manfred Novel synthetic route for (parent) phosphetanes, phospholanes, phosphinanes and phosphepanes. Chemical science, 2023, 14, 3834-3838
1568637	CIF	C13 H21 Fe P5	P 21 21 21	8.4755; 8.8421; 22.8473 90; 90; 90	1712.2	Reichl, Stephan; Balázs, Gábor; Scheer, Manfred Novel synthetic route for (parent) phosphetanes, phospholanes, phosphinanes and phosphepanes. Chemical science, 2023, 14, 3834-3838

First | Previous 300 | of 37 | Next 300 | Last | Display 5 20 50 100 200 300 500 1000 entries per page