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COD ID	Links	Formula	Space group	Cell parameters	Cell volume	Bibliography
5000392	CIF	C30 H27 F S3 Si	P 1 21/c 1	10.3293; 17.0485; 15.3155 90; 109.324; 90	2545.1	Dell, Steven; Ho, Douglas M.; Pascal, Jr., Robert A. in- and out-Cyclophanes Bearing Non-Hydrogen Bridgehead Substituents The Journal of Organic Chemistry, 1999, 64, 5626-5633
5000390	CIF	C21 H21 F Si	P 1 21/c 1	16.6635; 7.8104; 14.4375 90; 101.079; 90	1844	Dell, Steven; Ho, Douglas M.; Pascal, Jr., Robert A. in- and out-Cyclophanes Bearing Non-Hydrogen Bridgehead Substituents The Journal of Organic Chemistry, 1999, 64, 5626-5633
5000264	CIF	C25 H40 O8	P 1 21 1	11.816; 10.294; 21.255 90; 107.6; 90	2464.31	Roussis, Vassilios; Wu, Zhongde; Fenical, William; Strobel, Scott A.; Van Duyne, Gregory D.; Clardy, Jon New anti-inflammatory pseudopterosins from the marine octocoral Pseudopterogorgia elisabethae Journal of Organic Chemistry, 1990, 55, 4916-4922
5000248	CIF	C23 H31 Br O3	P 1 21 1	8.545; 10.639; 11.994 90; 100.42; 90	1072.4	Djura, Peter; Stierle, Donald B.; Sullivan, Brian; Faulkner, D. John; Arnold, Edward V.; Clardy, Jon Some metabolites of the marine sponges Smenospongia aurea and Smenospongia (Polyfibrospongia) echina Journal of Organic Chemistry, 1980, 45, 1435-1441}
5000245	CIF	C25 H40 O5	P 1 21 1	11.553; 9.759; 11.9 90; 114.56; 90	1220.29	Capon, Robert J.; MacLeod, John K.; Willis, Anthony C. Trunculins A and B, norsesterterpene cyclic peroxides from a marine sponge, Latrunculia brevis Journal of Organic Chemistry, 1987, 52, 339-342
5000243	CIF	C19 H20 O7	P -1	5.635; 10.53; 15.448 74.78; 82.51; 89.59	876.58	Fahy, Eoin; Andersen, Raymond J.; Xu, Chang Fu; Clardy, Jon Annulins A and B, metabolites of the marine hydroid Garveia annulata The Journal of Organic Chemistry, 1986, 51, 5145-5148
5000239	CIF	C33 H50 O7	P 21 21 21	7.5059; 14.199; 28.7786 90; 90; 90	3067.12	Jiménez, Jorge I.; Yoshida, Wesley Y.; Scheuer, Paul J.; Lobkovsky, Emil; Clardy, Jon; Kelly, Michelle Honulactones: New Bishomoscalarane Sesterterpenes from the Indonesian Sponge Strepsichordaia aliena Journal of Organic Chemistry, 2000, 65, 6837-6840
4039027	CIF HKL	C28 H46 N2 O7	I 1 2 1	12.8992; 6.1645; 35.2338 90; 100.471; 90	2755.03	Garsi, Jean-Baptiste; Aguiar, Pedro M.; Berger, Gilles; Maris, Thierry; Hanessian, Stephen Pseudodiproline (Pro-Cyp) Oligomers Fold into Helical Polyproline Type secondary structures Journal of Organic Chemistry, 2024, 89, 4283-4293
4039025	CIF HKL	C6 H10 N4	P 1 21/c 1	7.7694; 5.5029; 7.4694 90; 101.064; 90	313.41	Johann O. E. Sosoe; Cédric Malveau; Thierry Maris; Radu Iftimie; James D. Wuest Refreshing the Legacy of Rudolf Nietzki: Benzene-1,2,4,5-tetramine and Related Compounds Journal of Organic Chemistry, 2023, 88, 16302-16314
4039024	CIF HKL	C6 H10 Cl2 N4	P 1 21/n 1	5.3141; 7.3724; 11.3921 90; 99.436; 90	440.28	Johann O. E. Sosoe; Cédric Malveau; Thierry Maris; Radu Iftimie; James D. Wuest Refreshing the Legacy of Rudolf Nietzki: Benzene-1,2,4,5-tetramine and Related Compounds Journal of Organic Chemistry, 2023, 88, 16302-16314
4039023	CIF HKL	C6 H8 N4	P n a 21	10.7151; 7.784; 7.291 90; 90; 90	608.12	Johann O. E. Sosoe; Cédric Malveau; Thierry Maris; Radu Iftimie; James D. Wuest Refreshing the Legacy of Rudolf Nietzki: Benzene-1,2,4,5-tetramine and Related Compounds Journal of Organic Chemistry, 2023, 88, 16302-16314
4039022	CIF HKL	C6 H14 Cl4 N4	P n n m	8.0533; 9.6682; 7.3499 90; 90; 90	572.27	Johann O. E. Sosoe; Cédric Malveau; Thierry Maris; Radu Iftimie; James D. Wuest Refreshing the Legacy of Rudolf Nietzki: Benzene-1,2,4,5-tetramine and Related Compounds Journal of Organic Chemistry, 2023, 88, 16302-16314
4039021	CIF HKL	C6 H12 Cl2 N4	P 1 21/c 1	9.4236; 14.5883; 9.7872 90; 94.083; 90	1342.07	Johann O. E. Sosoe; Cédric Malveau; Thierry Maris; Radu Iftimie; James D. Wuest Refreshing the Legacy of Rudolf Nietzki: Benzene-1,2,4,5-tetramine and Related Compounds Journal of Organic Chemistry, 2023, 88, 16302-16314
4039014	CIF HKL	C22 H18 Br4 O4	C 1 2/m 1	19.8053; 6.3558; 9.0498 90; 109.266; 90	1075.38	Néron, Sébastien; Morency, Mathieu; Malveau, Cédric; Maris, Thierry; Iftimie, Radu; Wuest, James D. Diphenoquinhydrones and Related Hydrogen-Bonded Charge-Transfer Complexes The Journal of organic chemistry, 2022, 87, 15796-15805
4039013	CIF HKL	C22 H18 Cl4 O4	C 1 2/m 1	19.7264; 6.2955; 8.8067 90; 110.054; 90	1027.37	Néron, Sébastien; Morency, Mathieu; Malveau, Cédric; Maris, Thierry; Iftimie, Radu; Wuest, James D. Diphenoquinhydrones and Related Hydrogen-Bonded Charge-Transfer Complexes The Journal of organic chemistry, 2022, 87, 15796-15805
4039012	CIF HKL	C14 H11 Br2 O2	P -1	7.8307; 8.1915; 10.2693 75.078; 76.037; 85.769	617.66	Néron, Sébastien; Morency, Mathieu; Malveau, Cédric; Maris, Thierry; Iftimie, Radu; Wuest, James D. Diphenoquinhydrones and Related Hydrogen-Bonded Charge-Transfer Complexes The Journal of organic chemistry, 2022, 87, 15796-15805
4039011	CIF HKL	C28 H22 Cl4 O4	P -1	7.7126; 8.7927; 10.319 97.989; 102.763; 115.573	593.39	Néron, Sébastien; Morency, Mathieu; Malveau, Cédric; Maris, Thierry; Iftimie, Radu; Wuest, James D. Diphenoquinhydrones and Related Hydrogen-Bonded Charge-Transfer Complexes The Journal of organic chemistry, 2022, 87, 15796-15805
4039010	CIF HKL	C16 H17 O2	P -1	3.9361; 8.1328; 10.09 103.215; 98.917; 94.489	308.46	Néron, Sébastien; Morency, Mathieu; Malveau, Cédric; Maris, Thierry; Iftimie, Radu; Wuest, James D. Diphenoquinhydrones and Related Hydrogen-Bonded Charge-Transfer Complexes The Journal of organic chemistry, 2022, 87, 15796-15805
4039009	CIF HKL	C22 H28 O2	P b c a	9.9404; 12.579; 15.1193 90; 90; 90	1890.52	Néron, Sébastien; Morency, Mathieu; Chen, Liguo; Maris, Thierry; Rocherfort, Dominic; Iftimie, Radu; Wuest, James D. Diphenoquinone Redux Journal of Organic Chemistry, 2022, 87, 7673-7695
4039008	CIF HKL	C16 H16 O2	P 1 21/n 1	5.576; 10.2185; 10.9447 90; 90.06; 90	623.61	Néron, Sébastien; Morency, Mathieu; Chen, Liguo; Maris, Thierry; Rocherfort, Dominic; Iftimie, Radu; Wuest, James D. Diphenoquinone Redux Journal of Organic Chemistry, 2022, 87, 7673-7695
4039007	CIF HKL	C16 H16 O2	P 1 21/n 1	5.1591; 11.0703; 10.7115 90; 95.006; 90	609.43	Néron, Sébastien; Morency, Mathieu; Chen, Liguo; Maris, Thierry; Rocherfort, Dominic; Iftimie, Radu; Wuest, James D. Diphenoquinone Redux Journal of Organic Chemistry, 2022, 87, 7673-7695
4039006	CIF HKL	C16 H18 O2	P 1 21/c 1	6.9048; 4.6436; 19.7929 90; 99.258; 90	626.36	Néron, Sébastien; Morency, Mathieu; Chen, Liguo; Maris, Thierry; Rocherfort, Dominic; Iftimie, Radu; Wuest, James D. Diphenoquinone Redux Journal of Organic Chemistry, 2022, 87, 7673-7695
4039005	CIF HKL	C12 H4 Cl4 O2	P -1	7.4617; 10.9134; 11.5066 81.561; 74.206; 83.191	888.83	Néron, Sébastien; Morency, Mathieu; Chen, Liguo; Maris, Thierry; Rocherfort, Dominic; Iftimie, Radu; Wuest, James D. Diphenoquinone Redux Journal of Organic Chemistry, 2022, 87, 7673-7695
4039004	CIF HKL	C12 H4 Br4 O2	P 1 21/n 1	4.8559; 10.7212; 12.4441 90; 98.773; 90	640.27	Néron, Sébastien; Morency, Mathieu; Chen, Liguo; Maris, Thierry; Rocherfort, Dominic; Iftimie, Radu; Wuest, James D. Diphenoquinone Redux Journal of Organic Chemistry, 2022, 87, 7673-7695
4039003	CIF HKL	C13 H10 O2	P n m a	9.4974; 20.7529; 4.8353 90; 90; 90	953.03	Néron, Sébastien; Morency, Mathieu; Chen, Liguo; Maris, Thierry; Rocherfort, Dominic; Iftimie, Radu; Wuest, James D. Diphenoquinone Redux Journal of Organic Chemistry, 2022, 87, 7673-7695
4039002	CIF HKL	C12 H8 O2	P 1 21/c 1	3.7666; 11.9321; 9.487 90; 90.18; 90	426.38	Néron, Sébastien; Morency, Mathieu; Chen, Liguo; Maris, Thierry; Rocherfort, Dominic; Iftimie, Radu; Wuest, James D. Diphenoquinone Redux Journal of Organic Chemistry, 2022, 87, 7673-7695
4039001	CIF HKL	C16 H16 O6	P 1 21/n 1	3.8692; 13.0002; 13.4342 90; 92.021; 90	675.32	Néron, Sébastien; Morency, Mathieu; Chen, Liguo; Maris, Thierry; Rocherfort, Dominic; Iftimie, Radu; Wuest, James D. Diphenoquinone Redux Journal of Organic Chemistry, 2022, 87, 7673-7695
4039000	CIF HKL	C25 H12 O4	P b c a	12.955; 9.0569; 30.47 90; 90; 90	3575.1	Néron, Sébastien; Morency, Mathieu; Chen, Liguo; Maris, Thierry; Rocherfort, Dominic; Iftimie, Radu; Wuest, James D. Diphenoquinone Redux Journal of Organic Chemistry, 2022, 87, 7673-7695
4038999	CIF HKL	C25 H12 O4	P b c a	12.8587; 8.9635; 30.2132 90; 90; 90	3482.34	Néron, Sébastien; Morency, Mathieu; Chen, Liguo; Maris, Thierry; Rocherfort, Dominic; Iftimie, Radu; Wuest, James D. Diphenoquinone Redux Journal of Organic Chemistry, 2022, 87, 7673-7695
4038998	CIF HKL	C25.5 H20 O5.5	C 2 2 21	18.3893; 18.6897; 12.66 90; 90; 90	4351.12	Néron, Sébastien; Morency, Mathieu; Chen, Liguo; Maris, Thierry; Rocherfort, Dominic; Iftimie, Radu; Wuest, James D. Diphenoquinone Redux Journal of Organic Chemistry, 2022, 87, 7673-7695
4038997	CIF HKL	C8 H4 N8	P 1 21 1	7.4796; 5.1345; 11.9958 90; 104.155; 90	446.699	Numez Avila, Aaron Gabriel; Deschênes-Simard, Benoît; Arnold, Joseph E.; Morency, Mathieu; Chartrand, Daniel; Maris, Thierry; Berger, Gilles; Day, Graham M.; Hanessian, Stephen; Wuest, James D. Surprising Chemistry of 6.Azidotetrazolo[5,1.a]phthalazine: What a Purported Natural Product Reveals about the Polymorphism of Explosives Journal of Organic Chemistry, 2022, 87, 6680-6694
4038996	CIF HKL	C8 H4 N8	P 1 21/c 1	6.1658; 17.1862; 8.8111 90; 102.164; 90	912.72	Numez Avila, Aaron Gabriel; Deschênes-Simard, Benoît; Arnold, Joseph E.; Morency, Mathieu; Chartrand, Daniel; Maris, Thierry; Berger, Gilles; Day, Graham M.; Hanessian, Stephen; Wuest, James D. Surprising Chemistry of 6.Azidotetrazolo[5,1.a]phthalazine: What a Purported Natural Product Reveals about the Polymorphism of Explosives Journal of Organic Chemistry, 2022, 87, 6680-6694
4038995	CIF HKL	C8 H4 N8	F d d 2	20.2505; 33.1064; 5.3773 90; 90; 90	3605.1	Numez Avila, Aaron Gabriel; Deschênes-Simard, Benoît; Arnold, Joseph E.; Morency, Mathieu; Chartrand, Daniel; Maris, Thierry; Berger, Gilles; Day, Graham M.; Hanessian, Stephen; Wuest, James D. Surprising Chemistry of 6.Azidotetrazolo[5,1.a]phthalazine: What a Purported Natural Product Reveals about the Polymorphism of Explosives Journal of Organic Chemistry, 2022, 87, 6680-6694
4038994	CIF HKL	C8 H4 N8	P 1 21/c 1	8.3082; 13.8805; 8.052 90; 100.967; 90	911.61	Numez Avila, Aaron Gabriel; Deschênes-Simard, Benoît; Arnold, Joseph E.; Morency, Mathieu; Chartrand, Daniel; Maris, Thierry; Berger, Gilles; Day, Graham M.; Hanessian, Stephen; Wuest, James D. Surprising Chemistry of 6.Azidotetrazolo[5,1.a]phthalazine: What a Purported Natural Product Reveals about the Polymorphism of Explosives Journal of Organic Chemistry, 2022, 87, 6680-6694
4038993	CIF HKL	C8 H4 N8	P 1 21 1	4.9733; 12.1827; 14.5857 90; 92.319; 90	883	Numez Avila, Aaron Gabriel; Deschênes-Simard, Benoît; Arnold, Joseph E.; Morency, Mathieu; Chartrand, Daniel; Maris, Thierry; Berger, Gilles; Day, Graham M.; Hanessian, Stephen; Wuest, James D. Surprising Chemistry of 6.Azidotetrazolo[5,1.a]phthalazine: What a Purported Natural Product Reveals about the Polymorphism of Explosives Journal of Organic Chemistry, 2022, 87, 6680-6694
4038992	CIF HKL	C8 H4 N8	P 1 21/c 1	16.423; 17.1344; 25.7615 90; 97.989; 90	7178.9	Numez Avila, Aaron Gabriel; Deschênes-Simard, Benoît; Arnold, Joseph E.; Morency, Mathieu; Chartrand, Daniel; Maris, Thierry; Berger, Gilles; Day, Graham M.; Hanessian, Stephen; Wuest, James D. Surprising Chemistry of 6.Azidotetrazolo[5,1.a]phthalazine: What a Purported Natural Product Reveals about the Polymorphism of Explosives Journal of Organic Chemistry, 2022, 87, 6680-6694
4038991	CIF HKL	C8 H4 N8	P -1	16.4145; 17.1201; 19.7351 76.729; 85.855; 89.965	5383	Numez Avila, Aaron Gabriel; Deschênes-Simard, Benoît; Arnold, Joseph E.; Morency, Mathieu; Chartrand, Daniel; Maris, Thierry; Berger, Gilles; Day, Graham M.; Hanessian, Stephen; Wuest, James D. Surprising Chemistry of 6.Azidotetrazolo[5,1.a]phthalazine: What a Purported Natural Product Reveals about the Polymorphism of Explosives Journal of Organic Chemistry, 2022, 87, 6680-6694
4038990	CIF HKL	C8 H4 N8	P 21 21 21	4.9738; 12.2716; 14.6059 90; 90; 90	891.49	Numez Avila, Aaron Gabriel; Deschênes-Simard, Benoît; Arnold, Joseph E.; Morency, Mathieu; Chartrand, Daniel; Maris, Thierry; Berger, Gilles; Day, Graham M.; Hanessian, Stephen; Wuest, James D. Surprising Chemistry of 6.Azidotetrazolo[5,1.a]phthalazine: What a Purported Natural Product Reveals about the Polymorphism of Explosives Journal of Organic Chemistry, 2022, 87, 6680-6694
4038989	CIF HKL	C8 H4 N8	P 1 21/c 1	16.44; 17.2113; 14.4688 90; 116.005; 90	3679.5	Numez Avila, Aaron Gabriel; Deschênes-Simard, Benoît; Arnold, Joseph E.; Morency, Mathieu; Chartrand, Daniel; Maris, Thierry; Berger, Gilles; Day, Graham M.; Hanessian, Stephen; Wuest, James D. Surprising Chemistry of 6.Azidotetrazolo[5,1.a]phthalazine: What a Purported Natural Product Reveals about the Polymorphism of Explosives Journal of Organic Chemistry, 2022, 87, 6680-6694
4038952	CIF	C113 H16 N12 S12	P a -3	19.504; 19.504; 19.504 90; 90; 90	7419.4	Langis-Barsetti, Sophie; Maris, Thierry; Wuest, James D. Molecular Organization of 2,1,3-Benzothiadiazoles in the Solid State. The Journal of organic chemistry, 2017, 82, 5034-5045
4038951	CIF	C109 H28 N12 S6	P a -3	18.9035; 18.9035; 18.9035 90; 90; 90	6755	Langis-Barsetti, Sophie; Maris, Thierry; Wuest, James D. Molecular Organization of 2,1,3-Benzothiadiazoles in the Solid State. The Journal of organic chemistry, 2017, 82, 5034-5045
4038950	CIF	C20 H8 N6 S3	I -4 2 d	16.3407; 16.3407; 19.0557 90; 90; 90	5088.22	Langis-Barsetti, Sophie; Maris, Thierry; Wuest, James D. Molecular Organization of 2,1,3-Benzothiadiazoles in the Solid State. The Journal of organic chemistry, 2017, 82, 5034-5045
4038949	CIF	C25 H8 N8 S4	P 1 2/c 1	13.1602; 12.283; 14.3308 90; 111.651; 90	2153.09	Langis-Barsetti, Sophie; Maris, Thierry; Wuest, James D. Molecular Organization of 2,1,3-Benzothiadiazoles in the Solid State. The Journal of organic chemistry, 2017, 82, 5034-5045
4038948	CIF	C14 H4 N4 O2 S2	P 1 21/n 1	3.8045; 9.6098; 16.4052 90; 92.4211; 90	599.25	Langis-Barsetti, Sophie; Maris, Thierry; Wuest, James D. Molecular Organization of 2,1,3-Benzothiadiazoles in the Solid State. The Journal of organic chemistry, 2017, 82, 5034-5045
4038947	CIF	C10 H4 N4 S2	P 1 21/c 1	7.8092; 17.4192; 6.8514 90; 95.335; 90	927.96	Langis-Barsetti, Sophie; Maris, Thierry; Wuest, James D. Molecular Organization of 2,1,3-Benzothiadiazoles in the Solid State. The Journal of organic chemistry, 2017, 82, 5034-5045
4038946	CIF	C108 H162 N20 O26 S8	P -1	11.154; 14.2902; 19.7538 100.214; 90.119; 95.774	3082.4	Beaudoin, Daniel; Blair-Pereira, Joao-Nicolas; Langis-Barsetti, Sophie; Maris, Thierry; Wuest, James D. Predictably Ordered Open Hydrogen-Bonded Networks Built from Indeno[1,2-b]fluorenes. The Journal of organic chemistry, 2017, 82, 8536-8547
4038945	CIF HKL	C20 H14 O6	P -6 2 c	13.3732; 13.3732; 10.8212 90; 90; 120	1676.01	Langis-Barsetti, Sophie; Maris, Thierry; Wuest, James D. Triptycene 1,2-Quinones and Quinols: Permeable Crystalline Redox-Active Molecular Solids. The Journal of organic chemistry, 2018, 83, 15426-15437
4038944	CIF	C19 H24 Cl N O	P 21 21 21	7.6019; 12.1084; 18.2856 90; 90; 90	1683.13	Shcherbakova, Valeriya; Dibchak, Dmitry; Snisarenko, Mariya; Skalenko, Yevhen; Denisenko, Aleksandr V.; Kuznetsova, Anastasiia S.; Mykhailiuk, Pavel K. Bicyclic Piperidines <i>via</i> [2 + 2] Photocycloaddition. The Journal of organic chemistry, 2020
4038943	CIF	C18 H17 N O2	P 1 21 1	10.3223; 6.0857; 11.5807 90; 94.121; 90	725.6	Shcherbakova, Valeriya; Dibchak, Dmitry; Snisarenko, Mariya; Skalenko, Yevhen; Denisenko, Aleksandr V.; Kuznetsova, Anastasiia S.; Mykhailiuk, Pavel K. Bicyclic Piperidines <i>via</i> [2 + 2] Photocycloaddition. The Journal of organic chemistry, 2020
4038940	CIF	C20 H21 N O2	P 1 21/n 1	9.9355; 17.2277; 10.3753 90; 112.62; 90	1639.29	Vershinin, Vlada; Forkosh, Hagit; Ben-Lulu, Mor; Libman, Anna; Pappo, Doron Mechanistic Insights into the FeCl<sub>3</sub>-Catalyzed Oxidative Cross-Coupling of Phenols with 2-Aminonaphthalenes. The Journal of organic chemistry, 2020, 86, 79-90
4038935	CIF	C47.5 H31 Cl3 N2 O6 S3	P -1	7.3272; 13.9943; 21.5754 93.0414; 92.2764; 105.033	2130.31	Hempe, Matthias; Harrison, Alastair K.; Ward, Jonathan S.; Batsanov, Andrei S.; Fox, Mark A.; Dias, Fernando B.; Bryce, Martin R. Cyclophane Molecules Exhibiting Thermally Activated Delayed Fluorescence: Linking Donor Units to Influence Molecular Conformation The Journal of Organic Chemistry, 2020
4038934	CIF	C44 H34 N2 O4 S3	I 1 2/a 1	13.751; 12.365; 20.967 90; 104.142; 90	3457	Hempe, Matthias; Harrison, Alastair K.; Ward, Jonathan S.; Batsanov, Andrei S.; Fox, Mark A.; Dias, Fernando B.; Bryce, Martin R. Cyclophane Molecules Exhibiting Thermally Activated Delayed Fluorescence: Linking Donor Units to Influence Molecular Conformation The Journal of Organic Chemistry, 2020
4038933	CIF	C44 H30 D6 N2 O5 S4	P -1	7.3353; 13.8284; 19.709 96.934; 93.806; 105.314	1904	Hempe, Matthias; Harrison, Alastair K.; Ward, Jonathan S.; Batsanov, Andrei S.; Fox, Mark A.; Dias, Fernando B.; Bryce, Martin R. Cyclophane Molecules Exhibiting Thermally Activated Delayed Fluorescence: Linking Donor Units to Influence Molecular Conformation The Journal of Organic Chemistry, 2020
4038932	CIF	C39.5 H29 N2 O4.5 S3	P 1 21/n 1	15.6023; 16.9894; 25.0925 90; 96.251; 90	6611.8	Hempe, Matthias; Harrison, Alastair K.; Ward, Jonathan S.; Batsanov, Andrei S.; Fox, Mark A.; Dias, Fernando B.; Bryce, Martin R. Cyclophane Molecules Exhibiting Thermally Activated Delayed Fluorescence: Linking Donor Units to Influence Molecular Conformation The Journal of Organic Chemistry, 2020
4038931	CIF	C49 H38 N2 O5 S3	P m c 21	23.974; 7.3487; 22.763 90; 90; 90	4010.3	Hempe, Matthias; Harrison, Alastair K.; Ward, Jonathan S.; Batsanov, Andrei S.; Fox, Mark A.; Dias, Fernando B.; Bryce, Martin R. Cyclophane Molecules Exhibiting Thermally Activated Delayed Fluorescence: Linking Donor Units to Influence Molecular Conformation The Journal of Organic Chemistry, 2020
4038930	CIF	C19 H18 Cl N S2	P 1 21/c 1	10.3387; 15.7767; 11.6622 90; 115.548; 90	1716.24	Jia, Hongbin; Min, Deng; Guo, Tianyun; Wu, Mingzhong; Wang, Xiaolei; Liu, Jian; Tang, Shouchu Dithiane Induced [3+2] Cycloaddition Tactic for the Convergent Synthesis of Dihydropyrrole and Pyrrole Derivatives. The Journal of organic chemistry, 2020
4038929	CIF	C29 H30 N2 O5	P -1	9.6091; 10.3612; 12.9622 85.879; 77.215; 80.871	1241.7	Cui, Hai-Lei; Liu, Si-Wei; Xiao, Xue Synthesis of Tetrahydroindolizino[8,7-b]indole Derivatives in the Presence of Fe(OTf)3 or CF3SO3H through Intramolecular Dearomatization of Indole The Journal of Organic Chemistry, 2020
4038928	CIF	C29 H35 Cl2 N3 O4	P n a 21	9.4467; 28.7768; 10.3242 90; 90; 90	2806.59	Blasco-Brusola, Alejandro; Vayá, Ignacio; Miranda, Miguel A. Influence of the Linking Bridge on the Photoreactivity of Benzophenone-Thymine Conjugates. The Journal of organic chemistry, 2020
4038927	CIF	C12 H10 Cl2 O3	P 1 21/c 1	10.818; 10.444; 10.9 90; 105.617; 90	1186.1	Norseeda, Krissada; Chaisan, Nattawadee; Thongsornkleeb, Charnsak; Tummatorn, Jumreang; Ruchirawat, Somsak Correction to "Metal-Free Synthesis of 4-Chloroisocoumarins by TMSCl-Catalyzed NCS-Induced Chlorinative Annulation of 2-Alkynylaryloate Esters". The Journal of organic chemistry, 2020
4038926	CIF	C11 H8 Cl2 O3	P 21 21 21	9.0147; 10.9941; 11.1906 90; 90; 90	1109.08	Norseeda, Krissada; Chaisan, Nattawadee; Thongsornkleeb, Charnsak; Tummatorn, Jumreang; Ruchirawat, Somsak Correction to "Metal-Free Synthesis of 4-Chloroisocoumarins by TMSCl-Catalyzed NCS-Induced Chlorinative Annulation of 2-Alkynylaryloate Esters". The Journal of organic chemistry, 2020
4038925	CIF	C30 H43 N3 O3	P -1	11.406; 11.952; 12.014 87.77; 64.09; 89.1	1472.1	Eaton, Mary C.; Knight, Brian J.; Brahmi, Robin; Ferreira, Ricardo B.; Catalano, Vincent J.; Rheingold, Arnold L.; Ghiviriga, Ion; Murray, Leslie J. Synthetic Factors Governing Access to Tris(β-diketimine) Cyclophanes versus Tripodal Tri-β-aminoenones The Journal of Organic Chemistry, 2020
4038924	CIF	C55 H80 N6	P 1 21/c 1	18.7848; 30.833; 16.9686 90; 92.29; 90	9820.2	Eaton, Mary C.; Knight, Brian J.; Brahmi, Robin; Ferreira, Ricardo B.; Catalano, Vincent J.; Rheingold, Arnold L.; Ghiviriga, Ion; Murray, Leslie J. Synthetic Factors Governing Access to Tris(β-diketimine) Cyclophanes versus Tripodal Tri-β-aminoenones The Journal of Organic Chemistry, 2020
4038922	CIF	C44 H29 N3	P -1	11.7391; 12.2007; 13.0911 102.355; 103.287; 104.958	1686.84	Mondal, Rajarshi; Lozada, Issiah B.; Stotska, Olha; Herbert, David E. Catalytic Synthesis of Luminescent Pyrimidines via Acceptor-less Dehydrogenative Coupling The Journal of Organic Chemistry, 2020
4038921	CIF	C29 H25 N3 O	P 1 21/c 1	9.5603; 15.4396; 14.7968 90; 92.646; 90	2181.79	Mondal, Rajarshi; Lozada, Issiah B.; Stotska, Olha; Herbert, David E. Catalytic Synthesis of Luminescent Pyrimidines via Acceptor-less Dehydrogenative Coupling The Journal of Organic Chemistry, 2020
4038920	CIF	C15 H18 O4	P 21 21 21	9.5399; 9.9824; 13.668 90; 90; 90	1301.62	Su, Li-Hua; Geng, Chang-An; Li, Tian-Ze; Ma, Yun-Bao; Huang, Xiao-Yan; Zhang, Xue-Mei; Chen, Ji-Jun Artatrovirenols A and B: Two Cagelike Sesquiterpenoids from Artemisia atrovirens The Journal of Organic Chemistry, 2020
4038919	CIF	C36 H50 N4 O2	P 1 21/c 1	11.2338; 12.1485; 24.1749 90; 95.6697; 90	3283.1	Chaudhri, Nivedita; Zeller, Matthias; Brückner, Christian Stepwise Reduction of Octaethyl-β,β′-dioxochlorin Isomers: Access to Structurally and Electronically Diverse Hydroporphyrins The Journal of Organic Chemistry, 2020
4038918	CIF	C36 H48 N4 O2	C 1 2/c 1	28.938; 15.8655; 16.4572 90; 120.87; 90	6485.4	Chaudhri, Nivedita; Zeller, Matthias; Brückner, Christian Stepwise Reduction of Octaethyl-β,β′-dioxochlorin Isomers: Access to Structurally and Electronically Diverse Hydroporphyrins The Journal of Organic Chemistry, 2020
4038917	CIF	C36 H48 N4 O2	P 1	8.6099; 13.0696; 15.3288 75.546; 85.851; 73.985	1605.48	Chaudhri, Nivedita; Zeller, Matthias; Brückner, Christian Stepwise Reduction of Octaethyl-β,β′-dioxochlorin Isomers: Access to Structurally and Electronically Diverse Hydroporphyrins The Journal of Organic Chemistry, 2020
4038916	CIF	C38 H54 N4 O2	P -1	7.7374; 10.168; 11.5734 66.641; 84.803; 82.683	828.3	Chaudhri, Nivedita; Zeller, Matthias; Brückner, Christian Stepwise Reduction of Octaethyl-β,β′-dioxochlorin Isomers: Access to Structurally and Electronically Diverse Hydroporphyrins The Journal of Organic Chemistry, 2020
4038915	CIF	C38 H54 N4 O2	P c a 21	13.3711; 12.805; 20.1366 90; 90; 90	3447.7	Chaudhri, Nivedita; Zeller, Matthias; Brückner, Christian Stepwise Reduction of Octaethyl-β,β′-dioxochlorin Isomers: Access to Structurally and Electronically Diverse Hydroporphyrins The Journal of Organic Chemistry, 2020
4038914	CIF	C36 H48 N4 O2	P 1 21/n 1	16.1303; 11.074; 17.9593 90; 97.4689; 90	3180.8	Chaudhri, Nivedita; Zeller, Matthias; Brückner, Christian Stepwise Reduction of Octaethyl-β,β′-dioxochlorin Isomers: Access to Structurally and Electronically Diverse Hydroporphyrins The Journal of Organic Chemistry, 2020
4038913	CIF	C36 H48 N4 O2	P -1	11.4151; 11.6462; 12.5464 94.5164; 93.3913; 106.558	1588	Chaudhri, Nivedita; Zeller, Matthias; Brückner, Christian Stepwise Reduction of Octaethyl-β,β′-dioxochlorin Isomers: Access to Structurally and Electronically Diverse Hydroporphyrins The Journal of Organic Chemistry, 2020
4038912	CIF	C23 H25 N O10	P 1 21/c 1	10.3752; 9.7872; 21.5064 90; 100.142; 90	2149.73	Zhao, Yinjiao; Li, Yuda; Wang, Bei; Zhao, Jingfeng; Li, Liang; Luo, Xiao-Dong; Zhang, Hongbin Total Synthesis of Dactylicapnosines A and B. The Journal of organic chemistry, 2020
4038911	CIF	C27 H33 Cl2 N O10	P -1	8.0864; 12.184; 15.082 104.931; 105.413; 92.31	1374.7	Zhao, Yinjiao; Li, Yuda; Wang, Bei; Zhao, Jingfeng; Li, Liang; Luo, Xiao-Dong; Zhang, Hongbin Total Synthesis of Dactylicapnosines A and B. The Journal of organic chemistry, 2020
4038910	CIF	C26 H31 N O10	P 1 21/c 1	12.2847; 17.7579; 12.6581 90; 116.277; 90	2476	Zhao, Yinjiao; Li, Yuda; Wang, Bei; Zhao, Jingfeng; Li, Liang; Luo, Xiao-Dong; Zhang, Hongbin Total Synthesis of Dactylicapnosines A and B. The Journal of organic chemistry, 2020
4038909	CIF	C26 H33 N O10	P 1 21/n 1	13.7326; 9.2331; 19.795 90; 94.273; 90	2502.9	Zhao, Yinjiao; Li, Yuda; Wang, Bei; Zhao, Jingfeng; Li, Liang; Luo, Xiao-Dong; Zhang, Hongbin Total Synthesis of Dactylicapnosines A and B. The Journal of organic chemistry, 2020
4038908	CIF	C22 H25 N O8	P c a 21	21.1613; 8.9412; 10.6525 90; 90; 90	2015.5	Zhao, Yinjiao; Li, Yuda; Wang, Bei; Zhao, Jingfeng; Li, Liang; Luo, Xiao-Dong; Zhang, Hongbin Total Synthesis of Dactylicapnosines A and B. The Journal of organic chemistry, 2020
4038907	CIF	C29 H24 N2 O3 S	P 1 21/c 1	13.0523; 10.5054; 17.776 90; 98.567; 90	2410.2	Ge, Junying; Ding, Qiuping; Long, Xujing; Liu, Xuan; Peng, Yiyuan Copper(II)-Catalyzed Domino Synthesis of 4-Benzenesulfonyl Isoxazoles from 2-Nitro-1,3-enynes, Amines, and Sodium Benzenesulfinate The Journal of Organic Chemistry, 2020
4038906	CIF	C45 H43 Br3 N O8	P 21 21 21	5.1493; 24.3955; 34.606 90; 90; 90	4347.2	Zheng, Kuan; Shen, Defeng; Zhang, Bingbing; Hong, Ran The Landscape of Lankacidin Biomimetic Synthesis: Structural Revisions and Biogenetic Implications. The Journal of organic chemistry, 2020
4038905	CIF	C25 H35 N O7	P 1 21 1	6.9385; 11.2966; 16.5485 90; 93.908; 90	1294.08	Zheng, Kuan; Shen, Defeng; Zhang, Bingbing; Hong, Ran The Landscape of Lankacidin Biomimetic Synthesis: Structural Revisions and Biogenetic Implications. The Journal of organic chemistry, 2020
4038904	CIF	C49 H69 N O8 Si2	P 21 21 21	10.1898; 20.428; 24.565 90; 90; 90	5113.4	Zheng, Kuan; Shen, Defeng; Zhang, Bingbing; Hong, Ran The Landscape of Lankacidin Biomimetic Synthesis: Structural Revisions and Biogenetic Implications. The Journal of organic chemistry, 2020
4038903	CIF	C24 H34 N O5	P 21 21 21	5.9728; 12.6582; 31.5671 90; 90; 90	2386.6	Zheng, Kuan; Shen, Defeng; Zhang, Bingbing; Hong, Ran The Landscape of Lankacidin Biomimetic Synthesis: Structural Revisions and Biogenetic Implications. The Journal of organic chemistry, 2020
4038902	CIF	C24 H35 N O5	C 1 2 1	20.1817; 5.8935; 21.8822 90; 108.294; 90	2471.14	Zheng, Kuan; Shen, Defeng; Zhang, Bingbing; Hong, Ran The Landscape of Lankacidin Biomimetic Synthesis: Structural Revisions and Biogenetic Implications. The Journal of organic chemistry, 2020
4038898	CIF	C51 H47 Cl2 N2 P Pd	P 1 21/c 1	15.5895; 14.6791; 19.4121 90; 94.969; 90	4425.6	Kumar, Anuj; Kumar, Manoj; Verma, Akhilesh K. Well-Defined Palladium N-Heterocyclic Carbene Complexes: Direct C‒H Bond Arylation of Heteroarenes The Journal of Organic Chemistry, 2020
4038897	CIF	C38 H36 Cl3 N3 Pd	P 1 21/c 1	21.7121; 21.2886; 16.5409 90; 111.614; 90	7108	Kumar, Anuj; Kumar, Manoj; Verma, Akhilesh K. Well-Defined Palladium N-Heterocyclic Carbene Complexes: Direct C‒H Bond Arylation of Heteroarenes The Journal of Organic Chemistry, 2020
4038896	CIF	C38 H37 Cl2 N3 Pd	P 1 21 1	8.1816; 17.041; 12.2796 90; 107.688; 90	1631.12	Kumar, Anuj; Kumar, Manoj; Verma, Akhilesh K. Well-Defined Palladium N-Heterocyclic Carbene Complexes: Direct C‒H Bond Arylation of Heteroarenes The Journal of Organic Chemistry, 2020
4038895	CIF	C20 H15 N O	P 1 21/c 1	10.878; 17.189; 8.189 90; 107.049; 90	1463.9	Shi, Wei; Ma, Fang; Li, Pinhua; Wang, Lei; Miao, Tao Visible-Light-Induced Decarboxylative Cyclization/Hydrogenation Cascade Reaction to Access Phenanthridin-6-yl(aryl)methanol by an Electron Donor‒Acceptor Complex The Journal of Organic Chemistry, 2020
4038894	CIF	C30 H50 O4 S Si2	P 21 21 21	8.3608; 16.9291; 23.1401 90; 90; 90	3275.27	Kim, Hyun Su; Park, Hyunkyung; Lim, Juhee; Lim, Changjin; Kim, Taewoo; Lee, Seungbeom; Hur, Joonseong; Sim, Jaehoon; Choi, Hyun Jin; Suh, Young-Ger Collective Syntheses of Guaiane Sesquiterpenes: Stereoselective Syntheses of (+)-Dysodensiol F, (+)-10β,14-Dihydroxy-<i>allo</i>-aromadendrane, and (-)-Dendroside C Aglycon. The Journal of organic chemistry, 2020
4038893	CIF	C10 H13 N5	P 1 21/c 1	9.27494; 8.81723; 12.0155 90; 92.8415; 90	981.41	Korsik, Marat; Tse, Edwin; Smith, David G.; Lewis, William; Rutledge, Peter J.; Todd, Matthew H. Tele-substitution Reactions in the Synthesis of a Promising Class of 1,2,4-Triazolo[4,3-a]pyrazine-Based Antimalarials. The Journal of organic chemistry, 2020
4038892	CIF	C20 H19 N5 O	P -1	7.6546; 10.4869; 11.4484 71.511; 82.118; 82.695	859.9	Korsik, Marat; Tse, Edwin; Smith, David G.; Lewis, William; Rutledge, Peter J.; Todd, Matthew H. Tele-substitution Reactions in the Synthesis of a Promising Class of 1,2,4-Triazolo[4,3-a]pyrazine-Based Antimalarials. The Journal of organic chemistry, 2020
4038891	CIF	C5 H3 Cl N4	P 1 21/m 1	6.9527; 6.30259; 7.5416 90; 114.963; 90	299.6	Korsik, Marat; Tse, Edwin; Smith, David G.; Lewis, William; Rutledge, Peter J.; Todd, Matthew H. Tele-substitution Reactions in the Synthesis of a Promising Class of 1,2,4-Triazolo[4,3-a]pyrazine-Based Antimalarials. The Journal of organic chemistry, 2020
4038890	CIF	C29 H23 N O2	P -1	6.1618; 8.7522; 20.3805 88.042; 84.239; 78.625	1071.96	Liu, Yu-Te; Cheng, Chi-Wei; Lu, Huan-Chang; Chang, Ting-Yu; Chen, Chun-Ying; Yang, Hao-Chun; Yu, Shih-Hsien; Zehra, Syeda; Liu, Shu-Hui; Leung, Man-Kit; Lee, Kwang-Ming; Chen, Hsiu-Hui One-Pot CuI/DBU-Catalyzed Carboxylative Cyclization toward Oxazolidinones Using Recyclable Molecular Sieves as Efficient Promoters for Fixation of CO2 in Water Medium The Journal of Organic Chemistry, 2020
4038889	CIF	C24 H21 N O3	C 2 2 21	13.4355; 14.6914; 19.5353 90; 90; 90	3856	Liu, Yu-Te; Cheng, Chi-Wei; Lu, Huan-Chang; Chang, Ting-Yu; Chen, Chun-Ying; Yang, Hao-Chun; Yu, Shih-Hsien; Zehra, Syeda; Liu, Shu-Hui; Leung, Man-Kit; Lee, Kwang-Ming; Chen, Hsiu-Hui One-Pot CuI/DBU-Catalyzed Carboxylative Cyclization toward Oxazolidinones Using Recyclable Molecular Sieves as Efficient Promoters for Fixation of CO2 in Water Medium The Journal of Organic Chemistry, 2020
4038888	CIF	C15 H16 Cl F6 N3	P 1 21 1	10.5346; 15.4968; 10.755 90; 110.95; 90	1639.71	Dinh, Andrew N.; Maddox, Sean M.; Vaidya, Sagar D.; Saputra, Mirza A.; Nalbandian, Christopher J.; Gustafson, Jeffrey L. Catalyst-Controlled Regioselective Chlorination of Phenols and Anilines through a Lewis Basic Selenoether Catalyst The Journal of Organic Chemistry, 2020
4038887	CIF	C10 H7 Br2 F O2 S	P 1 21/n 1	7.12; 7.8736; 21.6656 90; 93.465; 90	1212.35	Zhang, Zai-Wei; Wang, Shi-Meng; Fang, Wan-Yin; Lekkala, Ravindar; Qin, Hua-Li A protocol for stereoselective construction of highly functionalized dienyl sulfonyl fluoride warheads. The Journal of organic chemistry, 2020
4038886	CIF	C48 H34 N6 O4	P -1	7.9652; 8.0725; 30.441 95.554; 95.804; 96.061	1925	Beesu, Mallesh; Mehta, Goverdhan Orthogonal Strapping of o-Haloaryl Ynones with Pyrazolones: A One-Pot, Domino Process toward Spiropyrazolones The Journal of Organic Chemistry, 2020
4038885	CIF	C48.05 H40 N4 O4	P -1	7.7764; 16.2542; 17.3988 62.893; 87.319; 78.993	1919.58	Beesu, Mallesh; Mehta, Goverdhan Orthogonal Strapping of o-Haloaryl Ynones with Pyrazolones: A One-Pot, Domino Process toward Spiropyrazolones The Journal of Organic Chemistry, 2020
4038884	CIF	C20 H16 N2 O2	P b c n	52.965; 8.731; 14.249 90; 90; 90	6589	Beesu, Mallesh; Mehta, Goverdhan Orthogonal Strapping of o-Haloaryl Ynones with Pyrazolones: A One-Pot, Domino Process toward Spiropyrazolones The Journal of Organic Chemistry, 2020
4038883	CIF	C24 H20 N4 O2	P 1 21/c 1	7.919; 34.155; 7.5867 90; 92.857; 90	2049.5	Beesu, Mallesh; Mehta, Goverdhan Orthogonal Strapping of o-Haloaryl Ynones with Pyrazolones: A One-Pot, Domino Process toward Spiropyrazolones The Journal of Organic Chemistry, 2020
4038882	CIF	C66 H84 N6	P -1	13.1663; 14.0425; 18.3518 71.914; 88.948; 85.804	3216.7	Schick, Tobias H. G.; Rominger, Frank; Mastalerz, Michael Examination of the Dynamic Covalent Chemistry of [2 + 3]-Imine Cages. The Journal of organic chemistry, 2020
4038881	CIF	C48 H66 N8	P 3 1 c	11.9345; 11.9345; 40.593 90; 90; 120	5007.1	Schick, Tobias H. G.; Rominger, Frank; Mastalerz, Michael Examination of the Dynamic Covalent Chemistry of [2 + 3]-Imine Cages. The Journal of organic chemistry, 2020
4038880	CIF	C90 H108 N6	P n n a	29.9197; 21.7163; 12.1918 90; 90; 90	7921.6	Schick, Tobias H. G.; Rominger, Frank; Mastalerz, Michael Examination of the Dynamic Covalent Chemistry of [2 + 3]-Imine Cages. The Journal of organic chemistry, 2020
4038879	CIF	C16 H24 O4	P 1 21/c 1	9.3426; 21.642; 7.3217 90; 95.5215; 90	1473.5	El-Hage, Firas; Schöll, Christopher; Pospech, Jola Photo-mediated Decarboxylative Giese-Type Reaction using Organic Pyrimidopteridine Photoredox Catalysts. The Journal of organic chemistry, 2020
4038878	CIF	C20 H18 Br N O2	P 21 21 21	6.4266; 15.5268; 16.3329 90; 90; 90	1629.77	Yadav, Jyothi; Pawar, Amol Prakash; Nagare, Yadav Kacharu; Iype, Eldhose; Rangan, Krishnan; Ohshita, Joji; Kumar, Dalip; Kumar, Indresh Direct Amine-Catalyzed Enantioselective Synthesis of Pentacyclic Dibenzo[<i>b</i>,<i>f</i>][1,4]oxazepine/Thiazepine-Fused Isoquinuclidines along with DFT Calculations. The Journal of organic chemistry, 2020
4038877	CIF	C93 H65 Cl3 O7	P 1	6.3659; 17.1828; 20.1654 66.231; 89.24; 89.986	2018.46	Zhang, Xiang-Zhi; Li, Bao Qiong; Qiu, Zong-Wang; Ma, Aijun; Peng, Jin-Bao; Du, Ji-Yuan; Feng, Na; Xu, Xue-Tao; Pan, Han-Peng Synthesis of Naphthopyrans <i>via</i> Formal (3+3)-Annulation of Propargylic (Aza)-<i>para</i>-Quinone Methides with Naphthols. The Journal of organic chemistry, 2020
4038876	CIF	C24 H27 N O4	P 21 21 21	6.0637; 16.8612; 19.9302 90; 90; 90	2037.69	Zhen, Li; Tong, Shuo; Zhu, Jieping; Wang, Mei-Xiang Construction of the Erythrinane Core Skeleton via Asymmetric Catalytic Cascade Reaction of Tertiary Enamides. The Journal of organic chemistry, 2020, 85, 13211-13219
4038875	CIF	C24 H27 N O4	P 21 21 21	6.7505; 13.9462; 22.3174 90; 90; 90	2101.05	Zhen, Li; Tong, Shuo; Zhu, Jieping; Wang, Mei-Xiang Construction of the Erythrinane Core Skeleton via Asymmetric Catalytic Cascade Reaction of Tertiary Enamides. The Journal of organic chemistry, 2020, 85, 13211-13219
4038874	CIF	C21 H27 N2 O6	P -1	8.1218; 11.2194; 13.0487 65.267; 79.27; 78.503	1051.2	Chen, Yanhui; Lv, Weiwei; Ba, Dan; Wen, Si; Cheng, Guolin Palladium-Catalyzed Chemoselective Synthesis of 2-Aminocinnamyl Esters via Sequential Amination and Olefination of Aryl Iodides. The Journal of organic chemistry, 2020
4038873	CIF	C52 H66 B2 F8 N6 Ni O0 P4	P 1 21 1	10.957; 19.503; 13.36 90; 106.509; 90	2737.3	Musina, Elvira I.; Wittmann, Tatiana I.; Musin, Lenar; Balueva, Anna S.; Shpagina, Alena S.; Litvinov, Igor A.; Lönnecke, Peter; Hey-Hawkins, Evamarie; Karasik, Andrey A.; Sinyashin, Oleg G. Dynamic covalent chemistry approach toward 18-membered P<sub>4</sub>N<sub>2</sub> macrocycles and their nickel(II) complexes. The Journal of organic chemistry, 2020
4038872	CIF	C48 H58 B2 F8 N6 Ni P4	P -1	10.99; 13.243; 20.297 88.718; 84.969; 71.022	2782.6	Musina, Elvira I.; Wittmann, Tatiana I.; Musin, Lenar; Balueva, Anna S.; Shpagina, Alena S.; Litvinov, Igor A.; Lönnecke, Peter; Hey-Hawkins, Evamarie; Karasik, Andrey A.; Sinyashin, Oleg G. Dynamic covalent chemistry approach toward 18-membered P<sub>4</sub>N<sub>2</sub> macrocycles and their nickel(II) complexes. The Journal of organic chemistry, 2020
4038871	CIF	C42 H58 B2 F8 N2 Ni P4	P 1 21/c 1	13.1558; 21.3869; 16.3943 90; 108.413; 90	4376.58	Musina, Elvira I.; Wittmann, Tatiana I.; Musin, Lenar; Balueva, Anna S.; Shpagina, Alena S.; Litvinov, Igor A.; Lönnecke, Peter; Hey-Hawkins, Evamarie; Karasik, Andrey A.; Sinyashin, Oleg G. Dynamic covalent chemistry approach toward 18-membered P<sub>4</sub>N<sub>2</sub> macrocycles and their nickel(II) complexes. The Journal of organic chemistry, 2020
4038870	CIF	C24 H29 N3 O2 P2	P -1	10.11; 11.896; 12.699 113.23; 104.32; 98.18	1310	Musina, Elvira I.; Wittmann, Tatiana I.; Musin, Lenar; Balueva, Anna S.; Shpagina, Alena S.; Litvinov, Igor A.; Lönnecke, Peter; Hey-Hawkins, Evamarie; Karasik, Andrey A.; Sinyashin, Oleg G. Dynamic covalent chemistry approach toward 18-membered P<sub>4</sub>N<sub>2</sub> macrocycles and their nickel(II) complexes. The Journal of organic chemistry, 2020
4038869	CIF	C44 H62 N2 P4	P -1	11.3964; 13.8689; 15.4979 106.832; 103.174; 105.045	2139.1	Musina, Elvira I.; Wittmann, Tatiana I.; Musin, Lenar; Balueva, Anna S.; Shpagina, Alena S.; Litvinov, Igor A.; Lönnecke, Peter; Hey-Hawkins, Evamarie; Karasik, Andrey A.; Sinyashin, Oleg G. Dynamic covalent chemistry approach toward 18-membered P<sub>4</sub>N<sub>2</sub> macrocycles and their nickel(II) complexes. The Journal of organic chemistry, 2020
4038868	CIF	C48 H66 N2 P4	P -1	12.6527; 13.775; 16.0646 104.584; 98.638; 115.784	2329	Musina, Elvira I.; Wittmann, Tatiana I.; Musin, Lenar; Balueva, Anna S.; Shpagina, Alena S.; Litvinov, Igor A.; Lönnecke, Peter; Hey-Hawkins, Evamarie; Karasik, Andrey A.; Sinyashin, Oleg G. Dynamic covalent chemistry approach toward 18-membered P<sub>4</sub>N<sub>2</sub> macrocycles and their nickel(II) complexes. The Journal of organic chemistry, 2020
4038867	CIF	C42 H58 N2 P4	C 1 2/c 1	21.8967; 8.026; 25.7249 90; 111.928; 90	4193.9	Musina, Elvira I.; Wittmann, Tatiana I.; Musin, Lenar; Balueva, Anna S.; Shpagina, Alena S.; Litvinov, Igor A.; Lönnecke, Peter; Hey-Hawkins, Evamarie; Karasik, Andrey A.; Sinyashin, Oleg G. Dynamic covalent chemistry approach toward 18-membered P<sub>4</sub>N<sub>2</sub> macrocycles and their nickel(II) complexes. The Journal of organic chemistry, 2020
4038866	CIF	C21 H13 F6 P	P 1 21/n 1	9.7568; 16.9083; 11.2062 90; 94.842; 90	1842.1	Han, Zeyu; Röhner, David; Samedov, Kerim; Gates, Derek P. Isolable Phosphaalkenes Bearing 2,4,6-Trimethoxyphenyl and 2,6-Bis(trifluoromethyl)phenyl as P-Substituents. The Journal of organic chemistry, 2020
4038865	CIF	C9 H13 O3 P	P 1 21/n 1	10.6804; 7.2713; 12.814 90; 90.712; 90	995.06	Han, Zeyu; Röhner, David; Samedov, Kerim; Gates, Derek P. Isolable Phosphaalkenes Bearing 2,4,6-Trimethoxyphenyl and 2,6-Bis(trifluoromethyl)phenyl as P-Substituents. The Journal of organic chemistry, 2020
4038864	CIF	C22 H21 O3 P	P 1 21/c 1	10.434; 6.0505; 29.2143 90; 96.876; 90	1831.1	Han, Zeyu; Röhner, David; Samedov, Kerim; Gates, Derek P. Isolable Phosphaalkenes Bearing 2,4,6-Trimethoxyphenyl and 2,6-Bis(trifluoromethyl)phenyl as P-Substituents. The Journal of organic chemistry, 2020
4038863	CIF	C26 H21 N O2	P 1 21 1	10.676; 8.467; 11.173 90; 106.897; 90	966.4	Debnath, Sudipto; Das, Tuluma; Pati, Tanmay K.; Majumdar, Swapan; Maiti, Dilip K. Metal-Free Indole-Phenacyl Bromide Cyclization: A Regioselective Synthesis of 3,5-Diarylcarbazoles. The Journal of organic chemistry, 2020, 85, 13272-13279
4038862	CIF	C15 H16 O3	P 65	24.0111; 24.0111; 22.65 90; 90; 120	11309	Kleiner, Yolanda; Hammann, Peter; Becker, Jonathan; Bauer, Armin; Pöverlein, Christoph; Schuler, Sören M M Total Synthesis and Structure Revision of (-)-Avicennone C. The Journal of organic chemistry, 2020
4038861	CIF	C26 H41 Br O4 Si	P 1 21 1	7.756; 43.788; 9.04 90; 114.516; 90	2793.4	Kleiner, Yolanda; Hammann, Peter; Becker, Jonathan; Bauer, Armin; Pöverlein, Christoph; Schuler, Sören M M Total Synthesis and Structure Revision of (-)-Avicennone C. The Journal of organic chemistry, 2020
4038860	CIF	C22 H28 N O6.5	C 1 2/c 1	22.801; 17.372; 13.239 90; 94.494; 90	5228	Xiong, Wei; Wang, Xiaohong; Shen, Xianyan; Hu, Cuifang; Wang, Xin; Wang, Fei; Zhang, Guolin; Wang, Chun Synthesis of Flavonols via Pyrrolidine Catalysis: Origins of the Selectivity for Flavonol versus Aurone. The Journal of organic chemistry, 2020
4038859	CIF	C39 H34 N3 O P	P 1 21/c 1	9.2046; 16.5447; 21.3255 90; 91.645; 90	3246.27	Pattarawarapan, Mookda; Yamano, Dolnapa; Wiriya, Nittaya; Yimklan, Saranphong; Phakhodee, Wong Simultaneous Formation and Functionalization of Aryliminophosphoranes Using 1,3-Dihydro-1<i>H</i>-benzimidazol-2-ones as Precursors. The Journal of organic chemistry, 2020, 85, 13330-13338
4038858	CIF	C86 H81 Cl3 N4 O5 Zn	P -1	15.3192; 16.6129; 17.287 92.847; 100.839; 108.55	4068.1	Ishizuka, Tomoya; Tanaka, Shogo; Uchida, Sayaka; Wei, Lianyu; Kojima, Takahiko Selective Convergence to Atropisomers of a Porphyrin Derivative Having Bulky Substituents at the Periphery. The Journal of organic chemistry, 2020
4038857	CIF	C87.5 H83 Cl3 F6 N4 O10 S2	P -1	15.715; 15.84; 16.452 97.24; 90.434; 99.096	4010	Ishizuka, Tomoya; Tanaka, Shogo; Uchida, Sayaka; Wei, Lianyu; Kojima, Takahiko Selective Convergence to Atropisomers of a Porphyrin Derivative Having Bulky Substituents at the Periphery. The Journal of organic chemistry, 2020
4038856	CIF	C85.52 H83.04 Cl5.04 N4 O12	P -1	15.172; 15.412; 17.553 81.596; 75.237; 86.921	3925.7	Ishizuka, Tomoya; Tanaka, Shogo; Uchida, Sayaka; Wei, Lianyu; Kojima, Takahiko Selective Convergence to Atropisomers of a Porphyrin Derivative Having Bulky Substituents at the Periphery. The Journal of organic chemistry, 2020
4038855	CIF	C85 H80 Cl2 N4 O4	P 1 21/c 1	14.701; 38.079; 14.624 90; 110.677; 90	7659.2	Ishizuka, Tomoya; Tanaka, Shogo; Uchida, Sayaka; Wei, Lianyu; Kojima, Takahiko Selective Convergence to Atropisomers of a Porphyrin Derivative Having Bulky Substituents at the Periphery. The Journal of organic chemistry, 2020
4038854	CIF	C85 H80 Cl2 N4 O4	P 1 21/n 1	13.151; 18.373; 29.23 90; 97.522; 90	7002	Ishizuka, Tomoya; Tanaka, Shogo; Uchida, Sayaka; Wei, Lianyu; Kojima, Takahiko Selective Convergence to Atropisomers of a Porphyrin Derivative Having Bulky Substituents at the Periphery. The Journal of organic chemistry, 2020
4038853	CIF	C93 H87 N4 O4	P 1 21/c 1	19.334; 15.9626; 24.978 90; 97.191; 90	7648.1	Ishizuka, Tomoya; Tanaka, Shogo; Uchida, Sayaka; Wei, Lianyu; Kojima, Takahiko Selective Convergence to Atropisomers of a Porphyrin Derivative Having Bulky Substituents at the Periphery. The Journal of organic chemistry, 2020
4038852	CIF	C15 H11 Br O2	P 1 21/n 1	9.5102; 8.4541; 16.722 90; 104.133; 90	1303.76	Hu, Sha; Lu, Zuolin; Liu, Minjie; Xu, Hanlin; Wu, Jiale; Chen, Fener TfOH-Catalyzed Cascade C-H Activation/Lactonization of Phenols with alpha-Aryl-alpha-Diazoesters: Rapid Access to alpha-Aryl Benzofuranones. The Journal of organic chemistry, 2020
4038851	CIF	C24 H18 N2 S	P 1 21/c 1	10.0472; 9.0898; 20.6002 90; 98.372; 90	1861.3	Kumar, Jogendra; Suresh, Eringathodi; Bhadra, Sukalyan Catalytic Direct α-Amination of Arylacetic Acid Synthons with Anilines The Journal of Organic Chemistry, 2020
4038850	CIF	C21 H17 Br N2 O	P 1 21/c 1	16.1173; 6.0319; 19.9118 90; 110.983; 90	1807.42	Kumar, Jogendra; Suresh, Eringathodi; Bhadra, Sukalyan Catalytic Direct α-Amination of Arylacetic Acid Synthons with Anilines The Journal of Organic Chemistry, 2020
4038849	CIF	C13 H12 N2 O	P n a 21	9.11; 10.547; 11.7739 90; 90; 90	1131.27	Zhao, Yulei; Guo, Xuqiang; Si, Zhiyao; Hu, Yanan; Sun, Ying; Liu, Yunlin; Ji, Zhongyin; You, Jinmao Hydrosilane-Assisted Synthesis of Urea Derivatives from CO<sub>2</sub> and Amines. The Journal of organic chemistry, 2020
4038848	CIF	C18 H22 N2 O6	P 21 21 21	5.921; 9.6597; 32.1824 90; 90; 90	1840.68	Yuan, Jinping; Jain, Pankaj; Antilla, Jon C. Bi(cyclopentyl)diol-Derived Boronates in Highly Enantioselective Chiral Phosphoric Acid-Catalyzed Allylation, Propargylation and Crotylation of Aldehydes. The Journal of organic chemistry, 2020
4038847	CIF	C19 H19 N O S2	P c a 21	9.4553; 7.4507; 24.9074 90; 90; 90	1754.69	Cheng, Bin; Li, Hui; Hou, Jieping; Zhang, Xinping; He, Yixuan; Sun, Haiyan; Xu, Wei; Wang, Taimin; Zhai, Hongbin Synthesis of 3,4-Dihydro-2H-1,3-thiazines from α-Enolic Dithioesters and 1,3,5-Triazinanes via a Formal (3 + 3) Annulation Reaction The Journal of Organic Chemistry, 2020
4038846	CIF	C18 H16 Cl N O3	P 1 21/n 1	10.01784; 10.98794; 15.5845 90; 105.645; 90	1651.92	Peng, Haiyun; Zhang, Yu; Zhu, Yang; Deng, Guisheng Silver(I)-catalyzed Domino Cyclization/Cyclopropanation/Ring-Cleavage/Nucleophilic Substitution Reaction of Enynones with Enamines: Synthesis of 4-(furan-2-yl)-3,4-dihydro-2<i>H</i>-pyrrol-2-one. The Journal of organic chemistry, 2020
4038845	CIF	C24 H23 N3 O2	P 1 21/c 1	9.8585; 9.5244; 21.7395 90; 99.223; 90	2014.9	Golmohammadi, Farhad; Balalaie, Saeed; Fathi Vavsari, Vaezeh; Anwar, Muhammad U.; Al-Harrasi, Ahmed Synthesis of Spiro-β-lactam-pyrroloquinolines as Fused Heterocyclic Scaffolds through Post-transformation Reactions The Journal of Organic Chemistry, 2020
4038844	CIF	C21 H24 N2 O2	P -1	8.7033; 10.3399; 11.7859 113.729; 92.491; 101.392	942.86	Yang, Zi; Yue, Qi; Yang, Mengqi; Zhang, Hong; Cui, Xiuling Ru(II)-catalyzed tunable cascade reaction via C-H/C-C bond cleavage. The Journal of organic chemistry, 2020
4038843	CIF	C28 H22 N O3 P	P -1	8.3188; 9.3992; 15.4909 75.866; 82.881; 74.752	1130.91	Lou, Qin-Xin; Niu, Yuan; Qi, Zhi-Chao; Yang, Shang-Dong Ir(III)-Catalyzed C-H Functionalization of Triphenylphosphine Oxide Towards 3-Aryl Oxindoles. The Journal of organic chemistry, 2020
4038842	CIF	C29 H38 N O2 P	P 1 21/n 1	11.799; 18.531; 12.441 90; 101.186; 90	2668.5	Huang, Yange; Choy, Pui Ying; Wang, Junya; Tse, Man Kin; Sun, Raymond Wai-Yin; Chan, Albert Sun Chi; Kwong, Fuk Yee Palladium-catalyzed Monoarylation of Arylhydrazines with Aryl Tosylates. The Journal of organic chemistry, 2020
4038841	CIF	C21 H18 N2 O2	P 1 c 1	7.327; 15.647; 7.711 90; 96.781; 90	877.8	Huang, Yange; Choy, Pui Ying; Wang, Junya; Tse, Man Kin; Sun, Raymond Wai-Yin; Chan, Albert Sun Chi; Kwong, Fuk Yee Palladium-catalyzed Monoarylation of Arylhydrazines with Aryl Tosylates. The Journal of organic chemistry, 2020
4038840	CIF	C16 H20 N2	P 1 n 1	6.381; 13.803; 7.88 90; 95.82; 90	690.5	Huang, Yange; Choy, Pui Ying; Wang, Junya; Tse, Man Kin; Sun, Raymond Wai-Yin; Chan, Albert Sun Chi; Kwong, Fuk Yee Palladium-catalyzed Monoarylation of Arylhydrazines with Aryl Tosylates. The Journal of organic chemistry, 2020
4038839	CIF	C16 H14 N2	C 1 c 1	23.2393; 7.5636; 7.3759 90; 100.902; 90	1273.08	Huang, Yange; Choy, Pui Ying; Wang, Junya; Tse, Man Kin; Sun, Raymond Wai-Yin; Chan, Albert Sun Chi; Kwong, Fuk Yee Palladium-catalyzed Monoarylation of Arylhydrazines with Aryl Tosylates. The Journal of organic chemistry, 2020
4038838	CIF	C16 H18 O2 S	P 1 21 1	9.6838; 8.3369; 9.8668 90; 116.416; 90	713.4	Li, Shu-Sen; Wang, Jianbo Cu(I)/Chiral Bisoxazoline-Catalyzed Enantioselective Sommelet-Hauser Rearrangement of Sulfonium Ylides. The Journal of organic chemistry, 2020, 85, 12343-12358
4038837	CIF	C28 H27 N O3	P -1	11.4662; 13.068; 16.186 82.877; 88.111; 79.015	2362.4	Lepovitz, Lance T.; Martin, Stephen F. Biomimetically Inspired, One-Step Synthesis of Exotine A and Exotine B. The Journal of organic chemistry, 2020
4038836	CIF	C26 H24 N O P	P b c a	18.889; 11.865; 19.04 90; 90; 90	4267.2	Lim, Taehyun; Kim, Byeong Moon Synthesis of α-aminophosphonates via phosphonylation of an aryne-imine adduct. The Journal of organic chemistry, 2020
4038835	CIF	C29 H36 N2 O5 Si	P -1	10.2581; 11.4654; 14.5949 70.423; 85.801; 75.155	1563.19	Zhang, Yan-Xue; Chen, Ling-Yan; Sun, Jian-Ting; Si, Chang-Mei; Wei, Bang-Guo Gold-Catalyzed Addition-<i>N</i>-Boc Cleavage-Cyclization of <i>N</i>,<i>O</i>-Acetal with Ynamides for Construction of 6-(<i>tert</i>-Butyldimethylsilyl)oxy-tetrahydropyrrolo[1,2-<i>c</i>][1,3]oxazin-1-ones. The Journal of organic chemistry, 2020, 85, 12603-12613
4038834	CIF	C25 H17 B Br F3 N2 O4	P 1 21/c 1	17.3714; 14.8912; 9.2154 90; 104.076; 90	2312.27	Yang, Tianbao; Cao, Xin; Zhang, Xing-Xing; Ou, Yifeng; Au, Chak-Tong; Yin, Shuang-Feng; Qiu, Renhua Iodine-Catalyzed Synthesis of <i>N,N</i>'-Chelate Organoboron Aminoquinolate. The Journal of organic chemistry, 2020, 85, 12430-12443
4038833	CIF	C23 H16 B F3 N2 O	P 1 21/c 1	9.638; 16.4283; 12.1516 90; 105.707; 90	1852.2	Yang, Tianbao; Cao, Xin; Zhang, Xing-Xing; Ou, Yifeng; Au, Chak-Tong; Yin, Shuang-Feng; Qiu, Renhua Iodine-Catalyzed Synthesis of <i>N,N</i>'-Chelate Organoboron Aminoquinolate. The Journal of organic chemistry, 2020, 85, 12430-12443
4038832	CIF	C40 H54 B F4 N2 O4 P4 Rh	P 1 21 1	10.8041; 15.3336; 13.3346 90; 102.262; 90	2158.7	Moritz, Jan-Ole; Chakrabortty, Soumyadeep; Müller, Bernd H; Spannenberg, Anke; Kamer, Paul C. J. P-chirogenic Diphosphazanes with Axially Chiral Substituents and their Use in Rh-catalyzed Asymmetric Hydrogenation. The Journal of organic chemistry, 2020
4038831	CIF	C20 H27 N O2 P2	P 21 21 21	9.856; 11.5291; 17.2583 90; 90; 90	1961.07	Moritz, Jan-Ole; Chakrabortty, Soumyadeep; Müller, Bernd H; Spannenberg, Anke; Kamer, Paul C. J. P-chirogenic Diphosphazanes with Axially Chiral Substituents and their Use in Rh-catalyzed Asymmetric Hydrogenation. The Journal of organic chemistry, 2020
4038830	CIF	C24 H39 Li N3 P	P 1 21 1	8.8123; 30.9425; 9.2575 90; 98.8763; 90	2494.05	Moritz, Jan-Ole; Chakrabortty, Soumyadeep; Müller, Bernd H; Spannenberg, Anke; Kamer, Paul C. J. P-chirogenic Diphosphazanes with Axially Chiral Substituents and their Use in Rh-catalyzed Asymmetric Hydrogenation. The Journal of organic chemistry, 2020
4038829	CIF	C20 H27 N O2 P2	P 21 21 21	9.851; 11.5233; 17.2368 90; 90; 90	1956.65	Moritz, Jan-Ole; Chakrabortty, Soumyadeep; Müller, Bernd H; Spannenberg, Anke; Kamer, Paul C. J. P-chirogenic Diphosphazanes with Axially Chiral Substituents and their Use in Rh-catalyzed Asymmetric Hydrogenation. The Journal of organic chemistry, 2020
4038828	CIF	C28 H39 N3	P -1	8.9279; 12.3384; 13.3669 66.588; 81.982; 72.54	1288.6	Zhang, Zengyu; Huang, Shiqing; Huang, Linwei; Xu, Xingyu; Zhao, Hongyan; Yan, Xiaoyu Synthesis of Mesoionic N-Heterocyclic Olefins and Catalytic Application for Hydroboration Reactions. The Journal of organic chemistry, 2020, 85, 12036-12043
4038827	CIF	C22 H27 N3	C 1 2/c 1	22.445; 10.5768; 8.1673 90; 92.685; 90	1936.8	Zhang, Zengyu; Huang, Shiqing; Huang, Linwei; Xu, Xingyu; Zhao, Hongyan; Yan, Xiaoyu Synthesis of Mesoionic N-Heterocyclic Olefins and Catalytic Application for Hydroboration Reactions. The Journal of organic chemistry, 2020, 85, 12036-12043
4038826	CIF	C42 H30 F12 N2	P 1 21/n 1	6.0701; 25.7968; 10.8547 90; 97.551; 90	1684.99	Tasior, Mariusz; Vakuliuk, Olena; Koga, Daiki; Koszarna, Beata; Górski, Krzysztof; Grzybowski, Marek; Kielesiński, Łukasz; Krzeszewski, Maciej; Gryko, Daniel T. Method for the Large-Scale Synthesis of Multifunctional 1,4-Dihydro-pyrrolo[3,2-<i>b</i>]pyrroles. The Journal of organic chemistry, 2020
4038825	CIF	C40 H28 N6 O2	P -1	11.3043; 11.6698; 13.0106 93.163; 100.157; 107.529	1600.24	Tasior, Mariusz; Vakuliuk, Olena; Koga, Daiki; Koszarna, Beata; Górski, Krzysztof; Grzybowski, Marek; Kielesiński, Łukasz; Krzeszewski, Maciej; Gryko, Daniel T. Method for the Large-Scale Synthesis of Multifunctional 1,4-Dihydro-pyrrolo[3,2-<i>b</i>]pyrroles. The Journal of organic chemistry, 2020
4038824	CIF	C23 H20 N2 O3	P 1 21/n 1	13.0463; 12.6415; 22.773 90; 105.273; 90	3623.2	Mittendorf, Fabia; Mohr, Fabian; Kirsch, Stefan F. Ring Expansion of 2-Azido-2-phenyl-indan-1,3-dione for the Generation of Heterocyclic Scaffolds. The Journal of organic chemistry, 2020, 85, 12760-12769
4038823	CIF	C18 H14 N2 O3	P 21 21 21	8.0529; 8.1749; 22.1907 90; 90; 90	1460.85	Mittendorf, Fabia; Mohr, Fabian; Kirsch, Stefan F. Ring Expansion of 2-Azido-2-phenyl-indan-1,3-dione for the Generation of Heterocyclic Scaffolds. The Journal of organic chemistry, 2020, 85, 12760-12769
4038822	CIF	C26 H20 B2 F8 N2 O	P 1 21/c 1	14.3987; 13.0464; 12.6405 90; 99.152; 90	2344.3	Pozharskii, Alexander F.; Dyablo, Olga V.; Pogosova, Olga G.; Ozeryanskii, Valery A.; Filarowski, Aleksander; Vasilikhina, Kseniya M.; Dzhangiryan, Narek A. Modeling Biologically Important NH···π Interactions Using <i>peri</i>-Disubstituted Naphthalenes. The Journal of organic chemistry, 2020, 85, 12468-12481
4038821	CIF	C18 H15 N O	P 1 21/c 1	9.4054; 14.334; 9.7907 90; 91.688; 90	1319.4	Pozharskii, Alexander F.; Dyablo, Olga V.; Pogosova, Olga G.; Ozeryanskii, Valery A.; Filarowski, Aleksander; Vasilikhina, Kseniya M.; Dzhangiryan, Narek A. Modeling Biologically Important NH···π Interactions Using <i>peri</i>-Disubstituted Naphthalenes. The Journal of organic chemistry, 2020, 85, 12468-12481
4038820	CIF	C17 H15 N O	P n a 21	6.165; 17.073; 12.098 90; 90; 90	1273.4	Pozharskii, Alexander F.; Dyablo, Olga V.; Pogosova, Olga G.; Ozeryanskii, Valery A.; Filarowski, Aleksander; Vasilikhina, Kseniya M.; Dzhangiryan, Narek A. Modeling Biologically Important NH···π Interactions Using <i>peri</i>-Disubstituted Naphthalenes. The Journal of organic chemistry, 2020, 85, 12468-12481
4038819	CIF	C19 H14 B F4 N	P 1 21/n 1	8.3874; 12.2927; 15.2185 90; 99.854; 90	1545.94	Pozharskii, Alexander F.; Dyablo, Olga V.; Pogosova, Olga G.; Ozeryanskii, Valery A.; Filarowski, Aleksander; Vasilikhina, Kseniya M.; Dzhangiryan, Narek A. Modeling Biologically Important NH···π Interactions Using <i>peri</i>-Disubstituted Naphthalenes. The Journal of organic chemistry, 2020, 85, 12468-12481
4038818	CIF	C18 H21 B F4 N2	P 1 21/c 1	12.1916; 9.9536; 14.3268 90; 100.697; 90	1708.35	Pozharskii, Alexander F.; Dyablo, Olga V.; Pogosova, Olga G.; Ozeryanskii, Valery A.; Filarowski, Aleksander; Vasilikhina, Kseniya M.; Dzhangiryan, Narek A. Modeling Biologically Important NH···π Interactions Using <i>peri</i>-Disubstituted Naphthalenes. The Journal of organic chemistry, 2020, 85, 12468-12481
4038817	CIF	C22 H20 B F4 N	P 1 21/n 1	12.0267; 8.0762; 19.1306 90; 96.044; 90	1847.83	Pozharskii, Alexander F.; Dyablo, Olga V.; Pogosova, Olga G.; Ozeryanskii, Valery A.; Filarowski, Aleksander; Vasilikhina, Kseniya M.; Dzhangiryan, Narek A. Modeling Biologically Important NH···π Interactions Using <i>peri</i>-Disubstituted Naphthalenes. The Journal of organic chemistry, 2020, 85, 12468-12481
4038816	CIF	C18 H18 B F4 N O	P -1	9.2376; 16.4663; 23.0599 101.102; 91.828; 103.786	3331.7	Pozharskii, Alexander F.; Dyablo, Olga V.; Pogosova, Olga G.; Ozeryanskii, Valery A.; Filarowski, Aleksander; Vasilikhina, Kseniya M.; Dzhangiryan, Narek A. Modeling Biologically Important NH···π Interactions Using <i>peri</i>-Disubstituted Naphthalenes. The Journal of organic chemistry, 2020, 85, 12468-12481
4038815	CIF	C19 H20 B F4 N O	P 1 21/n 1	15.456; 7.0443; 16.266 90; 91.746; 90	1770.2	Pozharskii, Alexander F.; Dyablo, Olga V.; Pogosova, Olga G.; Ozeryanskii, Valery A.; Filarowski, Aleksander; Vasilikhina, Kseniya M.; Dzhangiryan, Narek A. Modeling Biologically Important NH···π Interactions Using <i>peri</i>-Disubstituted Naphthalenes. The Journal of organic chemistry, 2020, 85, 12468-12481
4038814	CIF	C14 H15 N	P 1 21/c 1	8.7772; 14.3162; 17.4904 90; 97.518; 90	2178.88	Rodstein, Ilja; Prendes, Daniel Sowa; Wickert, Leon; Paaßen, Maurice; Gessner, Viktoria Selective Pd-Catalyzed Monoarylation of Small Primary Alkyl Amines through Backbone-Modification in Ylide-Functionalized Phosphines (YPhos). The Journal of organic chemistry, 2020
4038813	CIF	C40 H66 P2	P -1	10.1846; 10.2395; 18.2242 87.933; 86.219; 69.477	1775.85	Rodstein, Ilja; Prendes, Daniel Sowa; Wickert, Leon; Paaßen, Maurice; Gessner, Viktoria Selective Pd-Catalyzed Monoarylation of Small Primary Alkyl Amines through Backbone-Modification in Ylide-Functionalized Phosphines (YPhos). The Journal of organic chemistry, 2020
4038812	CIF	C38 H62 P2	P 1 21/c 1	10.29035; 20.32473; 16.76223 90; 100.361; 90	3448.63	Rodstein, Ilja; Prendes, Daniel Sowa; Wickert, Leon; Paaßen, Maurice; Gessner, Viktoria Selective Pd-Catalyzed Monoarylation of Small Primary Alkyl Amines through Backbone-Modification in Ylide-Functionalized Phosphines (YPhos). The Journal of organic chemistry, 2020
4038811	CIF	C44 H68 P2	P -1	9.3707; 9.9337; 10.031 90.2806; 93.674; 93.3011	930.24	Rodstein, Ilja; Prendes, Daniel Sowa; Wickert, Leon; Paaßen, Maurice; Gessner, Viktoria Selective Pd-Catalyzed Monoarylation of Small Primary Alkyl Amines through Backbone-Modification in Ylide-Functionalized Phosphines (YPhos). The Journal of organic chemistry, 2020
4038810	CIF	C80 H132 Au2 Cl2 O P4	P -1	10.22661; 10.50804; 18.1253 86.2203; 86.1003; 79.6142	1908.57	Rodstein, Ilja; Prendes, Daniel Sowa; Wickert, Leon; Paaßen, Maurice; Gessner, Viktoria Selective Pd-Catalyzed Monoarylation of Small Primary Alkyl Amines through Backbone-Modification in Ylide-Functionalized Phosphines (YPhos). The Journal of organic chemistry, 2020
4038809	CIF	C48 H81.54 Au Cl O2 P2	P 1 21/n 1	13.14401; 24.0935; 14.52671 90; 95.1545; 90	4581.79	Rodstein, Ilja; Prendes, Daniel Sowa; Wickert, Leon; Paaßen, Maurice; Gessner, Viktoria Selective Pd-Catalyzed Monoarylation of Small Primary Alkyl Amines through Backbone-Modification in Ylide-Functionalized Phosphines (YPhos). The Journal of organic chemistry, 2020
4038808	CIF	C45 H71 Cl2 O3 P2 Rh	P -1	10.92844; 12.69071; 18.62518 105.902; 94.5863; 113.405	2227.08	Rodstein, Ilja; Prendes, Daniel Sowa; Wickert, Leon; Paaßen, Maurice; Gessner, Viktoria Selective Pd-Catalyzed Monoarylation of Small Primary Alkyl Amines through Backbone-Modification in Ylide-Functionalized Phosphines (YPhos). The Journal of organic chemistry, 2020
4038807	CIF	C22.5 H22 Cl N O2 S	C 1 2/c 1	27.805; 10.095; 15.272 90; 96.621; 90	4258.1	Deng, Qingsong; Yu, Aimin; Zhou, Jie; Cao, Qin; Meng, Xiangtai Construction of Benzothiophene or Benzothiopheno[2,3-<i>e</i>]azepinedione Derivatives via Three-Component Domino or One-Pot Sequences. The Journal of organic chemistry, 2020, 85, 12270-12283
4038806	CIF	C25 H18 F N O2 S	P n a 21	13.6766; 12.8566; 11.474 90; 90; 90	2017.5	Deng, Qingsong; Yu, Aimin; Zhou, Jie; Cao, Qin; Meng, Xiangtai Construction of Benzothiophene or Benzothiopheno[2,3-<i>e</i>]azepinedione Derivatives via Three-Component Domino or One-Pot Sequences. The Journal of organic chemistry, 2020, 85, 12270-12283
4038805	CIF	C26 H21 N O2 S	P 1 21/c 1	15.6423; 16.3109; 8.6514 90; 101.62; 90	2162.1	Deng, Qingsong; Yu, Aimin; Zhou, Jie; Cao, Qin; Meng, Xiangtai Construction of Benzothiophene or Benzothiopheno[2,3-<i>e</i>]azepinedione Derivatives via Three-Component Domino or One-Pot Sequences. The Journal of organic chemistry, 2020, 85, 12270-12283
4038804	CIF	C24 H17 N O3 S	P -1	9.6034; 10.0317; 12.4075 99.201; 111.404; 102.937	1045.48	Deng, Qingsong; Yu, Aimin; Zhou, Jie; Cao, Qin; Meng, Xiangtai Construction of Benzothiophene or Benzothiopheno[2,3-<i>e</i>]azepinedione Derivatives via Three-Component Domino or One-Pot Sequences. The Journal of organic chemistry, 2020, 85, 12270-12283
4038803	CIF	C41 H40 N2 O4 S2	P n a 21	21.6005; 9.3977; 18.9366 90; 90; 90	3844	Deng, Qingsong; Yu, Aimin; Zhou, Jie; Cao, Qin; Meng, Xiangtai Construction of Benzothiophene or Benzothiopheno[2,3-<i>e</i>]azepinedione Derivatives via Three-Component Domino or One-Pot Sequences. The Journal of organic chemistry, 2020, 85, 12270-12283
4038802	CIF	C23 H19 N O3 S	C 1 2/c 1	17.59534; 10.30762; 22.2729 90; 106.229; 90	3878.58	Deng, Qingsong; Yu, Aimin; Zhou, Jie; Cao, Qin; Meng, Xiangtai Construction of Benzothiophene or Benzothiopheno[2,3-<i>e</i>]azepinedione Derivatives via Three-Component Domino or One-Pot Sequences. The Journal of organic chemistry, 2020, 85, 12270-12283
4038801	CIF	C21 H20 Br N O2 S	P 1 21/c 1	13.6616; 9.18547; 17.0339 90; 112.93; 90	1968.65	Deng, Qingsong; Yu, Aimin; Zhou, Jie; Cao, Qin; Meng, Xiangtai Construction of Benzothiophene or Benzothiopheno[2,3-<i>e</i>]azepinedione Derivatives via Three-Component Domino or One-Pot Sequences. The Journal of organic chemistry, 2020, 85, 12270-12283
4038800	CIF	C56 H48 N4	P 1 21/n 1	12.124; 21.984; 16.7347 90; 96.781; 90	4429.2	Rakshit, Amitava; Kumar, Prashant; Alam, Tipu; Dhara, Hirendranath; Patel, Bhisma K. Visible-Light-Accelerated Pd-Catalyzed Cascade Addition/Cyclization of Arylboronic Acids to γ- and β-Ketodinitriles for the Construction of 3-Cyanopyridines and 3-Cyanopyrrole Analogues. The Journal of organic chemistry, 2020, 85, 12482-12504
4038799	CIF	C112 H136 Cl12 O6	P -1	12.338; 15.813; 15.886 62.331; 80.881; 68.02	2545	Iuliano, Veronica; Talotta, Carmen; Gaeta, Carmine; Hickey, Neal; Geremia, Silvano; Vatsouro, Ivan; Kovalev, Vladimir; Neri, Placido Influence of <i>exo</i>-Adamantyl Groups and <i>endo</i>-OH Functions on the Threading of Calix[6]arene Macrocycle. The Journal of organic chemistry, 2020, 85, 12585-12593
4038798	CIF	C128.25 H170.25 Cl6.75 O6	P -1	12.959; 15.165; 29.378 75.8; 86.69; 86.896	5583	Iuliano, Veronica; Talotta, Carmen; Gaeta, Carmine; Hickey, Neal; Geremia, Silvano; Vatsouro, Ivan; Kovalev, Vladimir; Neri, Placido Influence of <i>exo</i>-Adamantyl Groups and <i>endo</i>-OH Functions on the Threading of Calix[6]arene Macrocycle. The Journal of organic chemistry, 2020, 85, 12585-12593
4038797	CIF	C9 H14 O2 S2	P 1 21 1	11.774; 6.7993; 13.767 90; 101.189; 90	1081.2	Wang, Panpan; Jiang, Qian; Zhao, Ruibo; Xie, Xingang; Tang, Shouchu; Wang, Xiaolei Enantioselective α-Functionalization of 1,3-Dithianes by Iridium-Catalyzed Allylic Substitution. The Journal of organic chemistry, 2020, 85, 12456-12467
4038796	CIF	C15 H18 O S2	P 1 21 1	8.4921; 11.0952; 8.7511 90; 118.324; 90	725.83	Wang, Panpan; Jiang, Qian; Zhao, Ruibo; Xie, Xingang; Tang, Shouchu; Wang, Xiaolei Enantioselective α-Functionalization of 1,3-Dithianes by Iridium-Catalyzed Allylic Substitution. The Journal of organic chemistry, 2020, 85, 12456-12467
4038795	CIF	C20 H21 F3 N2 O7	P 21 21 21	7.13243; 12.32391; 29.4905 90; 90; 90	2592.2	Li, Luyao; Yang, Tianxiao; Zhang, Tao; Zhu, Bo; Chang, Junbiao Organocatalytic Asymmetric Tandem Cyclization/Michael Addition via Oxazol-5(2<i>H</i>)-One Formation: Access to Perfluoroalkyl-Containing <i>N</i>,<i>O</i>-Acetal Derivatives. The Journal of organic chemistry, 2020, 85, 12294-12303
4038794	CIF	C41 H48 N4 O	P 1 21 1	12.5152; 8.1909; 18.3478 90; 109.467; 90	1773.3	Selby, Joshua; Holzapfel, Marco; Lombe, Blaise Kimbadi; Schmidt, David; Krause, Ana-Maria; Würthner, Frank; Bringmann, Gerhard; Lambert, Christoph Chiroptical Properties of Indolenine Squaraines with a Stereogenic Center at Close Proximity. The Journal of organic chemistry, 2020, 85, 12227-12242
4038793	CIF	C47 H44 N4 O	P 1 21 1	9.5514; 10.8418; 18.966 90; 102.372; 90	1918.4	Selby, Joshua; Holzapfel, Marco; Lombe, Blaise Kimbadi; Schmidt, David; Krause, Ana-Maria; Würthner, Frank; Bringmann, Gerhard; Lambert, Christoph Chiroptical Properties of Indolenine Squaraines with a Stereogenic Center at Close Proximity. The Journal of organic chemistry, 2020, 85, 12227-12242
4038792	CIF	C11 H9 N3 O	P -1	7.073; 8.1167; 8.7016 86.895; 81.037; 71.308	467.42	Wang, Jian; Li, Jiang-Hua; Guo, Yidong; Dong, Hongbo; Liu, Qiang; Yu, Xiao-Qi TEMPO-Mediated C-H Amination of Benzoxazoles with N-Heterocycles. The Journal of organic chemistry, 2020, 85, 12797-12803
4038791	CIF	C39 H28 Br N O6 S	P 41 21 2	23.9795; 23.9795; 13.6928 90; 90; 90	7873.58	Yan, Juzhang; Li, Xiaoping; Chen, Yuzhen; Li, Ying; Chen, Weiwen; Zhan, Ruoting; Huang, Huicai Organocatalytic 1,4-Addition of Azadienes with 3-Homoacyl Coumarins toward Highly Enantioenriched Benzofuran Coumarin Skeletons. The Journal of organic chemistry, 2020, 85, 12175-12186
4038790	CIF	C16 H15 O4 P	P b c a	13.6; 7.1637; 29.5605 90; 90; 90	2879.97	Shu, Zhihao; Zhou, Jianhui; Li, Junyou; Cheng, Yilang; Liu, Hong; Wang, Dechuan; Zhou, Yu Rh(III)-Catalyzed Dual C-H Functionalization/Cyclization Cascade by a Removable Directing Group: A Method for Synthesis of Polycyclic Fused Pyrano[<i>de</i>]Isochromenes. The Journal of organic chemistry, 2020, 85, 12097-12107
4038789	CIF	C17 H22 O8 P2	C 1 2/c 1	22.428; 8.079; 10.933 90; 101.949; 90	1938.1	Shu, Zhihao; Zhou, Jianhui; Li, Junyou; Cheng, Yilang; Liu, Hong; Wang, Dechuan; Zhou, Yu Rh(III)-Catalyzed Dual C-H Functionalization/Cyclization Cascade by a Removable Directing Group: A Method for Synthesis of Polycyclic Fused Pyrano[<i>de</i>]Isochromenes. The Journal of organic chemistry, 2020, 85, 12097-12107
4038788	CIF	C22 H32 N2 O9 P2	P 1 21/c 1	10.246; 21.331; 12.725 90; 113.59; 90	2548.7	Shu, Zhihao; Zhou, Jianhui; Li, Junyou; Cheng, Yilang; Liu, Hong; Wang, Dechuan; Zhou, Yu Rh(III)-Catalyzed Dual C-H Functionalization/Cyclization Cascade by a Removable Directing Group: A Method for Synthesis of Polycyclic Fused Pyrano[<i>de</i>]Isochromenes. The Journal of organic chemistry, 2020, 85, 12097-12107
4038787	CIF	C16 H16 N2	P b c a	11.62377; 11.62379; 19.3359 90; 90; 90	2612.52	Aksenov, Nicolai A.; Aksenov, Dmitrii A.; Skomorokhov, Anton A.; Prityko, Lidiya A.; Aksenov, Alexander V.; Griaznov, Georgii D.; Rubin, Michael Synthesis of 2-(1<i>H</i>-Indol-2-yl)acetamides via Brønsted Acid-Assisted Cyclization Cascade. The Journal of organic chemistry, 2020, 85, 12128-12146
4038786	CIF	C35 H25 F N2 O6 S	P n a 21	15.1594; 13.7549; 14.4974 90; 90; 90	3022.9	Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry, 2020, 85, 12117-12127
4038785	CIF	C36 H28 N2 O6 S	P 1 21/n 1	8.3197; 18.7648; 19.0758 90; 95.6621; 90	2963.5	Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry, 2020, 85, 12117-12127
4038784	CIF	C32 H27 F N2 O6 S	P -1	8.3862; 11.0478; 15.4388 91.9752; 96.6881; 102.411	1384.85	Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry, 2020, 85, 12117-12127
4038783	CIF	C32 H27 Cl N2 O6 S	P -1	8.426; 11.0834; 15.3702 91.376; 96.474; 102.111	1392.8	Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry, 2020, 85, 12117-12127
4038782	CIF	C32 H28 N2 O6 S	P -1	11.444; 11.462; 12.299 88.192; 63.357; 73.396	1373	Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry, 2020, 85, 12117-12127
4038781	CIF	C28 H19 Cl N2 O6 S	P -1	10.2791; 11.3288; 11.7187 90.027; 114.297; 94.437	1239.3	Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry, 2020, 85, 12117-12127
4038780	CIF	C28 H20 N2 O6 S	P -1	10.1008; 11.3688; 11.6597 82.638; 64.947; 81.864	1197.3	Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry, 2020, 85, 12117-12127
4038779	CIF	C25 H20 N2 O4 S	P 1 21/n 1	14.2296; 8.9965; 20.0891 90; 96.003; 90	2557.6	Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry, 2020, 85, 12117-12127
4038778	CIF	C24 H18 N2 O4 S	P -1	8.9949; 12.2989; 12.9055 63.957; 71.155; 75.637	1204.46	Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry, 2020, 85, 12117-12127
4038777	CIF	C36 H28 N2 O5 S	P 1 21/c 1	14.3741; 11.5458; 17.6215 90; 97.324; 90	2900.6	Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry, 2020, 85, 12117-12127
4038776	CIF	C32 H26 N2 O4 S	P -1	8.9799; 10.3963; 15.1711 96.679; 97.41; 106.252	1331	Sun, Quan-Shun; Sun, Jing; Pan, Liu-Na; Yan, Chao-Guo Selective Construction of Diverse Polycyclic Spirooxindoles via a Three-Component Reaction of Cyclic Mercapto-Substituted β-Enamino Esters, Isatins, and Cyclic 1,3-Diketones. The Journal of organic chemistry, 2020, 85, 12117-12127
4038775	CIF	C25 H32 O7	P 21 21 21	8.1574; 13.7272; 20.3329 90; 90; 90	2276.84	Chen, Shu-Rong; Wang, Shih-Wei; Sheu, Jyh-Horng; Chang, Ting-Hsuan; Cheng, Yuan-Bin Zoanthamine Alkaloid Derivatives from the Zoantharian <i>Zoanthus vietnamensis</i> with Antimetastatic Activity. The Journal of organic chemistry, 2020, 85, 12553-12560
4038774	CIF	C11 H12 N2 S	P -1	6.5847; 8.4285; 9.4274 89.0396; 72.6274; 80.7426	492.57	Geng, Xinyu; Liu, Siyuan; Wang, Wenyao; Qu, Jingping; Wang, Baomin <i>tert</i>-Amino Effect-Promoted Rearrangement of Aryl Isothiocyanate: A Versatile Approach to Benzimidazothiazepines and Benzimidazothioethers. The Journal of organic chemistry, 2020, 85, 12635-12643
4038773	CIF	C14 H25 N3 O7	P 1 21 1	9.5051; 8.8409; 20.79 90; 90.242; 90	1747	Richaud, Alexis D.; Roche, Stéphane P Structure-Property Relationship Study of <i>N</i>-(Hydroxy)Peptides for the Design of Self-Assembled Parallel β-Sheets. The Journal of organic chemistry, 2020, 85, 12329-12342
4038772	CIF	C18 H17 Cl F N2 O2 S	P -1	9.244; 12.1783; 16.9973 88.74; 82.005; 79.455	1862.9	Feberero, Claudia; Sedano, Carlos; Suárez-Pantiga, Samuel; López, Carlos Silva; Sanz, Roberto Experimental and Computational Study of the 1,5-O →N Carbamoyl Snieckus-Fries-Type Rearrangement. The Journal of organic chemistry, 2020, 85, 12561-12578
4038771	CIF	C18 H29 N3 O2	P 1 21/n 1	8.066; 15.096; 14.762 90; 104.125; 90	1743.1	Feberero, Claudia; Sedano, Carlos; Suárez-Pantiga, Samuel; López, Carlos Silva; Sanz, Roberto Experimental and Computational Study of the 1,5-O →N Carbamoyl Snieckus-Fries-Type Rearrangement. The Journal of organic chemistry, 2020, 85, 12561-12578
4038770	CIF	C15 H22 N2 O2	P 1 21/n 1	10.4657; 15.208; 19.367 90; 100.511; 90	3030.8	Feberero, Claudia; Sedano, Carlos; Suárez-Pantiga, Samuel; López, Carlos Silva; Sanz, Roberto Experimental and Computational Study of the 1,5-O →N Carbamoyl Snieckus-Fries-Type Rearrangement. The Journal of organic chemistry, 2020, 85, 12561-12578
4038769	CIF	C26 H28 Cl N3 O2	P 1 21/n 1	12.1225; 12.8572; 15.2915 90; 92.451; 90	2381.2	Feberero, Claudia; Sedano, Carlos; Suárez-Pantiga, Samuel; López, Carlos Silva; Sanz, Roberto Experimental and Computational Study of the 1,5-O →N Carbamoyl Snieckus-Fries-Type Rearrangement. The Journal of organic chemistry, 2020, 85, 12561-12578
4038768	CIF	C24 H26 N2 O2	P 1 21/n 1	9.495; 15.333; 14.547 90; 100.886; 90	2080	Feberero, Claudia; Sedano, Carlos; Suárez-Pantiga, Samuel; López, Carlos Silva; Sanz, Roberto Experimental and Computational Study of the 1,5-O →N Carbamoyl Snieckus-Fries-Type Rearrangement. The Journal of organic chemistry, 2020, 85, 12561-12578
4038767	CIF	C18 H18 Cl2 N2 O3	P b c a	13.8795; 11.3828; 23.518 90; 90; 90	3715.6	Feberero, Claudia; Sedano, Carlos; Suárez-Pantiga, Samuel; López, Carlos Silva; Sanz, Roberto Experimental and Computational Study of the 1,5-O →N Carbamoyl Snieckus-Fries-Type Rearrangement. The Journal of organic chemistry, 2020, 85, 12561-12578
4038766	CIF	C19 H22 N2 O3 S	P -1	8.596; 10.656; 11.508 107.17; 97.829; 103.488	955.2	Feberero, Claudia; Sedano, Carlos; Suárez-Pantiga, Samuel; López, Carlos Silva; Sanz, Roberto Experimental and Computational Study of the 1,5-O →N Carbamoyl Snieckus-Fries-Type Rearrangement. The Journal of organic chemistry, 2020, 85, 12561-12578
4038765	CIF	C25 H27 Cl N2 O4 S	P 21 21 21	10.906; 13.6614; 16.6806 90; 90; 90	2485.3	Feberero, Claudia; Sedano, Carlos; Suárez-Pantiga, Samuel; López, Carlos Silva; Sanz, Roberto Experimental and Computational Study of the 1,5-O →N Carbamoyl Snieckus-Fries-Type Rearrangement. The Journal of organic chemistry, 2020, 85, 12561-12578
4038764	CIF	C19 H17 N O2	P 1 21/n 1	5.942; 26.684; 9.9612 90; 104.342; 90	1530.2	Wang, Shifang; Liu, Xiaowei; Zhu, Dongsheng; Wang, Mang Copper-Catalyzed Ring-Opening Defluorinative Alkylation of Siloxydifluorocyclopropanes: Synthesis of γ-Fluoro-δ-Ketoesters and γ,δ-Diketonitriles. The Journal of organic chemistry, 2020, 85, 12408-12417
4038763	CIF	C20 H21 F O3	P 1 21/c 1	20.058; 14.261; 6.1046 90; 91.741; 90	1745.4	Wang, Shifang; Liu, Xiaowei; Zhu, Dongsheng; Wang, Mang Copper-Catalyzed Ring-Opening Defluorinative Alkylation of Siloxydifluorocyclopropanes: Synthesis of γ-Fluoro-δ-Ketoesters and γ,δ-Diketonitriles. The Journal of organic chemistry, 2020, 85, 12408-12417
4038762	CIF	C23 H15 N O2 S2	P 1 21/c 1	13.7554; 7.8485; 18.5 90; 110.617; 90	1869.3	Chen, Xia; Zhang, Lianpeng; Wang, Yuzhe; Qiu, Guanyinsheng; Liang, Qinghui; Zhou, Hongwei Copper-Catalyzed Tandem Radical Cyclization of 8-Ethynyl-1-naphthyl-amines for the Synthesis of 2<i>H</i>-Benzo[<i>e</i>][1,2]thiazine 1,1-Dioxides and its Fluorescence Properties. The Journal of organic chemistry, 2020, 85, 12526-12534
4038761	CIF	C68 H58 N2 O8 Rh2	P 1 21 1	9.8716; 18.221; 18.301 90; 91.066; 90	3291.2	Wertz, Benjamin; Ren, Zhi; Bacsa, John; Musaev, Djamaladdin G.; Davies, Huw M. L. Comparison of 1,2-Diarylcyclopropanecarboxylates with 1,2,2-Triarylcyclopropanecarboxylates as Chiral Ligands for Dirhodium-Catalyzed Cyclopropanation and C-H Functionalization. The Journal of organic chemistry, 2020
4038760	CIF	C87 H71 Br8 N O8 Rh2	P 21 21 21	16.21; 19.2876; 25.619 90; 90; 90	8009.8	Wertz, Benjamin; Ren, Zhi; Bacsa, John; Musaev, Djamaladdin G.; Davies, Huw M. L. Comparison of 1,2-Diarylcyclopropanecarboxylates with 1,2,2-Triarylcyclopropanecarboxylates as Chiral Ligands for Dirhodium-Catalyzed Cyclopropanation and C-H Functionalization. The Journal of organic chemistry, 2020
4038759	CIF	C72 H64 N4 O8 Rh2	P 1 21 1	9.896; 21.172; 14.8082 90; 100.901; 90	3046.6	Wertz, Benjamin; Ren, Zhi; Bacsa, John; Musaev, Djamaladdin G.; Davies, Huw M. L. Comparison of 1,2-Diarylcyclopropanecarboxylates with 1,2,2-Triarylcyclopropanecarboxylates as Chiral Ligands for Dirhodium-Catalyzed Cyclopropanation and C-H Functionalization. The Journal of organic chemistry, 2020
4038758	CIF	C78 H68 O8 Rh2	P 21 21 2	31.5424; 8.3838; 11.996 90; 90; 90	3172.28	Wertz, Benjamin; Ren, Zhi; Bacsa, John; Musaev, Djamaladdin G.; Davies, Huw M. L. Comparison of 1,2-Diarylcyclopropanecarboxylates with 1,2,2-Triarylcyclopropanecarboxylates as Chiral Ligands for Dirhodium-Catalyzed Cyclopropanation and C-H Functionalization. The Journal of organic chemistry, 2020
4038757	CIF	C18 H17 Br F N O2	P -1	6.8494; 10.5416; 11.8942 78.408; 89.07; 86.152	839.39	Zhang, Lili; Deng, Kezuan; Wu, Gaorong; Yang, Jinyue; Tang, Shibiao; Fu, Xiaopan; Xia, Chengcai; Ji, Yafei Ruthenium(II)-Catalyzed α-Fluoroalkenylation of Oxime Ethers with <i>gem</i>-Difluorostyrenes <i>via</i> C-H Activation and C-F Cleavage. The Journal of organic chemistry, 2020, 85, 12670-12681
4038756	CIF	C22 H12 N2 S	P 1 21/c 1	12.0548; 10.6734; 13.4266 90; 97.826; 90	1711.5	Sodre, Elaine R.; Guido, Bruna C.; de Souza, Paulo E. N.; Machado, Daniel F. S.; Carvalho-Silva, Valter H; Chaker, Juliano A.; Gatto, Claudia C.; Correa, Jose R.; Fernandes, Talita de A; Neto, Brenno A. D. Deciphering the Dynamics of Organic Nanoaggregates with AIEE Effect and Excited States: Lipophilic Benzothiadiazole Derivatives as Selective Cell Imaging Probes. The Journal of organic chemistry, 2020, 85, 12614-12634
4038755	CIF	C14 H7 Br N2 S	P 1 21/n 1	13.453; 4.8445; 19.075 90; 99.076; 90	1227.6	Sodre, Elaine R.; Guido, Bruna C.; de Souza, Paulo E. N.; Machado, Daniel F. S.; Carvalho-Silva, Valter H; Chaker, Juliano A.; Gatto, Claudia C.; Correa, Jose R.; Fernandes, Talita de A; Neto, Brenno A. D. Deciphering the Dynamics of Organic Nanoaggregates with AIEE Effect and Excited States: Lipophilic Benzothiadiazole Derivatives as Selective Cell Imaging Probes. The Journal of organic chemistry, 2020, 85, 12614-12634
4038754	CIF	C13 H9 F N2 O2 S	F d d 2	19.2656; 33.47; 7.2379 90; 90; 90	4667.1	Nguyen, Thi Mo; Cao, Hoang Anh; Thuong Cao, Thi Thuong; Koyama, Satoki; Mac, Dinh Hung; Nguyen, Thanh Binh Access to [2,1]Benzothiazine <i>S</i>,<i>S</i>-Dioxides from β-Substituted <i>o</i>-Nitrostyrenes and Sulfur. The Journal of organic chemistry, 2020, 85, 12058-12066
4038753	CIF	C13 H9 F N2 O2 S	P 21 21 21	7.3094; 11.286; 18.0876 90; 90; 90	1492.12	Nguyen, Thi Mo; Cao, Hoang Anh; Thuong Cao, Thi Thuong; Koyama, Satoki; Mac, Dinh Hung; Nguyen, Thanh Binh Access to [2,1]Benzothiazine <i>S</i>,<i>S</i>-Dioxides from β-Substituted <i>o</i>-Nitrostyrenes and Sulfur. The Journal of organic chemistry, 2020, 85, 12058-12066
4038752	CIF	C13 H13 N O4	F d d 2	25.037; 26.193; 7.1427 90; 90; 90	4684.1	Zhang, Sheng; Li, He; Yamamoto, Yoshinori; Bao, Ming Synthesis of 1H-Indole-2,3-dicarboxylates via Rhodium-catalyzed C-H Annulation of Arylhydrazines with Maleates. The Journal of organic chemistry, 2020
4038751	CIF	C11 H10 F3 N O	P b c a	8.6036; 11.7912; 21.27 90; 90; 90	2157.8	Chernykh, Anton V.; Olifir, Oleksandr S.; Kuchkovska, Yuliya O.; Volochnyuk, Dmitriy M.; Yarmolchuk, Vladimir S.; Grygorenko, Oleksandr O. Fluoroalkyl-Substituted Cyclopropane Derivatives: Synthesis and Physicochemical Properties. The Journal of organic chemistry, 2020, 85, 12692-12702
4038750	CIF	C4 H8 Cl F2 N	P -1	6.0157; 7.4732; 7.6279 106.605; 105.053; 91.961	315.16	Chernykh, Anton V.; Olifir, Oleksandr S.; Kuchkovska, Yuliya O.; Volochnyuk, Dmitriy M.; Yarmolchuk, Vladimir S.; Grygorenko, Oleksandr O. Fluoroalkyl-Substituted Cyclopropane Derivatives: Synthesis and Physicochemical Properties. The Journal of organic chemistry, 2020, 85, 12692-12702
4038749	CIF	C11 H10 F3 N O	P 1 21/n 1	5.1598; 11.2723; 17.688 90; 93.058; 90	1027.3	Chernykh, Anton V.; Olifir, Oleksandr S.; Kuchkovska, Yuliya O.; Volochnyuk, Dmitriy M.; Yarmolchuk, Vladimir S.; Grygorenko, Oleksandr O. Fluoroalkyl-Substituted Cyclopropane Derivatives: Synthesis and Physicochemical Properties. The Journal of organic chemistry, 2020, 85, 12692-12702
4038748	CIF	C5 H6 F2 O2	P 1 21/c 1	5.422; 8.6988; 12.1636 90; 94.341; 90	572.05	Chernykh, Anton V.; Olifir, Oleksandr S.; Kuchkovska, Yuliya O.; Volochnyuk, Dmitriy M.; Yarmolchuk, Vladimir S.; Grygorenko, Oleksandr O. Fluoroalkyl-Substituted Cyclopropane Derivatives: Synthesis and Physicochemical Properties. The Journal of organic chemistry, 2020, 85, 12692-12702
4038747	CIF	C30 H25 N3 O4 S	C 1 2/c 1	30.4299; 8.50556; 22.1713 90; 112.626; 90	5296.81	Yuan, Wei-Cheng; Quan, Bao-Xue; Zhao, Jian-Qiang; You, Yong; Wang, Zhen-Hua; Zhou, Ming-Qiang [4 + 2] Annulation Reaction of <i>In Situ</i> Generated Azoalkenes with Azlactones: Access to 4,5-Dihydropyridazin-3(2<i>H</i>)-Ones. The Journal of organic chemistry, 2020
4038746	CIF	C28 H24 Br Cl2 N O2	P -1	9.9075; 11.5025; 12.5629 110.42; 95.401; 112.56	1195.28	Marinova, Maya; Pascal, Simon; Guénée, Laure; Besnard, Céline; Shivachev, Boris; Kostova, Kalina; Villani, Claudio; Franzini, Roberta; Dimitrov, Vladimir; Lacour, Jérôme Synthesis, Resolution, Configurational Stability, and Properties of Cationic Functionalized [5]Helicenes. The Journal of organic chemistry, 2020, 85, 11908-11923
4038745	CIF	C29 H28 Br N O4	P 1 21/n 1	8.9485; 21.3763; 13.2147 90; 99.059; 90	2496.25	Marinova, Maya; Pascal, Simon; Guénée, Laure; Besnard, Céline; Shivachev, Boris; Kostova, Kalina; Villani, Claudio; Franzini, Roberta; Dimitrov, Vladimir; Lacour, Jérôme Synthesis, Resolution, Configurational Stability, and Properties of Cationic Functionalized [5]Helicenes. The Journal of organic chemistry, 2020, 85, 11908-11923
4038744	CIF	C23 H11 Br O3	P 1 21/c 1	20.2508; 4.24318; 19.0965 90; 106.186; 90	1575.88	Marinova, Maya; Pascal, Simon; Guénée, Laure; Besnard, Céline; Shivachev, Boris; Kostova, Kalina; Villani, Claudio; Franzini, Roberta; Dimitrov, Vladimir; Lacour, Jérôme Synthesis, Resolution, Configurational Stability, and Properties of Cationic Functionalized [5]Helicenes. The Journal of organic chemistry, 2020, 85, 11908-11923
4038743	CIF	C55 H44 B2 Br2 Cl2 F8 N2 O4	P 1	7.7507; 12.3048; 13.5177 104.972; 95.439; 94.459	1232.8	Marinova, Maya; Pascal, Simon; Guénée, Laure; Besnard, Céline; Shivachev, Boris; Kostova, Kalina; Villani, Claudio; Franzini, Roberta; Dimitrov, Vladimir; Lacour, Jérôme Synthesis, Resolution, Configurational Stability, and Properties of Cationic Functionalized [5]Helicenes. The Journal of organic chemistry, 2020, 85, 11908-11923
4038742	CIF	C29 H26 B Br F4 N2	P -1	12.7765; 16.0668; 17.3836 77.279; 80.071; 80.432	3398.1	Marinova, Maya; Pascal, Simon; Guénée, Laure; Besnard, Céline; Shivachev, Boris; Kostova, Kalina; Villani, Claudio; Franzini, Roberta; Dimitrov, Vladimir; Lacour, Jérôme Synthesis, Resolution, Configurational Stability, and Properties of Cationic Functionalized [5]Helicenes. The Journal of organic chemistry, 2020, 85, 11908-11923
4038741	CIF	C24 H14 B Br F4 O3	P -1	8.8561; 9.3777; 14.1453 91.724; 98.862; 116.907	1028.42	Marinova, Maya; Pascal, Simon; Guénée, Laure; Besnard, Céline; Shivachev, Boris; Kostova, Kalina; Villani, Claudio; Franzini, Roberta; Dimitrov, Vladimir; Lacour, Jérôme Synthesis, Resolution, Configurational Stability, and Properties of Cationic Functionalized [5]Helicenes. The Journal of organic chemistry, 2020, 85, 11908-11923
4038740	CIF	C23 H12 B Br F4 O2	P -1	8.406; 8.466; 14.6974 89.549; 77.343; 66.477	932.01	Marinova, Maya; Pascal, Simon; Guénée, Laure; Besnard, Céline; Shivachev, Boris; Kostova, Kalina; Villani, Claudio; Franzini, Roberta; Dimitrov, Vladimir; Lacour, Jérôme Synthesis, Resolution, Configurational Stability, and Properties of Cationic Functionalized [5]Helicenes. The Journal of organic chemistry, 2020, 85, 11908-11923
4038739	CIF	C19 H22 O4	P 1 21 1	7.7605; 9.6596; 11.3533 90; 101.556; 90	833.829	Zhong, Weimao; Chen, Yuchan; Mai, Zhimao; Wei, Xiaoyi; Wang, Junfeng; Zeng, Qi; Chen, Xiayu; Tian, Xinpeng; Zhang, Weimin; Wang, Fazuo; Zhang, Si Euroticins A and B, Two Pairs of Highly Constructed Salicylaldehyde Derivative Enantiomers from a Marine-Derived Fungus Eurotium sp. SCSIO F452 The Journal of Organic Chemistry, 2020
4038738	CIF	C19 H22 O4	P 43 21 2	10.7042; 10.7042; 30.0297 90; 90; 90	3440.8	Zhong, Weimao; Chen, Yuchan; Mai, Zhimao; Wei, Xiaoyi; Wang, Junfeng; Zeng, Qi; Chen, Xiayu; Tian, Xinpeng; Zhang, Weimin; Wang, Fazuo; Zhang, Si Euroticins A and B, Two Pairs of Highly Constructed Salicylaldehyde Derivative Enantiomers from a Marine-Derived Fungus Eurotium sp. SCSIO F452 The Journal of Organic Chemistry, 2020
4038737	CIF	C30 H17 F6 N	P 1 21/c 1	27.2097; 4.6842; 18.3065 90; 105.415; 90	2249.33	Molenda, Ricardo; Boldt, Sebastian; Villinger, Alexander; Ehlers, Peter; Langer, Peter Synthesis of 2-Azapyrenes and Their Photophysical and Electrochemical Properties. The Journal of organic chemistry, 2020
4038736	CIF	C28 H19 N	P c c n	31.461; 32.311; 7.4331 90; 90; 90	7556	Molenda, Ricardo; Boldt, Sebastian; Villinger, Alexander; Ehlers, Peter; Langer, Peter Synthesis of 2-Azapyrenes and Their Photophysical and Electrochemical Properties. The Journal of organic chemistry, 2020
4038735	CIF	C18 H31 N4 P	P 1 21/n 1	7.0785; 30.538; 8.6896 90; 93.553; 90	1874.8	Marchenko, Anatoliy; Koidan, Georgyi; Hurieva, Anastasiia N.; Shishkina, Svitlana; Rusanov, Eduard; Kostyuk, Aleksandr Ring Enlargement of <i>N</i>-Phosphanyl-1,2,3,4-tetrahydroquinazolines. The Journal of organic chemistry, 2020
4038734	CIF	C17 H29 N2 P	P 4/n :2	26.9636; 26.9636; 9.7516 90; 90; 90	7089.8	Marchenko, Anatoliy; Koidan, Georgyi; Hurieva, Anastasiia N.; Shishkina, Svitlana; Rusanov, Eduard; Kostyuk, Aleksandr Ring Enlargement of <i>N</i>-Phosphanyl-1,2,3,4-tetrahydroquinazolines. The Journal of organic chemistry, 2020
4038733	CIF	C23 H34 N5 P	P 1 21 1	7.4743; 16.7492; 9.742 90; 111.695; 90	1133.2	Marchenko, Anatoliy; Koidan, Georgyi; Hurieva, Anastasiia N.; Shishkina, Svitlana; Rusanov, Eduard; Kostyuk, Aleksandr Ring Enlargement of <i>N</i>-Phosphanyl-1,2,3,4-tetrahydroquinazolines. The Journal of organic chemistry, 2020
4038732	CIF	C24 H36 N5 P	P 1 21/c 1	11.7479; 13.1447; 16.1419 90; 108.509; 90	2363.74	Marchenko, Anatoliy; Koidan, Georgyi; Hurieva, Anastasiia N.; Shishkina, Svitlana; Rusanov, Eduard; Kostyuk, Aleksandr Ring Enlargement of <i>N</i>-Phosphanyl-1,2,3,4-tetrahydroquinazolines. The Journal of organic chemistry, 2020
4038731	CIF	C21 H20 N O4 P S	C 1 c 1	11.6904; 14.6998; 11.3235 90; 91.493; 90	1945.24	Luo, Wenjun; Wang, Zhenguo; Cao, Xiaohui; Liang, Dacheng; Wei, Mingjie; Yin, Keshu; Li, Le Construction of Benzo-1,2,3-thiazaphosphole Heterocycles by Annulations of ortho-Phosphinoarenesulfonyl Fluorides with Trimethylsilyl Azide The Journal of Organic Chemistry, 2020
4038730	CIF	C16 H11 Br N2 O3	P 21 21 21	8.1688; 8.8842; 20.4503 90; 90; 90	1484.14	Dong, Xiaodi; Tang, Zhishun; Ye, Ling; Shi, Zhichuan; Zhao, Zhigang; Li, Xuefeng Stereoselective Synthesis of Dihydrofuranoindoles via the Friedel-Crafts Alkylation/Annulation Cascade Process. The Journal of organic chemistry, 2020
4038729	CIF	C10 H8 N2 S	P -1	9.2794; 9.3445; 10.356 89.2189; 89.7152; 82.646	890.51	Wang, Haofeng; Wu, Xin; Wang, Luyu; Li, Erfei; Li, Xiaoyu; Tong, Tao; Kang, Honglan; Xie, Jian-Wu; Shen, Guodong; Lv, Xin One-Pot Synthesis of Benzimidazo[2,1-b]thiazoline Derivatives through An Addition/Cyclization/Oxidative Coupling Reaction. The Journal of organic chemistry, 2020
4038728	CIF	C21 H20 F0.25 N O6	P 1 21/c 1	12.849; 11.07235; 13.347 90; 103.715; 90	1844.71	Liu, Liang; Yang, De-Yong; He, Yan-Hong; Guan, Zhi Redox-Neutral Photocatalytic Radical Cascade Cyclization for the Synthesis of CH<sub>2</sub>CN/CF<sub>2</sub>COOEt/CF<sub>3</sub>-Containing Benzo[4,5]imidazo[2,1-<i>a</i>]isoquinolin-6(5<i>H</i>)-One Derivatives. The Journal of organic chemistry, 2020
4038727	CIF	C15 H19.44 O3	P 21 21 21	7.9886; 9.9248; 16.34 90; 90; 90	1295.52	Shao, Hui; Wang, Yun-Peng; Fang, Kun; Zhao, Yu-Ming; Tu, Yong-Qiang Total Synthesis of Sieboldine A. The Journal of organic chemistry, 2020
4038726	CIF	C80 H64 Cl6 N2 Pd	P -1	12.0249; 14.3002; 21.4777 96.356; 92.889; 91.174	3664.6	Yang, Xu-Wen; Li, Dong-Hui; Song, A-Xiang; Liu, Feng-Shou "Bulky-Yet-Flexible" α-Diimine Palladium-Catalyzed Reductive Heck Cross-Coupling: Highly Anti-Markovnikov-Selective Hydroarylation of Alkene in Air. The Journal of organic chemistry, 2020
4038725	CIF	C52.75 H39.5 Cl3.5 F2 N2 Pd	P 1 21/c 1	18.9995; 26.206; 35.374 90; 96.956; 90	17483.1	Yang, Xu-Wen; Li, Dong-Hui; Song, A-Xiang; Liu, Feng-Shou "Bulky-Yet-Flexible" α-Diimine Palladium-Catalyzed Reductive Heck Cross-Coupling: Highly Anti-Markovnikov-Selective Hydroarylation of Alkene in Air. The Journal of organic chemistry, 2020
4038724	CIF	C23 H29 F O7	C 1 2 1	15.424; 9.5366; 17.1423 90; 115.321; 90	2279.25	Ding, Ya-Nan; Shi, Wei-Yu; Liu, Ce; Zheng, Nian; Li, Ming; An, Yang; Zhang, Zhe; Wang, Cui-Tian; Zhang, Bo-Sheng; Liang, Yong-Min Palladium-Catalyzed ortho-C-H Glycosylation/ipso-Alkenylation of Aryl Iodides. The Journal of organic chemistry, 2020
4038723	CIF	C54 H56 Br2 O8	C 1 2/c 1	13.3525; 25.8179; 16.7371 90; 90.507; 90	5769.61	Li, Jing; Han, Xiao-Ni; Zhou, He-Ye; Han, Ying; Chen, Chuan-Feng Helic[1]triptycene[3]arene: Synthesis, Complexation and Formation of [2]Rotaxane Shuttle. The Journal of organic chemistry, 2020
4038722	CIF	C56 H56 N2 O8	C 1 2/c 1	13.4532; 25.5222; 16.7817 90; 90.016; 90	5762.08	Li, Jing; Han, Xiao-Ni; Zhou, He-Ye; Han, Ying; Chen, Chuan-Feng Helic[1]triptycene[3]arene: Synthesis, Complexation and Formation of [2]Rotaxane Shuttle. The Journal of organic chemistry, 2020
4038721	CIF	C54 H50 N2 O8	C 1 2/c 1	13.3833; 25.691; 16.512 90; 89.7135; 90	5677.26	Li, Jing; Han, Xiao-Ni; Zhou, He-Ye; Han, Ying; Chen, Chuan-Feng Helic[1]triptycene[3]arene: Synthesis, Complexation and Formation of [2]Rotaxane Shuttle. The Journal of organic chemistry, 2020
4038720	CIF	C61 H66 Cl2 N2 O9	C 1 2/c 1	13.3673; 25.6; 16.4937 90; 90.467; 90	5644	Li, Jing; Han, Xiao-Ni; Zhou, He-Ye; Han, Ying; Chen, Chuan-Feng Helic[1]triptycene[3]arene: Synthesis, Complexation and Formation of [2]Rotaxane Shuttle. The Journal of organic chemistry, 2020
4038719	CIF	C26 H26 O5	C 1 2/c 1	15.7398; 18.1447; 16.4868 90; 108.186; 90	4473.33	Li, Jing; Han, Xiao-Ni; Zhou, He-Ye; Han, Ying; Chen, Chuan-Feng Helic[1]triptycene[3]arene: Synthesis, Complexation and Formation of [2]Rotaxane Shuttle. The Journal of organic chemistry, 2020
4038718	CIF	C19 H18 O3	P 21 21 21	9.2907; 11.0841; 14.6284 90; 90; 90	1506.42	Göricke, Fabian; Haseloff, Stefan; Laue, Michael; Schneider, Maximilian; Brumme, Thomas; Schneider, Christoph Phosphoric Acid-Catalyzed Formation of Hydrogen-Bonded ortho-Quinone Methides. Enantioselective Cycloaddition with β-Dicarbonyl Compounds toward Benzannulated Oxygen Heterocycles. The Journal of organic chemistry, 2020
4038717	CIF	C20 H17 Br O3	P 21 21 21	5.5006; 17.2005; 17.2638 90; 90; 90	1633.38	Göricke, Fabian; Haseloff, Stefan; Laue, Michael; Schneider, Maximilian; Brumme, Thomas; Schneider, Christoph Phosphoric Acid-Catalyzed Formation of Hydrogen-Bonded ortho-Quinone Methides. Enantioselective Cycloaddition with β-Dicarbonyl Compounds toward Benzannulated Oxygen Heterocycles. The Journal of organic chemistry, 2020
4038716	CIF	C21 H19 O2	P 41 21 2	8.7209; 8.7209; 41.8621 90; 90; 90	3183.78	Göricke, Fabian; Haseloff, Stefan; Laue, Michael; Schneider, Maximilian; Brumme, Thomas; Schneider, Christoph Phosphoric Acid-Catalyzed Formation of Hydrogen-Bonded ortho-Quinone Methides. Enantioselective Cycloaddition with β-Dicarbonyl Compounds toward Benzannulated Oxygen Heterocycles. The Journal of organic chemistry, 2020
4038714	CIF	C18 H15 Cl F3 N O5 S	P 21 21 21	8.8858; 9.5706; 23.3142 90; 90; 90	1982.7	Duan, Hui-Xin; Zhang, Yongna; Zhang, Zhen-Zhen; Wang, You-Qing C2-Symmetric 1,2-Diphenylethane-1,2-diamine Derived Primary-Tertiary Diamine Catalyzed Asymmetric Mannich Addition of Cyclic N-Sulfonyl Trifluoromethylated Ketimines. The Journal of organic chemistry, 2020
4038713	CIF	C84 H108 I2 N10 Zn2	P -1	13.5467; 15.2671; 19.7699 107.173; 100.844; 90.31	3828.64	Sahoo, Rajata Kumar; Mahato, Mamata; Jana, Achintya; Nembenna, Sharanappa Zinc Hydride Catalyzed Hydrofuntionalization of Ketones. The Journal of organic chemistry, 2020
4038712	CIF	C19 H24 N4 O3	C 1 2/c 1	16.3776; 13.3941; 16.6146 90; 92.047; 90	3642.3	Ciccolini, Cecilia; Mari, Giacomo; Gatti, Francesco G.; Gatti, Giuseppe; Giorgi, Gianluca; Mantellini, Fabio; Favi, Gianfranco Synthesis of Polycyclic Fused Indoline Scaffolds through a Substrate-Guided Reactivity Switch. The Journal of organic chemistry, 2020
4038711	CIF	C37 H39 N O4 S	P 1 21/n 1	9.0613; 17.674; 20.106 90; 101.443; 90	3156	Wang, Junwei; Rong, Quanjin; Zhao, Lei; Pan, Xiang; Zhao, Lin; Zhao, Kun; Hu, Lihong Synthesis of 1,4-Dihydroquinolines and 4<i>H</i>-Chromenes via Organocatalytic Domino Aza/Oxa-Michael/1,6-Addition Reactions of <i>para</i>-Quinone Methides and Ynals. The Journal of organic chemistry, 2020
4038710	CIF	C80 H65 N5 O10	P 1 21/c 1	19.4882; 14.12202; 28.65569 90; 105.565; 90	7597.2	Du, Ke; Demay-Drouhard, Paul; Samanta, Kushal; Li, Shunshun; Thikekar, Tushar Ulhas; Wang, Haiying; Guo, Minjie; van Lagen, Barend; Zuilhof, Han; Sue, Andrew C.-H. Stereochemical Inversion of Rim-Differentiated Pillar[5]arene Molecular Swings The Journal of Organic Chemistry, 2020
4038709	CIF	C61 H84 O10	P b c a	20.84906; 14.0884; 38.1251 90; 90; 90	11198.5	Du, Ke; Demay-Drouhard, Paul; Samanta, Kushal; Li, Shunshun; Thikekar, Tushar Ulhas; Wang, Haiying; Guo, Minjie; van Lagen, Barend; Zuilhof, Han; Sue, Andrew C.-H. Stereochemical Inversion of Rim-Differentiated Pillar[5]arene Molecular Swings The Journal of Organic Chemistry, 2020
4038708	CIF	C58 H40	P -1	8.0569; 17.1074; 17.4187 117.369; 91.41; 93.755	2123.5	Wrona-Piotrowicz, Anna; Makal, Anna; Zakrzewski, Janusz Triflic Acid-Promoted Adamantylation and <i>tert</i>-Butylation of Pyrene: Fluorescent Properties of Pyrene-Decorated Adamantanes and a Channeled Crystal Structure of 1,3,5-Tris(pyren-2-yl)adamantane. The Journal of organic chemistry, 2020
4038707	CIF	C31 H28 N2 O3	P -1	10.2112; 15.7567; 17.6793 69.215; 74.393; 73.995	2509.49	Campbell, Molly V.; Iretskii, Alexei V.; Mosey, R. Adam One-Pot Tandem Assembly of Amides, Amines, and Ketones: Synthesis of C4-Quaternary 3,4- and 1,4-Dihydroquinazolines. The Journal of organic chemistry, 2020
4038706	CIF	C31 H28 N2 O3	P c a 21	17.7454; 13.7235; 21.0126 90; 90; 90	5117.18	Campbell, Molly V.; Iretskii, Alexei V.; Mosey, R. Adam One-Pot Tandem Assembly of Amides, Amines, and Ketones: Synthesis of C4-Quaternary 3,4- and 1,4-Dihydroquinazolines. The Journal of organic chemistry, 2020
4038705	CIF	C12 H10 O3	P 1 21/n 1	10.1493; 6.7882; 14.1297 90; 95.25; 90	969.39	Zhang, Ke; Zhang, Wen-Zhen; Tao, Xue-Yan; Zhang, Min; Ren, Wei-Min; Lu, Xiao-Bing Carboxylative Cyclization of 2-Butenoates with Carbon Dioxide: Access to Glutaconic Anhydrides. The Journal of organic chemistry, 2020
4038704	CIF	C22 H20 O9	P -1	9.1058; 9.3616; 12.5435 76.487; 79.631; 80.564	1014.35	Zhang, Ke; Zhang, Wen-Zhen; Tao, Xue-Yan; Zhang, Min; Ren, Wei-Min; Lu, Xiao-Bing Carboxylative Cyclization of 2-Butenoates with Carbon Dioxide: Access to Glutaconic Anhydrides. The Journal of organic chemistry, 2020
4038703	CIF	C12 H10 O4	P 1 21/n 1	10.5027; 7.0136; 13.6611 90; 96.983; 90	998.84	Zhang, Ke; Zhang, Wen-Zhen; Tao, Xue-Yan; Zhang, Min; Ren, Wei-Min; Lu, Xiao-Bing Carboxylative Cyclization of 2-Butenoates with Carbon Dioxide: Access to Glutaconic Anhydrides. The Journal of organic chemistry, 2020
4038702	CIF	C26 H30 F N O5	P 1 21/c 1	15.986; 16.5452; 16.1942 90; 146.786; 90	2346.2	Dorokhov, Valentin; Nelyubina, Yulia; Ioffe, Sema; Sukhorukov, Alexey Yu Asymmetric Synthesis of Merck's Potent hNK1 Antagonist and Its Stereoisomers via Tandem Acylation/[3,3]-Rearrangement of 1,2-Oxazine-N-oxides. The Journal of organic chemistry, 2020
4038701	CIF	C22 H18 F7 N O3	P 1 21/c 1	8.5733; 30.5985; 8.2945 90; 105.083; 90	2100.9	Dorokhov, Valentin; Nelyubina, Yulia; Ioffe, Sema; Sukhorukov, Alexey Yu Asymmetric Synthesis of Merck's Potent hNK1 Antagonist and Its Stereoisomers via Tandem Acylation/[3,3]-Rearrangement of 1,2-Oxazine-N-oxides. The Journal of organic chemistry, 2020
4038700	CIF	C30 H30 N O3 P	P 1 21 1	12.085; 7.2789; 14.672 90; 96.83; 90	1281.5	Petrovic, Ana G.; Polavarapu, Prasad L.; Łopusiński, Andrzej; Krasowska, Dorota; Wieczorek, Wanda; Szyrej, Małgorzata; Błaszczyk, Jarosław; Drabowicz, Józef Absolute Configuration and Conformation of (-)-<i>R</i>-<i>t</i>-Butylphenylphosphinoamidate: Chiroptical Spectroscopy and X-ray Analysis. The Journal of organic chemistry, 2020
4038699	CIF	C21 H21 N O3 S	P 1 21 1	12.55924; 5.55118; 13.81508 90; 109.467; 90	908.106	Gediya, Shweta K.; Clarkson, Guy J.; Wills, Martin Asymmetric Transfer Hydrogenation: Dynamic Kinetic Resolution of α-Amino Ketones. The Journal of organic chemistry, 2020
4038698	CIF	C19 H22 Cl N O3	P 21 21 21	9.73271; 10.62789; 18.00805 90; 90; 90	1862.72	Gediya, Shweta K.; Clarkson, Guy J.; Wills, Martin Asymmetric Transfer Hydrogenation: Dynamic Kinetic Resolution of α-Amino Ketones. The Journal of organic chemistry, 2020
4038697	CIF	C21 H23 N O2 Se	P n a 21	12.0693; 10.9616; 29.0524 90; 90; 90	3843.6	Song, Wei-Hong; Shi, Jia; Chen, Xiaohong; Song, Guoyong Silver-Catalyzed Remote C5-H Selenylation of Indoles. The Journal of organic chemistry, 2020
4038696	CIF	C20 H20 Cl N O Se	P 1 21/n 1	5.6868; 14.0452; 22.1678 90; 96.97; 90	1757.51	Song, Wei-Hong; Shi, Jia; Chen, Xiaohong; Song, Guoyong Silver-Catalyzed Remote C5-H Selenylation of Indoles. The Journal of organic chemistry, 2020
4038695	CIF	C38 H26 O2	P 1 21/n 1	12.7378; 9.8142; 22.302 90; 98.626; 90	2756.5	Sharma, Abhilash; Hazarika, Hemanta; Sarmah, Manashi; Das, Babulal; Gogoi, Pranjal Indane-Fused Spiropentadiene Chromanones: A Pd-Catalyzed Spiro-Annulation Followed by Cyclization via C-H Activation Strategy. The Journal of organic chemistry, 2020
4038694	CIF	C37 H24 O2	P 1 21/n 1	13.5792; 10.3124; 19.7937 90; 108.203; 90	2633.1	Sharma, Abhilash; Hazarika, Hemanta; Sarmah, Manashi; Das, Babulal; Gogoi, Pranjal Indane-Fused Spiropentadiene Chromanones: A Pd-Catalyzed Spiro-Annulation Followed by Cyclization via C-H Activation Strategy. The Journal of organic chemistry, 2020
4038693	CIF	C18 H10 Cl N5 O5	P 1 21/m 1	9.8312; 6.6242; 12.7222 90; 95.267; 90	825.02	Rowlands, Gareth J.; Severinsen, Rebecca J.; Buchanan, Jenna K.; Shaffer, Karl J.; Jameson, Heather T.; Thennakoon, Nishani; Leito, Ivo; Lõkov, Märt; Kütt, Agnes; Vianello, Robert; Despotović, Ines; Radić, Nena; Plieger, Paul G. Synthesis and Basicity Studies of Quinolino[7,8-h]quinoline Derivatives The Journal of Organic Chemistry, 2020
4038692	CIF	C26 H16 N4	P b n b	7.7745; 14.5862; 16.6756 90; 90; 90	1891.02	Rowlands, Gareth J.; Severinsen, Rebecca J.; Buchanan, Jenna K.; Shaffer, Karl J.; Jameson, Heather T.; Thennakoon, Nishani; Leito, Ivo; Lõkov, Märt; Kütt, Agnes; Vianello, Robert; Despotović, Ines; Radić, Nena; Plieger, Paul G. Synthesis and Basicity Studies of Quinolino[7,8-h]quinoline Derivatives The Journal of Organic Chemistry, 2020
4038691	CIF	C21 H15 N3 O2	C 1 c 1	3.8353; 23.3888; 16.9879 90; 93.51; 90	1521.01	Rowlands, Gareth J.; Severinsen, Rebecca J.; Buchanan, Jenna K.; Shaffer, Karl J.; Jameson, Heather T.; Thennakoon, Nishani; Leito, Ivo; Lõkov, Märt; Kütt, Agnes; Vianello, Robert; Despotović, Ines; Radić, Nena; Plieger, Paul G. Synthesis and Basicity Studies of Quinolino[7,8-h]quinoline Derivatives The Journal of Organic Chemistry, 2020
4038690	CIF	C17 H15 N O2 Se	P c a 21	18.769; 5.6852; 29.015 90; 90; 90	3096.1	Chen, Jia-Min; Qi, Lin; Zhang, Linlin; Li, Li-Jun; Hou, Cong-Ying; Li, Wei; Wang, Li-Jing Copper/DTBP-Promoted Oxyselenation of Propargylic Amines with Diselenides and CO<sub>2</sub>: Synthesis of Selenyl 2-Oxazolidinones. The Journal of organic chemistry, 2020, 85, 10924-10933
4038689	CIF	C21 H19 N O S	C 1 c 1	28.9068; 5.7531; 10.5484 90; 98.531; 90	1734.83	Yue, Yuanyuan; Shao, Huibin; Wang, Zhixian; Wang, Ke; Wang, Le; Zhuo, Kelei; Liu, Jianming Elemental Sulfur-Incorporated Cyclizations of Pyrrolidines Leading to Thienopyrroles. The Journal of organic chemistry, 2020
4038688	CIF	C20 H17 N S	P 1 21/c 1	13.4137; 5.9329; 20.1416 90; 90.21; 90	1602.9	Yue, Yuanyuan; Shao, Huibin; Wang, Zhixian; Wang, Ke; Wang, Le; Zhuo, Kelei; Liu, Jianming Elemental Sulfur-Incorporated Cyclizations of Pyrrolidines Leading to Thienopyrroles. The Journal of organic chemistry, 2020
4038687	CIF	C35 H27 Cl O2	P 1 21 1	13.6569; 11.1976; 17.9855 90; 97.29; 90	2728.2	Jiang, Ying; Yang, Yang; He, Qing; Du, Wei; Chen, Ying-Chun Asymmetric Intramolecular Rauhut‒Currier Reaction and Its Desymmetric Version via Double Thiol/Phase-Transfer Catalysis The Journal of Organic Chemistry, 2020
4038686	CIF	C27 H27 N O4	P 21 21 21	10.3861; 11.8749; 19.6542 90; 90; 90	2424.03	Jiang, Ying; Yang, Yang; He, Qing; Du, Wei; Chen, Ying-Chun Asymmetric Intramolecular Rauhut‒Currier Reaction and Its Desymmetric Version via Double Thiol/Phase-Transfer Catalysis The Journal of Organic Chemistry, 2020
4038685	CIF	C17 H23 N O2 S	C 1 2 1	25.6686; 6.3122; 11.3113 90; 115.585; 90	1653.01	Wellhöfer, Isabelle; Beck, Janina; Frydenvang, Karla; Bräse, Stefan; Olsen, Christian A. Increasing the Functional Group Diversity in Helical β-Peptoids: Achievement of Solvent- and pH-Dependent Folding The Journal of Organic Chemistry, 2020
4038684	CIF	C13 H14 Cl N	P 1 21 1	10.2971; 5.3701; 10.6919 90; 94.959; 90	589.01	Wellhöfer, Isabelle; Beck, Janina; Frydenvang, Karla; Bräse, Stefan; Olsen, Christian A. Increasing the Functional Group Diversity in Helical β-Peptoids: Achievement of Solvent- and pH-Dependent Folding The Journal of Organic Chemistry, 2020
4038683	CIF	C36 H36 N2 O2	P 21 21 21	9.8347; 11.3818; 24.1002 90; 90; 90	2697.69	Mądry, Tomasz; Czapik, Agnieszka; Kwit, Marcin Point-to-Axial Chirality Transmission: A Highly Sensitive Triaryl Chirality Probe for Stereochemical Assignments of Amines The Journal of Organic Chemistry, 2020
4038682	CIF	C36 H40 N2	P 21 21 21	9.8232; 11.5685; 24.8431 90; 90; 90	2823.16	Mądry, Tomasz; Czapik, Agnieszka; Kwit, Marcin Point-to-Axial Chirality Transmission: A Highly Sensitive Triaryl Chirality Probe for Stereochemical Assignments of Amines The Journal of Organic Chemistry, 2020
4038681	CIF	C38 H44 N2	P 1 21 1	9.8901; 11.4265; 13.5336 90; 100.593; 90	1503.36	Mądry, Tomasz; Czapik, Agnieszka; Kwit, Marcin Point-to-Axial Chirality Transmission: A Highly Sensitive Triaryl Chirality Probe for Stereochemical Assignments of Amines The Journal of Organic Chemistry, 2020
4038680	CIF	C40 H48 N2	P 1 21 1	9.9973; 11.6194; 13.9974 90; 98.549; 90	1607.91	Mądry, Tomasz; Czapik, Agnieszka; Kwit, Marcin Point-to-Axial Chirality Transmission: A Highly Sensitive Triaryl Chirality Probe for Stereochemical Assignments of Amines The Journal of Organic Chemistry, 2020
4038679	CIF	C36 H32 N2 O2	P 21 21 21	9.7094; 11.6644; 23.344 90; 90; 90	2643.8	Mądry, Tomasz; Czapik, Agnieszka; Kwit, Marcin Point-to-Axial Chirality Transmission: A Highly Sensitive Triaryl Chirality Probe for Stereochemical Assignments of Amines The Journal of Organic Chemistry, 2020
4038678	CIF	C44 H48 N2	P 21 21 21	9.4593; 11.8372; 30.9935 90; 90; 90	3470.4	Mądry, Tomasz; Czapik, Agnieszka; Kwit, Marcin Point-to-Axial Chirality Transmission: A Highly Sensitive Triaryl Chirality Probe for Stereochemical Assignments of Amines The Journal of Organic Chemistry, 2020
4038677	CIF	C36 H36 N2	P 1 21 1	9.6607; 11.69; 13.1805 90; 104.823; 90	1438.98	Mądry, Tomasz; Czapik, Agnieszka; Kwit, Marcin Point-to-Axial Chirality Transmission: A Highly Sensitive Triaryl Chirality Probe for Stereochemical Assignments of Amines The Journal of Organic Chemistry, 2020
4038676	CIF	C38 H40 N2	P 21 21 21	9.5927; 11.5581; 27.4017 90; 90; 90	3038.12	Mądry, Tomasz; Czapik, Agnieszka; Kwit, Marcin Point-to-Axial Chirality Transmission: A Highly Sensitive Triaryl Chirality Probe for Stereochemical Assignments of Amines The Journal of Organic Chemistry, 2020
4038675	CIF	C40 H44 N2	P 42	20.4806; 20.4806; 7.7702 90; 90; 90	3259.2	Mądry, Tomasz; Czapik, Agnieszka; Kwit, Marcin Point-to-Axial Chirality Transmission: A Highly Sensitive Triaryl Chirality Probe for Stereochemical Assignments of Amines The Journal of Organic Chemistry, 2020
4038674	CIF	C28 H18 O2	P 1 21/c 1	8.065; 15.5091; 7.9152 90; 107.286; 90	945.32	Mądry, Tomasz; Czapik, Agnieszka; Kwit, Marcin Point-to-Axial Chirality Transmission: A Highly Sensitive Triaryl Chirality Probe for Stereochemical Assignments of Amines The Journal of Organic Chemistry, 2020
4038671	CIF	C26 H22 N O2 P	P 1	5.0456; 10.0717; 20.3776 96.509; 95.256; 90.126	1024.46	Winters, Karen R.; Montchamp, Jean-Luc Evaluation and Development of Methodologies for the Synthesis of Thiophosphinic Acids The Journal of Organic Chemistry, 2020
4038670	CIF	C18 H20	P 1 21/c 1	7.1566; 6.7942; 13.6647 90; 94.077; 90	662.74	Langhals, Heinz; Dietl, Christian; Dahl, Jeremy E. P.; Carlson, Robert M. K.; Chern, Yaw-Terng; Mayer, Peter FRET in Orthogonal Stiff Dyads; Diamond-restriction for Frozen Vibrations. The Journal of organic chemistry, 2020
4038669	CIF	C18 H20	P n a 21	13.5493; 14.2703; 6.6906 90; 90; 90	1293.64	Langhals, Heinz; Dietl, Christian; Dahl, Jeremy E. P.; Carlson, Robert M. K.; Chern, Yaw-Terng; Mayer, Peter FRET in Orthogonal Stiff Dyads; Diamond-restriction for Frozen Vibrations. The Journal of organic chemistry, 2020
4038668	CIF	C42 H49 N5 O9	P -1	8.8554; 15.448; 15.7234 87.963; 76.295; 75.824	2025.48	Srinivasulu, Vunnam; Schilf, Paul; Ibrahim, Saleh; Shehadi, Ihsan A.; Malik, Omar G.; Sieburth, Scott; Khanfar, Monther A.; Hamad, Mohamad; Abu-Yousef, Imad A.; Majdalawieh, Amin F.; Al-Tel, Taleb H. Divergent Strategy for Diastereocontrolled Synthesis of Small- and Medium-Ring Architectures The Journal of Organic Chemistry, 2020
4038667	CIF	C36 H37 N5 O3	P b c a	23.94; 10.015; 26.173 90; 90; 90	6275	Srinivasulu, Vunnam; Schilf, Paul; Ibrahim, Saleh; Shehadi, Ihsan A.; Malik, Omar G.; Sieburth, Scott; Khanfar, Monther A.; Hamad, Mohamad; Abu-Yousef, Imad A.; Majdalawieh, Amin F.; Al-Tel, Taleb H. Divergent Strategy for Diastereocontrolled Synthesis of Small- and Medium-Ring Architectures The Journal of Organic Chemistry, 2020
4038666	CIF	C36 H36 N18 O18	P 1 21/n 1	11.442; 35.588; 12.41317 90; 108.58; 90	4791.16	Breton, Gary W.; Martin, Kenneth L. Probing the Dynamic Covalent Chemistry Behavior of Nitrogen-Centered Di and Tri-Urazole Radicals. The Journal of organic chemistry, 2020
4038665	CIF	C30 H32 N12 O14	P -1	13.525; 14.4928; 20.6967 80.1888; 78.9436; 82.5255	3903.38	Breton, Gary W.; Martin, Kenneth L. Probing the Dynamic Covalent Chemistry Behavior of Nitrogen-Centered Di and Tri-Urazole Radicals. The Journal of organic chemistry, 2020
4038664	CIF	C26 H57 Ag F6 O P2 Si4	P 1 21/n 1	10.0857; 11.4481; 30.5231 90; 95.713; 90	3506.8	Hirakawa, Fumiya; Nakagawa, Hiroshi; Honda, Shunya; Ishida, Shintaro; Iwamoto, Takeaki Trialkylphosphines Having a Bulky Phosphacyclopentane Backbone: Structural and Redox Properties Depending on the Exocyclic Alkyl Groups and EPR Observation of a Persistent Trialkylphosphine Radical Cation. The Journal of organic chemistry, 2020
4038663	CIF	C26 H56 F6 P Sb Si4	P 1 21/c 1	11.3052; 16.6951; 17.9915 90; 90.973; 90	3395.3	Hirakawa, Fumiya; Nakagawa, Hiroshi; Honda, Shunya; Ishida, Shintaro; Iwamoto, Takeaki Trialkylphosphines Having a Bulky Phosphacyclopentane Backbone: Structural and Redox Properties Depending on the Exocyclic Alkyl Groups and EPR Observation of a Persistent Trialkylphosphine Radical Cation. The Journal of organic chemistry, 2020
4038662	CIF	C26 H55 P Si4	P n a 21	16.317; 10.0485; 18.383 90; 90; 90	3014.1	Hirakawa, Fumiya; Nakagawa, Hiroshi; Honda, Shunya; Ishida, Shintaro; Iwamoto, Takeaki Trialkylphosphines Having a Bulky Phosphacyclopentane Backbone: Structural and Redox Properties Depending on the Exocyclic Alkyl Groups and EPR Observation of a Persistent Trialkylphosphine Radical Cation. The Journal of organic chemistry, 2020
4038661	CIF	C20 H49 P Si4	P -1	8.365; 11.304; 16.179 109.976; 92.19; 108.632	1343.7	Hirakawa, Fumiya; Nakagawa, Hiroshi; Honda, Shunya; Ishida, Shintaro; Iwamoto, Takeaki Trialkylphosphines Having a Bulky Phosphacyclopentane Backbone: Structural and Redox Properties Depending on the Exocyclic Alkyl Groups and EPR Observation of a Persistent Trialkylphosphine Radical Cation. The Journal of organic chemistry, 2020
4038660	CIF	C19 H47 P Si4	P -1	8.501; 11.132; 15.43 106.972; 91.957; 109.448	1302.9	Hirakawa, Fumiya; Nakagawa, Hiroshi; Honda, Shunya; Ishida, Shintaro; Iwamoto, Takeaki Trialkylphosphines Having a Bulky Phosphacyclopentane Backbone: Structural and Redox Properties Depending on the Exocyclic Alkyl Groups and EPR Observation of a Persistent Trialkylphosphine Radical Cation. The Journal of organic chemistry, 2020
4038659	CIF	C18 H45 P Si4	P 1 21/n 1	11.3795; 15.8206; 14.3559 90; 102.901; 90	2519.3	Hirakawa, Fumiya; Nakagawa, Hiroshi; Honda, Shunya; Ishida, Shintaro; Iwamoto, Takeaki Trialkylphosphines Having a Bulky Phosphacyclopentane Backbone: Structural and Redox Properties Depending on the Exocyclic Alkyl Groups and EPR Observation of a Persistent Trialkylphosphine Radical Cation. The Journal of organic chemistry, 2020
4038658	CIF	C17 H43 P Si4	P -1	9.1062; 11.3846; 13.688 105.432; 100.772; 112.646	1193.8	Hirakawa, Fumiya; Nakagawa, Hiroshi; Honda, Shunya; Ishida, Shintaro; Iwamoto, Takeaki Trialkylphosphines Having a Bulky Phosphacyclopentane Backbone: Structural and Redox Properties Depending on the Exocyclic Alkyl Groups and EPR Observation of a Persistent Trialkylphosphine Radical Cation. The Journal of organic chemistry, 2020
4038657	CIF	C10 H16 O4	P 1	9.5884; 14.8739; 15.0818 90.941; 94.795; 102.677	2089.8	Cornelius, Lyndon A. M.; Li, Jianqing; Smith, Daniel; Krishnananthan, Subramaniam; Yip, Shiuhang; Wu, Dauh-Rurng; Pawluczyk, Joseph; Aulakh, Darpandeep; Sarjeant, Amy A.; Kempson, James; Tino, Joseph A.; Mathur, Arvind; Dhar, T. G. Murali; Cherney, Robert J. Synthesis of 1-(tert-Butyl) 4-Methyl (1R,2S,4R)-2-Methylcyclohexane-1,4-Dicarboxylate from Hagemann's tert-Butyl Ester for an Improved Synthesis of BMS-986251. The Journal of organic chemistry, 2020
4038656	CIF	C43 H33 Cl3 O4 S2	P -1	8.1459; 9.0608; 13.5621 75.86; 73.582; 84.176	930.52	Dressler, Justin; Barker, Joshua E.; Karas, Lucas J.; Hashimoto, Hannah; Kishi, Ryohei; Zakharov, Lev N.; MacMillan, Samantha N.; Gómez-García, Carlos J; Nakano, Masayoshi; Wu, Judy I.; Haley, Michael M. Late-stage Modification of Electronic Properties of Antiaromatic and Diradicaloid Indeno[1,2-b]fluorene Analogues via Sulfur Oxidation. The Journal of organic chemistry, 2020
4038655	CIF	C48 H44 O4 S2	P -1	13.0977; 15.0775; 15.4634 115.901; 94.74; 112.307	2425.5	Dressler, Justin; Barker, Joshua E.; Karas, Lucas J.; Hashimoto, Hannah; Kishi, Ryohei; Zakharov, Lev N.; MacMillan, Samantha N.; Gómez-García, Carlos J; Nakano, Masayoshi; Wu, Judy I.; Haley, Michael M. Late-stage Modification of Electronic Properties of Antiaromatic and Diradicaloid Indeno[1,2-b]fluorene Analogues via Sulfur Oxidation. The Journal of organic chemistry, 2020
4038654	CIF	C56 H52 N2 O4 S2	P -1	7.6244; 10.3907; 15.0797 92.525; 97.786; 98.462	1168.26	Dressler, Justin; Barker, Joshua E.; Karas, Lucas J.; Hashimoto, Hannah; Kishi, Ryohei; Zakharov, Lev N.; MacMillan, Samantha N.; Gómez-García, Carlos J; Nakano, Masayoshi; Wu, Judy I.; Haley, Michael M. Late-stage Modification of Electronic Properties of Antiaromatic and Diradicaloid Indeno[1,2-b]fluorene Analogues via Sulfur Oxidation. The Journal of organic chemistry, 2020
4038653	CIF	C54 H48 Cl6 N2 O4 S2	C 1 c 1	11.949; 25.877; 16.528 90; 98.21; 90	5058	Dressler, Justin; Barker, Joshua E.; Karas, Lucas J.; Hashimoto, Hannah; Kishi, Ryohei; Zakharov, Lev N.; MacMillan, Samantha N.; Gómez-García, Carlos J; Nakano, Masayoshi; Wu, Judy I.; Haley, Michael M. Late-stage Modification of Electronic Properties of Antiaromatic and Diradicaloid Indeno[1,2-b]fluorene Analogues via Sulfur Oxidation. The Journal of organic chemistry, 2020
4038652	CIF	C23 H28 Br N O5	P 1 21/c 1	10.671; 22.8755; 9.5065 90; 92.152; 90	2318.9	Ubale, Akash; Chaudhari, Moreshwar Bhagwan; Shaikh, Moseen A.; Gnanaprakasam, Boopathy Manganese-Catalyzed Synthesis of Quaternary Peroxides: Application in Catalytic Deperoxidation and Rearrangement Reactions. The Journal of organic chemistry, 2020
4038651	CIF	C86 H86 La2 N4 O6	P 1 21 1	13.7694; 26.093; 14.2594 90; 115.124; 90	4638.5	Sun, Yuli; Lu, Chengrong; Zhao, Bei; Xue, Mingqiang Enantioselective Hydroboration of Ketones Catalyzed by Rare-Earth Metal Complexes Containing Trost Ligands. The Journal of organic chemistry, 2020
4038650	CIF	C10 H14 O	P 1 21 1	12.2177; 12.0514; 12.2819 90; 90.36; 90	1808.36	Sun, Yuli; Lu, Chengrong; Zhao, Bei; Xue, Mingqiang Enantioselective Hydroboration of Ketones Catalyzed by Rare-Earth Metal Complexes Containing Trost Ligands. The Journal of organic chemistry, 2020
4038649	CIF	C94 H106 N4 O10 Y2	P 21 21 21	14.5715; 16.3015; 36.96 90; 90; 90	8779.4	Sun, Yuli; Lu, Chengrong; Zhao, Bei; Xue, Mingqiang Enantioselective Hydroboration of Ketones Catalyzed by Rare-Earth Metal Complexes Containing Trost Ligands. The Journal of organic chemistry, 2020
4038648	CIF	C94 H104 N4 Nd2 O9	P 21 21 21	14.6007; 16.7977; 37.486 90; 90; 90	9193.7	Sun, Yuli; Lu, Chengrong; Zhao, Bei; Xue, Mingqiang Enantioselective Hydroboration of Ketones Catalyzed by Rare-Earth Metal Complexes Containing Trost Ligands. The Journal of organic chemistry, 2020
4038647	CIF	C94 H104 Eu2 N4 O9	P 21 21 21	14.5692; 16.642; 37.323 90; 90; 90	9049.4	Sun, Yuli; Lu, Chengrong; Zhao, Bei; Xue, Mingqiang Enantioselective Hydroboration of Ketones Catalyzed by Rare-Earth Metal Complexes Containing Trost Ligands. The Journal of organic chemistry, 2020
4038646	CIF	C27 H55.75 O6 Si3	P 1 21 1	7.858; 31.257; 28.576 90; 90; 90	7019	Fortunato, Moustapha; Gimbert, Yves; Rousset, Elodie; Lameiras, Pedro; Martinez, Agathe; Gatard, Sylvain; Plantier-Royon, Richard; Jaroschik, Florian Diastereoselective synthesis of axially chiral xylose-derived 1,3-disubstituted alkoxyallenes: scope, structure and mechanism. The Journal of organic chemistry, 2020
4038645	CIF	C26 H54 O5 Si3	C 1 2 1	28.9222; 7.8099; 31.9633 90; 113.747; 90	6608.6	Fortunato, Moustapha; Gimbert, Yves; Rousset, Elodie; Lameiras, Pedro; Martinez, Agathe; Gatard, Sylvain; Plantier-Royon, Richard; Jaroschik, Florian Diastereoselective synthesis of axially chiral xylose-derived 1,3-disubstituted alkoxyallenes: scope, structure and mechanism. The Journal of organic chemistry, 2020
4038644	CIF	C17 H16 Cl2 N2 O6	P 21 21 2	14.7629; 13.4736; 8.8054 90; 90; 90	1751.48	Sun, Guodong; Wang, Zhongqing; Luo, Zhonghua; Lin, YiCao; Deng, Zhuofei; Li, Ridong; Zhang, Jiancun Design, Synthesis and Resolution of Spirocyclic Bisoxindoles Based C2-Symmetric Diols. The Journal of organic chemistry, 2020
4038643	CIF	C21 H17 Cl F3 N3	P 1 21/c 1	8.0093; 13.7121; 17.661 90; 102.821; 90	1891.2	Ren, Zhi-Lin; Cai, Shuang; Liu, Ying-Ying; Xie, Yin-Qing; Yuan, Ding; Lei, Min; He, Ping; Wang, Long C(sp2)-H Functionalization of Imidazole at C2 and C4-Position via Palladium-Catalyzed Isocyanide Insertion Leading to Indeno[1,2-d]imidazole and Imidazo[1,2-a]indole Derivatives. The Journal of organic chemistry, 2020
4038642	CIF	C27 H23 Cl N4	P -1	6.9037; 10.4256; 15.9906 75.052; 81.967; 79.048	1086.72	Ren, Zhi-Lin; Cai, Shuang; Liu, Ying-Ying; Xie, Yin-Qing; Yuan, Ding; Lei, Min; He, Ping; Wang, Long C(sp2)-H Functionalization of Imidazole at C2 and C4-Position via Palladium-Catalyzed Isocyanide Insertion Leading to Indeno[1,2-d]imidazole and Imidazo[1,2-a]indole Derivatives. The Journal of organic chemistry, 2020
4038641	CIF	C24 H14 F3 N O	P 1 21/c 1	21.308; 10.085; 8.125 90; 95.72; 90	1737.3	Zhang, Yu; Yu, Yue; Liang, Bing-Bing; Pei, Yong-Yan; Liu, Xiang; Yao, Hua-Gang; Cao, Hua Synthesis of Pyrrolo[2,1,5-cd]indolizine Rings via Visible-Light-Induced Intermolecular [3+2] Cycloaddition of Indolizines and Alkynes. The Journal of organic chemistry, 2020
4038640	CIF	C44 H28 Cl3 N O2 S	P 1 21/c 1	19.4003; 8.8494; 21.4549 90; 110.588; 90	3448.2	Yang, Sheng-Yi; Tian, Qi-Sheng; Yu, You-Jun; Zou, Sheng-Nan; Li, Hong-Cheng; Khan, Aziz; Wu, Qian-Han; Jiang, Zuo-Quan; Liao, Liang-Sheng Sky-Blue Thermally Activated Delayed Fluorescence with Intramolecular Spatial Charge Transfer Based on a Dibenzothiophene Sulfone Emitter. The Journal of organic chemistry, 2020, 85, 10628-10637
4038639	CIF	C43 H29 N O2 S	P 1 21/c 1	8.2499; 16.3857; 23.2184 90; 91.583; 90	3137.5	Yang, Sheng-Yi; Tian, Qi-Sheng; Yu, You-Jun; Zou, Sheng-Nan; Li, Hong-Cheng; Khan, Aziz; Wu, Qian-Han; Jiang, Zuo-Quan; Liao, Liang-Sheng Sky-Blue Thermally Activated Delayed Fluorescence with Intramolecular Spatial Charge Transfer Based on a Dibenzothiophene Sulfone Emitter. The Journal of organic chemistry, 2020, 85, 10628-10637
4038638	CIF	C30 H18 O4	P b c a	10.1603; 14.3842; 29.7704 90; 90; 90	4350.9	Hosseini, Seyyedamirhossein; Thapa, Bishnu; Medeiros, Maria Jose; Pasciak, Erick M.; Pence, Michael A.; Twum, Eric B.; Karty, Jonathan A.; Gao, Xinfeng; Mubarak, Mohammad S.; Raghavachari, Krishnan; Peters, Dennis G. Electrosynthesis of a Biaurone by Controlled Dimerization of Flavone: Mechanistic Insight and Large-Scale Application. The Journal of organic chemistry, 2020
4038637	CIF	C30 H26 O4	P 1 21/n 1	11.7533; 7.0684; 28.577 90; 98.767; 90	2346.4	Hosseini, Seyyedamirhossein; Thapa, Bishnu; Medeiros, Maria Jose; Pasciak, Erick M.; Pence, Michael A.; Twum, Eric B.; Karty, Jonathan A.; Gao, Xinfeng; Mubarak, Mohammad S.; Raghavachari, Krishnan; Peters, Dennis G. Electrosynthesis of a Biaurone by Controlled Dimerization of Flavone: Mechanistic Insight and Large-Scale Application. The Journal of organic chemistry, 2020
4038636	CIF	C23 H25 Br N2 O2	P 21 21 21	9.4438; 12.2974; 18.032 90; 90; 90	2094.13	Ueda, Jun; Harada, Shingo; Kanda, Ayaka; Nakayama, Hiroki; Nemoto, Tetsuhiro Silver-Catalyzed, Chemo- and Enantioselective Intramolecular Dearomatization of Indoles to Access Sterically Congested Azaspiro Frameworks. The Journal of organic chemistry, 2020
4038635	CIF	C26 H21 Br N2 O4	P 21 21 21	6.3409; 15.7289; 21.5122 90; 90; 90	2145.53	Ueda, Jun; Harada, Shingo; Kanda, Ayaka; Nakayama, Hiroki; Nemoto, Tetsuhiro Silver-Catalyzed, Chemo- and Enantioselective Intramolecular Dearomatization of Indoles to Access Sterically Congested Azaspiro Frameworks. The Journal of organic chemistry, 2020
4038634	CIF	C20 H12 Cl N O4	P -1	8.2755; 10.0566; 14.2145 96.365; 98.489; 108.418	1094.34	Joshi, Dirgha Raj; Seo, Yohan; Heo, Yunkyung; Park, So-Hyeon; Lee, Yechan; Namkung, Wan; Kim, Ikyon Domino [4+2] Annulation Access to Quinone-Indolizine Hybrids: Anticancer N-Fused Polycycles. The Journal of organic chemistry, 2020
4038633	CIF	C56 H40 Cl2	P 1 21/n 1	13.4014; 16.7991; 17.6974 90; 94.059; 90	3974.25	Berrocal, Jose Augusto; Pfeifer, Lukas; Heijnen, Dorus; Feringa, Ben L. Synthesis of Core-Modified Third-Generation Light-Driven Molecular Motors. The Journal of organic chemistry, 2020
4038632	CIF	C44 H32 O2	P 1 21/c 1	14.1264; 11.2302; 20.1932 90; 108.151; 90	3044.09	Berrocal, Jose Augusto; Pfeifer, Lukas; Heijnen, Dorus; Feringa, Ben L. Synthesis of Core-Modified Third-Generation Light-Driven Molecular Motors. The Journal of organic chemistry, 2020
4038631	CIF	C42 H26 Cl2	P 1 21/n 1	15.4794; 11.3565; 17.3278 90; 100.282; 90	2997.17	Berrocal, Jose Augusto; Pfeifer, Lukas; Heijnen, Dorus; Feringa, Ben L. Synthesis of Core-Modified Third-Generation Light-Driven Molecular Motors. The Journal of organic chemistry, 2020
4038630	CIF	C28 H38 O5	P 21 21 21	13.41972; 13.53829; 13.78246 90; 90; 90	2504	Elsayed, Somayah; Genta-Jouve, Gregory; Carrión, Víctor; Nibbering, Peter; Siegler, Maxime A.; de Boer, Wietse; Hankemeier, Thomas; van Wezel, Gilles P. Atypical Spirotetronate Polyketides Identified in the Under-explored Genus Streptacidiphilus. The Journal of organic chemistry, 2020
4038629	CIF	C28 H20 Br N O3 S	P -1	9.238; 11.0371; 12.9522 104.269; 101.676; 98.093	1227.84	Chen, Zhan; Jin, Shengnan; Jiang, Wenyao; Zhu, Feimin; Chen, Yuqi; Zhao, Yingwei Multicomponent Synthesis of Iminocoumarins via Rhodium-Catalyzed C-H Bond Activation. The Journal of organic chemistry, 2020
4038628	CIF	C28 H25 F6 N O9 S2	P 1 21 1	12.742; 9.0469; 26.924 90; 96.544; 90	3083.5	Chu, Ming-Ming; Chen, Xue-Yang; Wang, Yi-Feng; Qi, Suo-Suo; Jiang, Zhen-Hui; Xu, Dan-Qian; Xu, Zhen-Yuan Regio- and Enantioselective Friedel-Crafts Benzhydrylation of Indoles in Carbocyclic Ring with ortho-Quinomethanes: Access to Chiral Diarylindolylmethanes. The Journal of organic chemistry, 2020
4038627	CIF	C32 H22	P 1 21/c 1	9.4761; 9.698; 23.3128 90; 97.566; 90	2123.78	Brown, Loren C.; Peloquin, Andrew; Godman, Nicholas P.; Balaich, Gary James; Iacono, Scott T. Correlation of Structure with Crystalline to Amorphous Phase Transitions of 1,3,6-Substituted Fulvene Derived Molecular Glasses. The Journal of organic chemistry, 2020
4038626	CIF	C30 H22	P 1 21 1	11.7922; 7.3144; 23.5196 90; 91.718; 90	2027.72	Brown, Loren C.; Peloquin, Andrew; Godman, Nicholas P.; Balaich, Gary James; Iacono, Scott T. Correlation of Structure with Crystalline to Amorphous Phase Transitions of 1,3,6-Substituted Fulvene Derived Molecular Glasses. The Journal of organic chemistry, 2020
4038625	CIF	C21 H20	P 1 21/c 1	11.0596; 8.4681; 33.2511 90; 99.015; 90	3075.62	Brown, Loren C.; Peloquin, Andrew; Godman, Nicholas P.; Balaich, Gary James; Iacono, Scott T. Correlation of Structure with Crystalline to Amorphous Phase Transitions of 1,3,6-Substituted Fulvene Derived Molecular Glasses. The Journal of organic chemistry, 2020
4038624	CIF	C23 H22	P b c a	7.3169; 21.1822; 21.2038 90; 90; 90	3286.34	Brown, Loren C.; Peloquin, Andrew; Godman, Nicholas P.; Balaich, Gary James; Iacono, Scott T. Correlation of Structure with Crystalline to Amorphous Phase Transitions of 1,3,6-Substituted Fulvene Derived Molecular Glasses. The Journal of organic chemistry, 2020
4038623	CIF	C49 H36 F N3 O3	P 1	12.9213; 16.017; 20.8553 104.882; 91.17; 90.245	4170.37	Chen, Ke-Wei; Wang, Zhao-Shan; Wu, Ping; Yan, Xin-Yu; Zhang, Shu; Zhang, Yu-Chen; Shi, Feng Catalytic Asymmetric Synthesis of 3,3'-Bisindoles Bearing Single Axial Chirality. The Journal of organic chemistry, 2020
4038622	CIF	C58 H74 Cl2 N6 O6 S6	P -1	13.4947; 14.2983; 16.9696 67.4217; 72.7655; 81.2908	2884.97	Etkind, Samuel I.; Vander Griend, Douglas A.; Swager, Timothy M. Electroactive Anion Receptor with High Affinity for Arsenate The Journal of Organic Chemistry, 2020
4038621	CIF	C2.75 H1.88 N0.12 O0.12	P 1 21 1	7.6652; 10.2251; 10.0678 90; 97.411; 90	782.5	Lyu, Xue-Li; Huang, Shi-Sheng; Huang, Yuan-Qiong; Li, Yongqiang; Song, Hong-Jian; Liu, Yuxiu; Wang, Qingmin Rhodium(III)-Catalyzed Direct Coupling of Quinoline-8-Carbaldehydes with (Het)Arylboronic Acids for the Synthesis of 8-Aryloylquinolines. The Journal of organic chemistry, 2020
4038620	CIF	C15 H26 O4	P 1 21 1	6.7174; 7.3675; 14.6311 90; 95.693; 90	720.53	Wang, Xiao-Tao; Han, Wei-Bo; Chen, Hui-Jun; Zha, Qinghong; Wu, Yikang Regio- and Stereoselective Addition of HO/OOH to Allylic Alcohols The Journal of Organic Chemistry, 2020
4038619	CIF	C16 H32 O5 Si	P 1 21 1	6.3257; 7.1917; 20.208 90; 98.685; 90	908.77	Wang, Xiao-Tao; Han, Wei-Bo; Chen, Hui-Jun; Zha, Qinghong; Wu, Yikang Regio- and Stereoselective Addition of HO/OOH to Allylic Alcohols The Journal of Organic Chemistry, 2020
4038618	CIF	C13 H19 O4.5	C 1 2/c 1	28.3527; 6.0676; 14.7772 90; 93.381; 90	2537.74	Wang, Xiao-Tao; Han, Wei-Bo; Chen, Hui-Jun; Zha, Qinghong; Wu, Yikang Regio- and Stereoselective Addition of HO/OOH to Allylic Alcohols The Journal of Organic Chemistry, 2020
4038617	CIF	C24 H36 O6	P c a 21	12.769; 5.7458; 31.33 90; 90; 90	2298.6	Wang, Xiao-Tao; Han, Wei-Bo; Chen, Hui-Jun; Zha, Qinghong; Wu, Yikang Regio- and Stereoselective Addition of HO/OOH to Allylic Alcohols The Journal of Organic Chemistry, 2020
4038616	CIF	C26 H41 N O5 Si	P b c a	12.4873; 14.046; 29.563 90; 90; 90	5185.3	Suzuki, Takahiro; Koyama, Takeshi; Nakanishi, Kenta; Kobayashi, Susumu; Tanino, Keiji Formal Total Synthesis of Atropurpuran. The Journal of organic chemistry, 2020
4038615	CIF	C21 H32 O5	P 1 21/c 1	9.7358; 24.4825; 7.6319 90; 100.777; 90	1787.03	Suzuki, Takahiro; Koyama, Takeshi; Nakanishi, Kenta; Kobayashi, Susumu; Tanino, Keiji Formal Total Synthesis of Atropurpuran. The Journal of organic chemistry, 2020
4038614	CIF	C20 H24 O5	P 1 21/n 1	13.4894; 6.9863; 18.057 90; 96.75; 90	1689.91	Suzuki, Takahiro; Koyama, Takeshi; Nakanishi, Kenta; Kobayashi, Susumu; Tanino, Keiji Formal Total Synthesis of Atropurpuran. The Journal of organic chemistry, 2020
4038613	CIF	C16 H14 Cl2 F3 N O3	P 21 21 21	10.5277; 16.5073; 19.0274 90; 90; 90	3306.7	Ben Jamaa, Abdelkhalek; Latrache, Mohammed; Riguet, Emmanuel; Grellepois, Fabienne cis-Dihydroxylated α-Trifluoromethylated N,O-Acetal from l-Tartaric Acid: Synthesis of Tetrasubstituted Stereocenter via Diastereoselective Pictet-Spengler Cyclization of N-Acyliminium Ions The Journal of Organic Chemistry, 2020
4038612	CIF	C16 H18 F3 N O4	P 21 21 21	8.26; 10.089; 18.565 90; 90; 90	1547.1	Ben Jamaa, Abdelkhalek; Latrache, Mohammed; Riguet, Emmanuel; Grellepois, Fabienne cis-Dihydroxylated α-Trifluoromethylated N,O-Acetal from l-Tartaric Acid: Synthesis of Tetrasubstituted Stereocenter via Diastereoselective Pictet-Spengler Cyclization of N-Acyliminium Ions The Journal of Organic Chemistry, 2020
4038611	CIF	C10 H16 F3 N O6	P 21 21 21	8.8728; 11.3215; 13.0054 90; 90; 90	1306.44	Ben Jamaa, Abdelkhalek; Latrache, Mohammed; Riguet, Emmanuel; Grellepois, Fabienne cis-Dihydroxylated α-Trifluoromethylated N,O-Acetal from l-Tartaric Acid: Synthesis of Tetrasubstituted Stereocenter via Diastereoselective Pictet-Spengler Cyclization of N-Acyliminium Ions The Journal of Organic Chemistry, 2020
4038610	CIF	C15 H16 F3 N O4	P 21 21 21	8.113; 9.611; 18.867 90; 90; 90	1471.1	Ben Jamaa, Abdelkhalek; Latrache, Mohammed; Riguet, Emmanuel; Grellepois, Fabienne cis-Dihydroxylated α-Trifluoromethylated N,O-Acetal from l-Tartaric Acid: Synthesis of Tetrasubstituted Stereocenter via Diastereoselective Pictet-Spengler Cyclization of N-Acyliminium Ions The Journal of Organic Chemistry, 2020
4038609	CIF	C18 H20 F3 N O5	P 21 21 21	8.6589; 9.9867; 20.1991 90; 90; 90	1746.69	Ben Jamaa, Abdelkhalek; Latrache, Mohammed; Riguet, Emmanuel; Grellepois, Fabienne cis-Dihydroxylated α-Trifluoromethylated N,O-Acetal from l-Tartaric Acid: Synthesis of Tetrasubstituted Stereocenter via Diastereoselective Pictet-Spengler Cyclization of N-Acyliminium Ions The Journal of Organic Chemistry, 2020
4038608	CIF	C18 H22 F3 N O6	P 21 21 21	5.6895; 12.5824; 25.6234 90; 90; 90	1834.32	Ben Jamaa, Abdelkhalek; Latrache, Mohammed; Riguet, Emmanuel; Grellepois, Fabienne cis-Dihydroxylated α-Trifluoromethylated N,O-Acetal from l-Tartaric Acid: Synthesis of Tetrasubstituted Stereocenter via Diastereoselective Pictet-Spengler Cyclization of N-Acyliminium Ions The Journal of Organic Chemistry, 2020
4038607	CIF	C21 H19 I O2 S2	P -1	9.1035; 9.7637; 13.8594 94.342; 106.336; 116.57	1027.74	Jian, Xue; Bai, Li-Gang; Zhang, Liang; Zhou, Yue; Lin, Xiao-Long; Mou, Neng-Jie; Xiao, Dong-Rong; Luo, Qun-Li One-Pot Synthesis of 2,4-Diacyl Thiophenes from α-Oxo Ketene Dithioacetals and Propargylic Alcohols. The Journal of organic chemistry, 2020
4038606	CIF	C32 H24 N2 O	P 1 21/c 1	9.2416; 18.9953; 14.738 90; 103.756; 90	2513	Du, Li-Juan; Zhang, Yuecheng; Zhang, Hong-Yu; Yin, Guohui; Wang, Xiao-Yan; Zhao, Jiquan; Han, Ya-Ping Synthesis of 1,6-Dihydropyridine-3-carbonitrile Derivatives via Lewis Acid-Catalyzed Annulation of Propargylic Alcohols with (E)-3-amino-3-phenylacrylonitriles. The Journal of organic chemistry, 2020
4038605	CIF	C26 H17 N O	P -1	9.9459; 10.0372; 10.2116 85.58; 72.746; 67.106	896	Hua, Yiwen; Chen, Zi-Yan; Diao, Hanying; Zhang, Lianpeng; Qiu, Guanyinsheng; Gao, Xiaoxing; Zhou, Hongwei Copper Catalyzed Preparation of Benzo[3,4]indolo[1,2-b]isoquinoline-8-ones and Photoluminescence Exploration. The Journal of organic chemistry, 2020
4038604	CIF	C15 H18 B N3 O2	P -1	13.081; 15.69; 16.982 116.092; 97.851; 101.938	2958	Suzuki, Yota; Ikeda, Ayumi; Ohno, Keiji; Fujihara, Takashi; Sugaya, Tomoaki; Ishihara, Koji <i>o</i>-Azophenylboronic Acid-Based Colorimetric Sensors for d-Fructose: <i>o</i>-Azophenylboronic Acids with Inserted Protic Solvent Are the Key Species for a Large Color Change. The Journal of organic chemistry, 2020
4038603	CIF	C12 H10 B N3 O5	P 1 21 1	3.7451; 7.501; 21.773 90; 92.94; 90	610.8	Suzuki, Yota; Ikeda, Ayumi; Ohno, Keiji; Fujihara, Takashi; Sugaya, Tomoaki; Ishihara, Koji <i>o</i>-Azophenylboronic Acid-Based Colorimetric Sensors for d-Fructose: <i>o</i>-Azophenylboronic Acids with Inserted Protic Solvent Are the Key Species for a Large Color Change. The Journal of organic chemistry, 2020
4038602	CIF	C19 H16 B N3 O5	P -1	9.6949; 12.4853; 15.2894 100.708; 95.767; 97.285	1789.1	Suzuki, Yota; Ikeda, Ayumi; Ohno, Keiji; Fujihara, Takashi; Sugaya, Tomoaki; Ishihara, Koji <i>o</i>-Azophenylboronic Acid-Based Colorimetric Sensors for d-Fructose: <i>o</i>-Azophenylboronic Acids with Inserted Protic Solvent Are the Key Species for a Large Color Change. The Journal of organic chemistry, 2020
4038601	CIF	C12 H14 B Cl3 N4 O2 S	P 1 21/n 1	8.303; 9.935; 21.623 90; 97.49; 90	1768.5	Suzuki, Yota; Ikeda, Ayumi; Ohno, Keiji; Fujihara, Takashi; Sugaya, Tomoaki; Ishihara, Koji <i>o</i>-Azophenylboronic Acid-Based Colorimetric Sensors for d-Fructose: <i>o</i>-Azophenylboronic Acids with Inserted Protic Solvent Are the Key Species for a Large Color Change. The Journal of organic chemistry, 2020
4038600	CIF	C15 H16 B N5 O6	P 1 21/c 1	12.151; 6.869; 20.974 90; 104.652; 90	1693.7	Suzuki, Yota; Ikeda, Ayumi; Ohno, Keiji; Fujihara, Takashi; Sugaya, Tomoaki; Ishihara, Koji <i>o</i>-Azophenylboronic Acid-Based Colorimetric Sensors for d-Fructose: <i>o</i>-Azophenylboronic Acids with Inserted Protic Solvent Are the Key Species for a Large Color Change. The Journal of organic chemistry, 2020
4038599	CIF	C20 H19 B N2 O3	P -1	6.5595; 10.6346; 13.94 108.236; 94.37; 99.634	901.9	Suzuki, Yota; Ikeda, Ayumi; Ohno, Keiji; Fujihara, Takashi; Sugaya, Tomoaki; Ishihara, Koji <i>o</i>-Azophenylboronic Acid-Based Colorimetric Sensors for d-Fructose: <i>o</i>-Azophenylboronic Acids with Inserted Protic Solvent Are the Key Species for a Large Color Change. The Journal of organic chemistry, 2020
4038598	CIF	C34 H29 Br2 N3 O5 S2	P -1	11.6878; 12.5438; 13.3312 70.9079; 72.8568; 81.449	1761.95	Dhanasekar, Elumalai; Kannan, Tharanikkarasu; Venkatesan, Ragavan; Perumal, Paramasivam Thirumalai; Kamalraja, Jayabal Metal-Free and Regioselective Synthesis of Substituted and Fused Chromenopyrrole Scaffolds via Divergent Reactivity of α-Azido Ketone in Water. The Journal of organic chemistry, 2020
4038597	CIF	C30 H43 N3 O8	P b c a	18.8334; 17.4964; 19.2021 90; 90; 90	6327.41	Zhang, Mengsi; Li, Baojun; Chen, Huimin; Lu, Haotian; Ma, Hailong; Cheng, Xiaoyu; Wang, Wenbo; Wang, Yue; Ding, Yun; Hu, Aiguo Triggering the Antitumor Activity of Acyclic Enediyne through Maleimide Assisted Rearrangement and Cycloaromatization. The Journal of organic chemistry, 2020
4038596	CIF	C42 H33 N O9 S	P 1 21 1	5.9632; 18.9516; 15.9602 90; 95.889; 90	1794.18	Shrestha, Ganesh; Panza, Matteo; Singh, Yashapal; Rath, Nigam P.; Demchenko, Alexei V. Indolylthio glycosides as effective building blocks for chemical glycosylation. The Journal of organic chemistry, 2020
4038595	CIF	C42 H41 N O5 S	P 1 21 1	11.9289; 8.8193; 16.9246 90; 100.021; 90	1753.38	Shrestha, Ganesh; Panza, Matteo; Singh, Yashapal; Rath, Nigam P.; Demchenko, Alexei V. Indolylthio glycosides as effective building blocks for chemical glycosylation. The Journal of organic chemistry, 2020
4038594	CIF	C14 H18 N2 O3 S	C 1 2 1	20.2904; 6.2175; 11.6198 90; 101.089; 90	1438.53	Fujiu, Motohiro; Yokoo, Katsuki; Aoki, Toshiaki; Shibuya, Satoru; Sato, Jun; Komano, Kazuo; Kusano, Hiroki; Sato, Soichiro; Ogawa, Masayoshi; Yamawaki, Kenji Synthesis of 2-Thio-Substituted 1,6-Diazabicyclo[3.2.1]octane Derivatives, Potent β-Lactamase Inhibitors. The Journal of organic chemistry, 2020
4038593	CIF	C30 H22 F6 N0 O2 S4	P 1 21/n 1	7.8473; 7.4755; 24.8721 90; 94.13; 90	1455.27	Soni, Sonam; Pali, Pragya; Ansari, Monish Arbaz; Singh, Maya Shankar Visible-Light Photocatalysis of Eosin Y: HAT and Complementing MS-CPET Strategy to Trifluoromethylation of β-Ketodithioesters with Langlois' Reagent. The Journal of organic chemistry, 2020
4038592	CIF	C15 H18 N2 O5	P 21 21 21	6.804; 12.317; 17.084 90; 90; 90	1431.7	Shatsauskas, Anton L.; Mamonova, Tatyana E.; Stasyuk, Anton J.; Chernenko, Sergey A.; Slepukhin, Pavel A.; Kostyuchenko, Anastasia S.; Fisyuk, Alexander Semenovich A rearrangement of 7-aryloxazolo[5,4-b]pyridines to benzo[c][1,7]naphthyridine-4(3H)-ones and thieno[3,2-c][1,7]naphthyridine-6(7H)-ones. The Journal of organic chemistry, 2020
4038591	CIF	C27 H22 F3 N3 O5 S	P 21 21 21	10.1231; 10.3591; 24.2386 90; 90; 90	2541.8	Zhu, Wen-Jing; Gong, Jun-Fang; Song, Mao-Ping Synthesis of Chiral Bis(3-indolyl)methanes Bearing a Trifluoromethylated All-Carbon Quaternary Stereocenter via Nickel-Catalyzed Asymmetric Friedel-Crafts Alkylation Reaction. The Journal of organic chemistry, 2020
4038590	CIF	C20 H16 F3 N3 O2	P 21 21 21	6.8083; 15.0243; 34.886 90; 90; 90	3568.5	Zhu, Wen-Jing; Gong, Jun-Fang; Song, Mao-Ping Synthesis of Chiral Bis(3-indolyl)methanes Bearing a Trifluoromethylated All-Carbon Quaternary Stereocenter via Nickel-Catalyzed Asymmetric Friedel-Crafts Alkylation Reaction. The Journal of organic chemistry, 2020
4038589	CIF	C23 H19 N O4	P 1 21/c 1	15.945; 8.13292; 27.6436 90; 95.2369; 90	3569.84	Kazim, Muhammad; Guan, Liangyu; Chopra, Anant; Sun, Roy; Siegler, Maxime A.; Lectka, Thomas Switching a HO···π Interaction to a Nonconventional OH···π Hydrogen Bond: A Completed Crystallographic Puzzle. The Journal of organic chemistry, 2020
4038588	CIF	C22 H21 N O5	P -1	9.4768; 10.3802; 10.6661 84.849; 66.399; 79.726	945.86	Hwu, Jih Ru; Roy, Animesh; Panja, Avijit; Huang, Wen-Chieh; Hu, Yu-Chen; Tan, Kui-Thong; Lin, Chun-Cheng; Hwang, Kuo Chu; Hsu, Ming-Hua; Tsay, Shwu-Chen Domino Reaction for the Synthesis of Polysubstituted Pyrroles and Lamellarin R. The Journal of organic chemistry, 2020
4038587	CIF	C16 H29 O2 P	P 21 21 21	5.9712; 12.238; 22.345 90; 90; 90	1632.9	Zimmerman, Amber; Xu, Rebecca; Reynolds, Samantha C.; Shipp, Chase; Marshall, Derrick; Wang, Ge; Blank, Natalia F.; Gibbons, Sarah; Hughes, Russell P.; Glueck, David S.; Balaich, Gary James; Rheingold, Arnold L. Diastereoselective Synthesis of P-Stereogenic Secondary Phosphine Oxides (SPOs) Bearing a Chiral Substituent by Ring Opening of (+)-Limonene Oxide with Primary Phosphido Nucleophiles. The Journal of organic chemistry, 2020
4038586	CIF	C28 H47 O2 P	P 21 21 21	12.164; 17.59; 38.736 90; 90; 90	8288	Zimmerman, Amber; Xu, Rebecca; Reynolds, Samantha C.; Shipp, Chase; Marshall, Derrick; Wang, Ge; Blank, Natalia F.; Gibbons, Sarah; Hughes, Russell P.; Glueck, David S.; Balaich, Gary James; Rheingold, Arnold L. Diastereoselective Synthesis of P-Stereogenic Secondary Phosphine Oxides (SPOs) Bearing a Chiral Substituent by Ring Opening of (+)-Limonene Oxide with Primary Phosphido Nucleophiles. The Journal of organic chemistry, 2020
4038585	CIF	C14 H27 O2 P	P 21 21 21	6.3103; 12.1035; 19.3802 90; 90; 90	1480.2	Zimmerman, Amber; Xu, Rebecca; Reynolds, Samantha C.; Shipp, Chase; Marshall, Derrick; Wang, Ge; Blank, Natalia F.; Gibbons, Sarah; Hughes, Russell P.; Glueck, David S.; Balaich, Gary James; Rheingold, Arnold L. Diastereoselective Synthesis of P-Stereogenic Secondary Phosphine Oxides (SPOs) Bearing a Chiral Substituent by Ring Opening of (+)-Limonene Oxide with Primary Phosphido Nucleophiles. The Journal of organic chemistry, 2020
4038584	CIF	C26 H45 O3 P	P 32	11.0048; 11.0048; 17.676 90; 90; 120	1853.87	Zimmerman, Amber; Xu, Rebecca; Reynolds, Samantha C.; Shipp, Chase; Marshall, Derrick; Wang, Ge; Blank, Natalia F.; Gibbons, Sarah; Hughes, Russell P.; Glueck, David S.; Balaich, Gary James; Rheingold, Arnold L. Diastereoselective Synthesis of P-Stereogenic Secondary Phosphine Oxides (SPOs) Bearing a Chiral Substituent by Ring Opening of (+)-Limonene Oxide with Primary Phosphido Nucleophiles. The Journal of organic chemistry, 2020
4038583	CIF	C16 H23 O2 P	P 21 21 21	5.9884; 13.6655; 18.8441 90; 90; 90	1542.1	Zimmerman, Amber; Xu, Rebecca; Reynolds, Samantha C.; Shipp, Chase; Marshall, Derrick; Wang, Ge; Blank, Natalia F.; Gibbons, Sarah; Hughes, Russell P.; Glueck, David S.; Balaich, Gary James; Rheingold, Arnold L. Diastereoselective Synthesis of P-Stereogenic Secondary Phosphine Oxides (SPOs) Bearing a Chiral Substituent by Ring Opening of (+)-Limonene Oxide with Primary Phosphido Nucleophiles. The Journal of organic chemistry, 2020
4038582	CIF	C16 H23 O2 P	P 21 21 21	5.9126; 12.16; 20.6164 90; 90; 90	1482.26	Zimmerman, Amber; Xu, Rebecca; Reynolds, Samantha C.; Shipp, Chase; Marshall, Derrick; Wang, Ge; Blank, Natalia F.; Gibbons, Sarah; Hughes, Russell P.; Glueck, David S.; Balaich, Gary James; Rheingold, Arnold L. Diastereoselective Synthesis of P-Stereogenic Secondary Phosphine Oxides (SPOs) Bearing a Chiral Substituent by Ring Opening of (+)-Limonene Oxide with Primary Phosphido Nucleophiles. The Journal of organic chemistry, 2020
4038581	CIF	C15 H15 F N2	P -1	8.1747; 8.6211; 9.3514 98.774; 93.882; 91.418	649.42	Zhang, Rui; Zhang, Zhikun; Wang, Kang; Wang, Jianbo Difluoroketenimine: Generation from Difluorocarbene and Isocyanide, and Its [3+2] Cycloadditions with Alkenes or Alkynes. The Journal of organic chemistry, 2020
4038580	CIF	C30 H36 F4 N4	P 1 2/c 1	11.9761; 9.3925; 25.5523 90; 102.852; 90	2802.26	Zhang, Rui; Zhang, Zhikun; Wang, Kang; Wang, Jianbo Difluoroketenimine: Generation from Difluorocarbene and Isocyanide, and Its [3+2] Cycloadditions with Alkenes or Alkynes. The Journal of organic chemistry, 2020
4038579	CIF	C16 H12 N S2	C 1 2/c 1	18.894; 12.886; 11.479 90; 92.493; 90	2792	Li, Ling; Chen, Qian; Xu, Honghui; Zhang, Xiao-Hong; Zhang, Xing-Guo DBU-Promoted Demethoxylative Thioannulation of Alkynyl Oxime Ethers with Sulfur for the Synthesis of Bisisothiazole-4-yl Disulfides. The Journal of organic chemistry, 2020
4038578	CIF	C18 H12 F8 I2 O4	P 21 21 21	10.4936; 20.3829; 10.7259 90; 90; 90	2294.16	Yasumoto, Kento; Kano, Taichi; Maruoka, Keiji Synthesis of Electron-Deficient Chiral Biphenols and Their Applica-tions in Catalytic Asymmetric Reactions. The Journal of organic chemistry, 2020
4038577	CIF	C32 H29 Co2 N O8 Si	P 1 21/c 1	11.29; 15.0614; 19.1778 90; 93.217; 90	3255.9	Kang, Zhenghui; Shou, Jiayi; Xing, Dong; Hu, Wenhao Rh(II)/Ag(I) co-catalyzed three-component reaction via SN1/SN1'-type trapping of oxonium ylide with Nicholas intermediate. The Journal of organic chemistry, 2020
4038576	CIF	C14 H25 O7 P S	P 21 21 21	8.9034; 11.952; 16.993 90; 90; 90	1808.3	Kuwabara, Kazuma; Maekawa, Yuuki; Minoura, Mao; Maruyama, Toshifumi; Murai, Toshiaki Chemo- and Stereoselective Alcoholysis of Binaphthyl Phosphonothioates: Straightforward Access to both Stereoisomers of Biologically Relevant P-Stereogenic Phosphonothioates. The Journal of organic chemistry, 2020
4038575	CIF	C27 H27 O3 P S	P 21 21 21	8.9005; 15.1026; 17.357 90; 90; 90	2333.14	Kuwabara, Kazuma; Maekawa, Yuuki; Minoura, Mao; Maruyama, Toshifumi; Murai, Toshiaki Chemo- and Stereoselective Alcoholysis of Binaphthyl Phosphonothioates: Straightforward Access to both Stereoisomers of Biologically Relevant P-Stereogenic Phosphonothioates. The Journal of organic chemistry, 2020
4038574	CIF	C32 H30 N4 O2	P 1 21/c 1	9.2121; 38.932; 8.1281 90; 114.645; 90	2649.57	Faltracco, Matteo; Sukowski, Verena; van Druenen, Max; Hamlin, Trevor A.; Bickelhaupt, F. Matthias; Ruijter, Eelco Diastereoselective Synthesis of β-Lactams by Ligand-Controlled Stereodivergent Intramolecular Tsuji-Trost Allylation. The Journal of organic chemistry, 2020
4038573	CIF	C22 H20 N2 O3	P 1 21/n 1	9.47937; 21.40602; 18.35435 90; 93.8774; 90	3715.86	Wang, Qian; Tuinhof, Jesse; Mgimpatsang, Kumchok C.; Kurpiewska, Katarzyna; Kalinowska-Tłuścik, Justyna; Dömling, Alexander Copper-Catalyzed Modular Assembly of Polyheterocycles. The Journal of organic chemistry, 2020
4038572	CIF	C15 H19 N O3	P 1 21/c 1	8.848; 13.727; 11.346 90; 111.621; 90	1281.1	Bonepally, Karunakar Reddy; Takahashi, Norihito; Matsuoka, Naoya; Koi, Hikari; Mizoguchi, Haruki; Hiruma, Takahisa; Ochiai, Kyohei; Suzuki, Shun; Yamagishi, Yutaka; Oikawa, Hideaki; Ishiyama, Aki; Hokari, Rei; Iwatsuki, Masato; Otoguro, Kazuhiko; Omura, Satoshi; Kato, Nobutaka; Oguri, Hiroki Rapid and Systematic Exploration of Chemical Space Relevant to Artemisinins: Anti-malarial Activities of Skeletally Diversified Tetracyclic Peroxides and 6-Aza-artemisinins. The Journal of organic chemistry, 2020
4038571	CIF	C14 H21 N O5	P 1 21 1	10.1639; 6.2896; 22.0115 90; 93.038; 90	1405.15	Bonepally, Karunakar Reddy; Takahashi, Norihito; Matsuoka, Naoya; Koi, Hikari; Mizoguchi, Haruki; Hiruma, Takahisa; Ochiai, Kyohei; Suzuki, Shun; Yamagishi, Yutaka; Oikawa, Hideaki; Ishiyama, Aki; Hokari, Rei; Iwatsuki, Masato; Otoguro, Kazuhiko; Omura, Satoshi; Kato, Nobutaka; Oguri, Hiroki Rapid and Systematic Exploration of Chemical Space Relevant to Artemisinins: Anti-malarial Activities of Skeletally Diversified Tetracyclic Peroxides and 6-Aza-artemisinins. The Journal of organic chemistry, 2020
4038570	CIF	C33 H55 N O5 Si	P -1	9.1976; 13.8881; 14.247 70.634; 87.276; 86.347	1712.7	Bonepally, Karunakar Reddy; Takahashi, Norihito; Matsuoka, Naoya; Koi, Hikari; Mizoguchi, Haruki; Hiruma, Takahisa; Ochiai, Kyohei; Suzuki, Shun; Yamagishi, Yutaka; Oikawa, Hideaki; Ishiyama, Aki; Hokari, Rei; Iwatsuki, Masato; Otoguro, Kazuhiko; Omura, Satoshi; Kato, Nobutaka; Oguri, Hiroki Rapid and Systematic Exploration of Chemical Space Relevant to Artemisinins: Anti-malarial Activities of Skeletally Diversified Tetracyclic Peroxides and 6-Aza-artemisinins. The Journal of organic chemistry, 2020
4038569	CIF	C19 H20 Br N O6	P 1 21 1	8.7395; 8.783; 11.9719 90; 95.873; 90	914.13	Bonepally, Karunakar Reddy; Takahashi, Norihito; Matsuoka, Naoya; Koi, Hikari; Mizoguchi, Haruki; Hiruma, Takahisa; Ochiai, Kyohei; Suzuki, Shun; Yamagishi, Yutaka; Oikawa, Hideaki; Ishiyama, Aki; Hokari, Rei; Iwatsuki, Masato; Otoguro, Kazuhiko; Omura, Satoshi; Kato, Nobutaka; Oguri, Hiroki Rapid and Systematic Exploration of Chemical Space Relevant to Artemisinins: Anti-malarial Activities of Skeletally Diversified Tetracyclic Peroxides and 6-Aza-artemisinins. The Journal of organic chemistry, 2020
4038568	CIF	C27 H28 N2 O6 S	P -1	9.98869; 11.08896; 13.18431 102.245; 101.385; 115.842	1212.66	Hou, Ke-Qiang; Zhou, Feng; Chen, Xue-Ping; Ge, Yang; Chan, Albert Sun Chi; Xiong, Xiao-Feng Asymmetric Synthesis of Oxindole-Derived Vicinal Tetrasubstituted Acyclic Amino Acid Derivatives by Mannich-Type Reaction. The Journal of organic chemistry, 2020
4038567	CIF	C34 H33 N3 O6 S	P b c a	21.5878; 11.8658; 23.2836 90; 90; 90	5964.25	Hou, Ke-Qiang; Zhou, Feng; Chen, Xue-Ping; Ge, Yang; Chan, Albert Sun Chi; Xiong, Xiao-Feng Asymmetric Synthesis of Oxindole-Derived Vicinal Tetrasubstituted Acyclic Amino Acid Derivatives by Mannich-Type Reaction. The Journal of organic chemistry, 2020
4038566	CIF	C19 H17 N O3	P -1	6.9345; 11.057; 11.166 111.127; 92.434; 96.953	789.3	Zhang, Xiaofei; Zhu, Peiyuan; Zhang, Ruihong; Li, Xiang; Yao, Tuanli Visible-light-induced decarboxylative cyclization of 2-alkenylarylisocyanides with α-oxocarboxylic acids: direct access to 2-acylindoles. The Journal of organic chemistry, 2020
4038565	CIF	C26 H35 N9 O4 S2	P 1 21/c 1	10.7556; 7.9327; 17.5581 90; 96.939; 90	1487.1	Zhang, Yanhan; Yan, Xiaosheng; Cao, Jinlian; Weng, Peimin; Miao, Daiyu; Li, Zhao; Jiang, Yun-Bao Turn Conformation of β-Amino Acid Based Short Peptides Promoted by an Amidothiourea Moiety at C-Terminus. The Journal of organic chemistry, 2020
4038564	CIF	C25 H23 N3 O5 S2	P 1 21/c 1	14.6337; 8.212; 19.9944 90; 95.296; 90	2392.5	Kumar, Chepuri V Suneel; Holyoke, Jr, Caleb W; Keller, Taylor M.; Fleming, Fraser F. Asmic Isocyanide [3 + 2] Cascade to Dihydrooxazoles and Dihydroimidazoles. The Journal of organic chemistry, 2020, 85, 9153-9160
4038563	CIF	C19 H15 N5 O2	P -1	10.495; 14.6071; 17.6793 71.132; 83.894; 76.917	2496.4	Wang, Yingchun; Opsomer, Tomas; Van Meervelt, Luc; Dehaen, Wim Ring-Degenerate Rearrangement Resulting from the Azo Coupling Reaction of a 3-Aryl-1,3a,6a-triazapentalene. The Journal of organic chemistry, 2020
4038562	CIF	C19 H15 N5 O2	P -1	9.1471; 10.2389; 10.4577 60.722; 78.914; 71.326	808.58	Wang, Yingchun; Opsomer, Tomas; Van Meervelt, Luc; Dehaen, Wim Ring-Degenerate Rearrangement Resulting from the Azo Coupling Reaction of a 3-Aryl-1,3a,6a-triazapentalene. The Journal of organic chemistry, 2020
4038561	CIF	C17 H13 N3 S	P n a 21	8.285; 14.446; 12.198 90; 90; 90	1459.9	Honnanayakanavar, Jyoti M.; Harish, Battu; Nanubolu, Jagadeesh Babu; Suresh, Surisetti Tandem Copper-Catalyzed Regioselective <i>N</i>-Arylation-Aza-Michael Addition: Synthesis of Tetracyclic 5<i>H</i>-Benzothiazolo[3,2-<i>a</i>]quinazoline Derivatives. The Journal of organic chemistry, 2020
4038560	CIF	C17 H15 N3 O2 S	C 1 2/c 1	36.176; 5.6425; 15.396 90; 104.478; 90	3042.9	Honnanayakanavar, Jyoti M.; Harish, Battu; Nanubolu, Jagadeesh Babu; Suresh, Surisetti Tandem Copper-Catalyzed Regioselective <i>N</i>-Arylation-Aza-Michael Addition: Synthesis of Tetracyclic 5<i>H</i>-Benzothiazolo[3,2-<i>a</i>]quinazoline Derivatives. The Journal of organic chemistry, 2020
4038559	CIF	C19 H18 N2 O2 S	P -1	7.6361; 8.1452; 14.722 95.298; 90.26; 113.046	838.2	Honnanayakanavar, Jyoti M.; Harish, Battu; Nanubolu, Jagadeesh Babu; Suresh, Surisetti Tandem Copper-Catalyzed Regioselective <i>N</i>-Arylation-Aza-Michael Addition: Synthesis of Tetracyclic 5<i>H</i>-Benzothiazolo[3,2-<i>a</i>]quinazoline Derivatives. The Journal of organic chemistry, 2020
4038558	CIF	C18 H16 N2 O2 S	P -1	8.3698; 10.5488; 10.695 66.788; 75.559; 76.436	830.5	Honnanayakanavar, Jyoti M.; Harish, Battu; Nanubolu, Jagadeesh Babu; Suresh, Surisetti Tandem Copper-Catalyzed Regioselective <i>N</i>-Arylation-Aza-Michael Addition: Synthesis of Tetracyclic 5<i>H</i>-Benzothiazolo[3,2-<i>a</i>]quinazoline Derivatives. The Journal of organic chemistry, 2020
4038557	CIF	C14 H16 Cl F3 N O4 P	I 1 2/a 1	11.7704; 15.69; 18.6268 90; 105.599; 90	3313.25	Mitrofanov, Alexander; Bychkova, Valentina A.; Nefedov, Sergey E.; Beletskaya, Irina P. Selective Metal-Controlled Synthesis of Trifluoromethylated (Indolin-2-ylidene)methyl- and Quinolin-3-ylphosphonates. The Journal of organic chemistry, 2020
4038556	CIF	C54 H66 N14	C 1 2/c 1	25.2762; 9.5637; 24.9579 90; 125.694; 90	4899.8	Oshchepkov, Aleksandr S.; Namashivaya, Siva S. R.; Khrustalev, Victor N.; Hampel, Frank; Laikov, Dimitri N.; Kataev, Evgeny A. Control of Photoisomerization of an Azoazacryptand by Anion Binding and Cucurbit[8]uril Encapsulation in an Aqueous Solution. The Journal of organic chemistry, 2020
4038555	CIF	C54 H80 N20 O22	P -1	9.8128; 16.744; 20.0298 86.159; 89.162; 85.312	3272.5	Oshchepkov, Aleksandr S.; Namashivaya, Siva S. R.; Khrustalev, Victor N.; Hampel, Frank; Laikov, Dimitri N.; Kataev, Evgeny A. Control of Photoisomerization of an Azoazacryptand by Anion Binding and Cucurbit[8]uril Encapsulation in an Aqueous Solution. The Journal of organic chemistry, 2020
4038554	CIF	C29 H21 N	P 1 21/c 1	9.4336; 19.646; 10.9945 90; 106.121; 90	1957.5	Chakraborty, Baitan; Kar, Abhishek; Chanda, Rupsa; Jana, Umasish Application of Povarov Reaction in Biaryls under Iron Catalysis for the General Synthesis of Dibenzo[a, c]acridines. The Journal of organic chemistry, 2020
4038553	CIF	C15 H11 N O4	P -1	10.8933; 11.5767; 11.8325 76.19; 70.082; 67.095	1282.56	Zhou, Yan; Liang, Hong; Sheng, Yaoguang; Wang, Shaoli; Gao, Yi; Zhan, Lingling; Zheng, Zhilong; Yang, Mengjie; Liang, Guang; Zhou, Jianmin; Deng, Jun; Song, Zengqiang Ruthenium(II)-catalyzed C-H activation of chromones with maleimides to synthesize succinimide/ maleimide-containing chromones. The Journal of organic chemistry, 2020
4038552	CIF	C25 H19 O2 P	P 1 21/n 1	9.9751; 14.6491; 14.8894 90; 93.64; 90	2171.34	Xie, Pei; Yang, Shoushan; Guo, Yuyu; Cai, Zhihua; Dai, Bin; He, Lin Multicomponent reaction of phosphines, benzynes and CO2: facile synthesis of stable zwitterionic phosphonium inner-salts. The Journal of organic chemistry, 2020
4038551	CIF	C16 H12 N2 O2	P 1 21/n 1	8.1128; 9.3254; 17.1572 90; 100.4; 90	1276.7	Dhiman, Ankit Kumar; Thakur, Ankita; Kumar, Inder; Kumar, Rakesh; Sharma, Upendra Co(III)-Catalyzed C-H Amidation of Nitrogen Containing Heterocycles with Dioxazolones under Mild Condition. The Journal of organic chemistry, 2020
4038550	CIF	C26 H22 N4 O4	P 21 21 21	9.111; 10.58534; 48.0239 90; 90; 90	4631.57	Song, Xiang-Jia; Ren, Hong-Xia; Xiang, Min; Li, Chen-Yi; Zou, Ying; Li, Xia; Huang, Zhi-Cheng; Tian, Fang; Wang, Li-Xin Organocatalytic Enantioselective Michael Addition between 3-(3-hydroxy-1H-pyrazol-1-yl)Oxindole and β-Nitrostyrene for the Preparation of Chiral Di-substituted Oxindoles. The Journal of organic chemistry, 2020
4038549	CIF	C13 H19 I O3	P 1 21/n 1	24.9006; 6.3095; 28.91 90; 110.855; 90	4244.5	Tomanik, Martin; Economou, Christos; Frischling, Madeline C.; Xue, Mengzhao; Marks, Victoria A.; Mercado, Brandon Q.; Herzon, Seth B. Development of a Convergent Enantioselective Synthetic Route to (-)-Myrocin G. The Journal of organic chemistry, 2020, 85, 8952-8989
4038548	CIF	C21 H27 Cl O4	F d d 2	64.915; 22.4355; 16.2049 90; 90; 90	23601	Tomanik, Martin; Economou, Christos; Frischling, Madeline C.; Xue, Mengzhao; Marks, Victoria A.; Mercado, Brandon Q.; Herzon, Seth B. Development of a Convergent Enantioselective Synthetic Route to (-)-Myrocin G. The Journal of organic chemistry, 2020, 85, 8952-8989
4038547	CIF	C21 H31 I O4	P 1 21/c 1	17.2644; 11.1326; 23.6238 90; 110.142; 90	4262.76	Tomanik, Martin; Economou, Christos; Frischling, Madeline C.; Xue, Mengzhao; Marks, Victoria A.; Mercado, Brandon Q.; Herzon, Seth B. Development of a Convergent Enantioselective Synthetic Route to (-)-Myrocin G. The Journal of organic chemistry, 2020, 85, 8952-8989
4038546	CIF	C23 H35 O5	P c a 21	19.7853; 22.1644; 10.4 90; 90; 90	4560.7	Tomanik, Martin; Economou, Christos; Frischling, Madeline C.; Xue, Mengzhao; Marks, Victoria A.; Mercado, Brandon Q.; Herzon, Seth B. Development of a Convergent Enantioselective Synthetic Route to (-)-Myrocin G. The Journal of organic chemistry, 2020, 85, 8952-8989
4038545	CIF	C19 H24 O5	P 1 21 1	11.2611; 6.3708; 12.0672 90; 105.942; 90	832.43	Tomanik, Martin; Economou, Christos; Frischling, Madeline C.; Xue, Mengzhao; Marks, Victoria A.; Mercado, Brandon Q.; Herzon, Seth B. Development of a Convergent Enantioselective Synthetic Route to (-)-Myrocin G. The Journal of organic chemistry, 2020, 85, 8952-8989
4038544	CIF	C14 H23 I O3 Si	P 1 21/c 1	21.9715; 6.3739; 12.0779 90; 92.562; 90	1689.75	Tomanik, Martin; Economou, Christos; Frischling, Madeline C.; Xue, Mengzhao; Marks, Victoria A.; Mercado, Brandon Q.; Herzon, Seth B. Development of a Convergent Enantioselective Synthetic Route to (-)-Myrocin G. The Journal of organic chemistry, 2020, 85, 8952-8989
4038543	CIF	C22 H23 N O2 S	P 1 21/n 1	10.8954; 13.6167; 12.5125 90; 99.513; 90	1830.82	Zhao, Sheng; Zang, Zhong-Lin; Li, Siyu; Wen, Xumei; Wang, Chenhui; Guo, Jian; He, Yun Iridium-Catalyzed Cycloisomerization of N-Tethered 1,7-Enynes: Construction of Azabicyclo [5.1.0] octene System. The Journal of organic chemistry, 2020
4038542	CIF	C13 H7 Cl O3	P 1 21/c 1	11.126; 11.093; 18.301 90; 102.45; 90	2205.6	Zhao, Guihua; Li, Biqing; Wang, Shuangshuang; Liu, Man; Chen, Yuan; Wang, Bin PIFA-mediated dearomatizative spirocyclization of phenolic biarylic ketones via oxidation and C-C bond cleavage. The Journal of organic chemistry, 2020
4038539	CIF	C17 H24 F3 N2 O5 P	P 1	11.8281; 11.8983; 19.0954 72.31; 72.182; 61.141	2201.08	Fernández-Pérez, Héctor; Lenartowicz, Paweł; Carreras Vinent, Lucas; Grabulosa, Arnald; Kafarski, Paweł; Vidal-Ferran, Anton Access to alpha-aminophosphonic acid derivatives and phosphonopeptides by [Rh(P-OP)]-catalyzed stereoselective hydrogenation. The Journal of organic chemistry, 2020
4038538	CIF	C26 H18 N4 Se	P 1 21/n 1	12.3346; 13.865; 12.6601 90; 102.552; 90	2113.37	Zhu, Yu-Shen; Xue, Yuting; Liu, Wannian; Zhu, Xinju; Hao, Xin-Qi; Song, Mao-Ping Temperature-Controlled Chalcogenation and Chalcogenocyanation of Imidazopyridines in Water under Transition Metal-Free Conditions. The Journal of organic chemistry, 2020
4038537	CIF	C24 H27 Br O4	P 1 21/c 1	10.79064; 25.34034; 7.96505 90; 111.012; 90	2033.13	Annand, James R.; Riehl, Paul S.; Schultz, Danielle M.; Schindler, Corinna S. High-Throughput Approach toward the Development of a Mizoroki-Heck Reaction To Access Tricyclic Spirolactones. The Journal of organic chemistry, 2020
4038536	CIF	C17 H15 N O S	P 1 21/n 1	9.5914; 16.819; 9.964 90; 112.258; 90	1487.6	Xiong, Wei; Zhang, Shengjun; Li, Huijun; Zhang, Zhifeng; Xu, Tongyu Pd-Catalyzed Decarboxylative Cycloaddition of Vinylethylene Carbonates with Isothiocyanates. The Journal of organic chemistry, 2020
4038535	CIF	C20 H14 F3 I O3 S	P 21 21 21	13.6314; 19.2653; 14.8884 90; 90; 90	3909.89	Caspers, Lucien; Spils, Julian; Damrath, Mattis; Lork, Enno; Nachtsheim, Boris Johannes One-Pot Synthesis and Conformational Analysis of 6-Membered Cyclic Iodonium Salts. The Journal of organic chemistry, 2020
4038534	CIF	C26 H32 N2 O8 S	C 1 2/c 1	20.3582; 11.1376; 28.4519 90; 110.673; 90	6035.8	Mane, Vaijinath; Sivanandan, Sudheesh T.; Santana, Rafael G.; Beatriz, Adilson; da Silva Júnior, Eufrânio N; Namboothiri, Irishi N. N. Synthesis of Densely Substituted Sulfonylfurans and Dihydrofurans via Cascade Reactions of α-Functionalized Nitroalkenes with β-Ketosulfones. The Journal of organic chemistry, 2020
4038533	CIF	C48 H41 N2 O12 S2	P 1 21/c 1	18.974; 7.2666; 31.532 90; 92.709; 90	4342.7	Mane, Vaijinath; Sivanandan, Sudheesh T.; Santana, Rafael G.; Beatriz, Adilson; da Silva Júnior, Eufrânio N; Namboothiri, Irishi N. N. Synthesis of Densely Substituted Sulfonylfurans and Dihydrofurans via Cascade Reactions of α-Functionalized Nitroalkenes with β-Ketosulfones. The Journal of organic chemistry, 2020
4038532	CIF	C18 H17 N O3 S	P 1 21/c 1	10.8696; 7.3461; 20.8568 90; 101.555; 90	1631.65	Mane, Vaijinath; Sivanandan, Sudheesh T.; Santana, Rafael G.; Beatriz, Adilson; da Silva Júnior, Eufrânio N; Namboothiri, Irishi N. N. Synthesis of Densely Substituted Sulfonylfurans and Dihydrofurans via Cascade Reactions of α-Functionalized Nitroalkenes with β-Ketosulfones. The Journal of organic chemistry, 2020
4038531	CIF	C27 H24 O6 S	P 1 21/c 1	12.1028; 10.899; 18.1775 90; 101.941; 90	2345.88	Mane, Vaijinath; Sivanandan, Sudheesh T.; Santana, Rafael G.; Beatriz, Adilson; da Silva Júnior, Eufrânio N; Namboothiri, Irishi N. N. Synthesis of Densely Substituted Sulfonylfurans and Dihydrofurans via Cascade Reactions of α-Functionalized Nitroalkenes with β-Ketosulfones. The Journal of organic chemistry, 2020
4038530	CIF	C15 H17 N O3 S	P 1 21/c 1	6.11355; 22.066; 10.8459 90; 94.66; 90	1458.29	Raclea, Robert-Cristian; Natho, Philipp; Allen, Lewis A. T.; White, Andrew J. P.; Parsons, Philip J. Oxidative Deconstruction of Azetidinols to α-Amino Ketones. The Journal of organic chemistry, 2020
4038529	CIF	C13 H13 N O5	P 1 21/c 1	11.7637; 14.5153; 7.3338 90; 101.923; 90	1225.26	Brahmachari, Goutam; Karmakar, Indrajit Visible Light-Induced and Singlet Oxygen-Mediated Photochemical Conversion of 4-Hydroxy-alpha-benzopyrones to 2-Hydroxy-3-oxo-2,3-dihydrobenzofuran-2-carboxamides/carboxylates Using Rose Bengal as a Photosensitizer. The Journal of organic chemistry, 2020
4038528	CIF	C22 H10 Co2 O9	P -1	13.17979; 13.5664; 13.59048 105.804; 105.681; 105.509	2093.08	Danilkina, Natalia A.; D'yachenko, Alexander; Govdi, Anastasia I.; Khlebnikov, Alexander F.; Kornyakov, Ilya; Bräse, Stefan; Balova, Irina A. Intramolecular Nicholas Reactions in the Synthesis of Heteroenediynes fused to Indole, Triazole and Isocoumarin. The Journal of organic chemistry, 2020
4038527	CIF	C14 H14 I N3 O2	P -1	7.2353; 9.1711; 12.0759 97.581; 106.756; 103.036	730.66	Danilkina, Natalia A.; D'yachenko, Alexander; Govdi, Anastasia I.; Khlebnikov, Alexander F.; Kornyakov, Ilya; Bräse, Stefan; Balova, Irina A. Intramolecular Nicholas Reactions in the Synthesis of Heteroenediynes fused to Indole, Triazole and Isocoumarin. The Journal of organic chemistry, 2020
4038526	CIF	C16 H16 I N O3	P n a 21	8.2618; 43.8957; 4.20886 90; 90; 90	1526.37	Danilkina, Natalia A.; D'yachenko, Alexander; Govdi, Anastasia I.; Khlebnikov, Alexander F.; Kornyakov, Ilya; Bräse, Stefan; Balova, Irina A. Intramolecular Nicholas Reactions in the Synthesis of Heteroenediynes fused to Indole, Triazole and Isocoumarin. The Journal of organic chemistry, 2020
4038525	CIF	C13 H9 I3 O3	P 1 21/c 1	8.694; 20.9333; 9.0103 90; 106.693; 90	1570.7	Danilkina, Natalia A.; D'yachenko, Alexander; Govdi, Anastasia I.; Khlebnikov, Alexander F.; Kornyakov, Ilya; Bräse, Stefan; Balova, Irina A. Intramolecular Nicholas Reactions in the Synthesis of Heteroenediynes fused to Indole, Triazole and Isocoumarin. The Journal of organic chemistry, 2020
4038524	CIF	C19 H17 N O3	P 21 21 21	5.41; 12.802; 22.803 90; 90; 90	1579.3	Xiong, Cheng; Cheng, Kunpeng; Wang, Jiahua; Yang, Fulai; Lu, Jinrong; Zhou, Qingfa Iodine-Catalyzed Aerobic Oxidation of Spirovinylcyclopropyl Oxindoles to Form Spiro-1,2-dioxolanes Diastereoselectively. The Journal of organic chemistry, 2020
4038523	CIF	C52 H56 N16 O8	C 1 c 1	23.264; 18.39; 17.423 90; 127.66; 90	5901	Mohite, Amar Ramchandra; Reany, Ofer Inherently Chiral Bambus[4]urils. The Journal of organic chemistry, 2020
4038521	CIF	C17 H16 O6	I 1 2/a 1	13.718; 8.7102; 25.568 90; 95.537; 90	3040.8	Wang, Yu-Jiao; Wang, Tong-Tong; Yao, Lan; Wang, Qian-Long; Zhao, Li-Ming Access to 4-Alkenylated Coumarins via Ruthenium-Catalyzed Olefinic C-H Alkenylation of Coumarins with Modifiable and Removable Directing Groups. The Journal of organic chemistry, 2020
4038520	CIF	C31 H27 Br N2 O2	P 21 21 21	15.5188; 21.4989; 7.5658 90; 90; 90	2524.2	Tejeneki, Hossein Zahedian; Nikbakht, Ali; Balalaie, Saeed; Rominger, Frank Regio- and Diastereoselective Indium-Catalyzed Conia-Ene Reaction of <i>ortho</i>-Alkynyl Diketopiperazines to Access Fused Diketopiperazinoindolines. The Journal of organic chemistry, 2020, 85, 8544-8552
4038519	CIF	C31 H27 Cl N2 O2	C 1 2/c 1	21.532; 8.0393; 29.212 90; 99.5823; 90	4986.1	Tejeneki, Hossein Zahedian; Nikbakht, Ali; Balalaie, Saeed; Rominger, Frank Regio- and Diastereoselective Indium-Catalyzed Conia-Ene Reaction of <i>ortho</i>-Alkynyl Diketopiperazines to Access Fused Diketopiperazinoindolines. The Journal of organic chemistry, 2020, 85, 8544-8552
4038518	CIF	C27 H22	P 1 21/n 1	8.2882; 11.6286; 19.897 90; 100.909; 90	1883	Nishida, Masaki; Lee, Donghyeon; Shintani, Ryo Intermolecular Three-Component Synthesis of Fluorene Derivatives by a Rhodium-Catalyzed Stitching Reaction/Remote Nucleophilic Substitution Sequence. The Journal of organic chemistry, 2020, 85, 8489-8500
4038517	CIF	C27 H38 N2 O2 Si	P -1	8.8912; 11.9339; 12.6741 85.22; 74.19; 80.966	1276.72	Pati, Tanmay K.; Ajarul, Sk; Kundu, Mrinalkanti; Tayde, Deepak; Khamrai, Uttam; Maiti, Dilip K. Synthesis of Functionalized Arylacetamido-2-pyridones through <i>ortho</i>-C(sp<sup>2</sup>)-H-Activated Installation of Olefins and Alkynes. The Journal of organic chemistry, 2020, 85, 8563-8579
4038516	CIF	C31 H24 Cl N O4	P 1 21/n 1	9.7883; 26.2735; 10.597 90; 112.636; 90	2515.3	Zimnitskiy, Nikolay S.; Denikaev, Andrey D.; Barkov, Alexey Y.; Kutyashev, Igor B.; Korotaev, Vladislav Y.; Sosnovskikh, Vyacheslav Y. Catalyst-free Tandem 1,3-Dipolar Cycloaddition/Aldol Condensation: Diastereoselective Construction of the Azatetraquinane Skeleton. The Journal of organic chemistry, 2020, 85, 8683-8694
4038515	CIF	C30 H30 B F2 N3	C 1 2/c 1	16.8071; 19.0449; 16.4613 90; 98.752; 90	5207.7	Wang, Dandan; Guo, Xing; Wu, Hao; Wu, Qinghua; Wang, Hua; Zhang, Xiankang; Hao, Erhong; Jiao, Lijuan Visible Light Excitation of BODIPYs Enables Dehydrogenative Enamination at Their α-Positions with Aliphatic Amines. The Journal of organic chemistry, 2020, 85, 8360-8370
4038514	CIF	C30 H29 B Br2 Cl F2 N3	P 21 21 21	8.7637; 17.0551; 20.6021 90; 90; 90	3079.3	Wang, Dandan; Guo, Xing; Wu, Hao; Wu, Qinghua; Wang, Hua; Zhang, Xiankang; Hao, Erhong; Jiao, Lijuan Visible Light Excitation of BODIPYs Enables Dehydrogenative Enamination at Their α-Positions with Aliphatic Amines. The Journal of organic chemistry, 2020, 85, 8360-8370
4038513	CIF	C66 H68 B3 F6 N9	P -1	10.9684; 17.472; 18.559 114.162; 102.168; 93.667	3126.8	Wang, Dandan; Guo, Xing; Wu, Hao; Wu, Qinghua; Wang, Hua; Zhang, Xiankang; Hao, Erhong; Jiao, Lijuan Visible Light Excitation of BODIPYs Enables Dehydrogenative Enamination at Their α-Positions with Aliphatic Amines. The Journal of organic chemistry, 2020, 85, 8360-8370
4038512	CIF	C24 H25 B Br3 F2 N3	P 1 21/c 1	12.489; 11.29; 18.975 90; 104.119; 90	2594.7	Wang, Dandan; Guo, Xing; Wu, Hao; Wu, Qinghua; Wang, Hua; Zhang, Xiankang; Hao, Erhong; Jiao, Lijuan Visible Light Excitation of BODIPYs Enables Dehydrogenative Enamination at Their α-Positions with Aliphatic Amines. The Journal of organic chemistry, 2020, 85, 8360-8370
4038511	CIF	C24 H26 B Br2 F2 N3	P 21 21 21	9.656; 14.574; 17.635 90; 90; 90	2481.7	Wang, Dandan; Guo, Xing; Wu, Hao; Wu, Qinghua; Wang, Hua; Zhang, Xiankang; Hao, Erhong; Jiao, Lijuan Visible Light Excitation of BODIPYs Enables Dehydrogenative Enamination at Their α-Positions with Aliphatic Amines. The Journal of organic chemistry, 2020, 85, 8360-8370
4038510	CIF	C21 H17 B F7 N3	P 1 21/c 1	18.1713; 13.699; 8.3562 90; 97.785; 90	2060.93	Wang, Dandan; Guo, Xing; Wu, Hao; Wu, Qinghua; Wang, Hua; Zhang, Xiankang; Hao, Erhong; Jiao, Lijuan Visible Light Excitation of BODIPYs Enables Dehydrogenative Enamination at Their α-Positions with Aliphatic Amines. The Journal of organic chemistry, 2020, 85, 8360-8370
4038509	CIF	C13 H17 Cl2 N O	P 1 21 1	8.5612; 7.1443; 11.337 90; 101.245; 90	680.1	Gao, Shenghua; Gao, Xuezhi; Wu, Zenong; Li, Houyong; Yang, Zhezhou; Zhang, Fuli Process for (<i>S</i>)-Ketamine and (<i>S</i>)-Norketamine via Resolution Combined with Racemization. The Journal of organic chemistry, 2020, 85, 8656-8664
4038508	CIF	C12 H13 Cl O2	P 21 21 21	7.2414; 8.1329; 18.752 90; 90; 90	1104.4	Gao, Shenghua; Gao, Xuezhi; Wu, Zenong; Li, Houyong; Yang, Zhezhou; Zhang, Fuli Process for (<i>S</i>)-Ketamine and (<i>S</i>)-Norketamine via Resolution Combined with Racemization. The Journal of organic chemistry, 2020, 85, 8656-8664
4038507	CIF	C18 H17 F3 N2 O5	P 1 21/c 1	8.6117; 13.1472; 16.255 90; 95.684; 90	1831.3	Fang, Zheng; Yin, Hongshan; Lin, Lu; Wen, Shunli; Xie, Lili; Huang, Yangjie; Weng, Zhiqiang Collaborative Activation of Trifluoroacetyl Diazoester by a Lewis Acid and Base for the Synthesis of Polysubstituted 4-Trifluoromethylpyrazoles. The Journal of organic chemistry, 2020, 85, 8714-8722
4038506	CIF	C18 H15 N O3	P -1	8.8161; 9.5583; 9.7852 70.157; 73.487; 68.453	709.31	Ghosh, Koushik; Ghosh, Arghadip; Mukherjee, Kallol; Rit, Raja K.; Sahoo, Akhila K. Sulfoximine-Assisted Unsymmetrical Twofold C-H Functionalization of Arenes. The Journal of organic chemistry, 2020, 85, 8618-8626
4038505	CIF	C20 H21 N O6 S	P 1 21/n 1	8.4889; 23.1788; 10.7372 90; 108.396; 90	2004.7	Ghosh, Koushik; Ghosh, Arghadip; Mukherjee, Kallol; Rit, Raja K.; Sahoo, Akhila K. Sulfoximine-Assisted Unsymmetrical Twofold C-H Functionalization of Arenes. The Journal of organic chemistry, 2020, 85, 8618-8626
4038504	CIF	C17 H18 N2 S2	P -1	8.2539; 9.845; 10.1665 85.666; 76.94; 82.44	796.86	Qi, Peng; Sun, Fang; Chen, Ning; Du, Hongguang Cross-Dehydrogenative Coupling of Azoarenes with Dialkyl Disulfides. The Journal of organic chemistry, 2020, 85, 8588-8596
4038502	CIF	C22 H13 N3	P 1 21/c 1	23.9762; 11.8933; 22.7987 90; 93.283; 90	6490.52	Kumar, Neha; Agrawal, Abhijeet R.; Choudhury, Aditya; Zade, Sanjio S. The Effect of Base and Nucleophile on the Nucleophilic Substitution of Methoxytropone Derivatives: An Easy Access to 4- and 5-Substituted Multifunctional Azulenes. The Journal of organic chemistry, 2020
4038501	CIF	C1.714 H1.486 N0.343	P 1 21/n 1	7.022; 11.2016; 15.789 90; 99.001; 90	1226.6	Kumar, Neha; Agrawal, Abhijeet R.; Choudhury, Aditya; Zade, Sanjio S. The Effect of Base and Nucleophile on the Nucleophilic Substitution of Methoxytropone Derivatives: An Easy Access to 4- and 5-Substituted Multifunctional Azulenes. The Journal of organic chemistry, 2020
4038500	CIF	C13 H9 Cl O2	P 1 21/c 1	15.3318; 5.8627; 11.9302 90; 104.921; 90	1036.2	Tong, Zhou; Tang, Zhi; Au, Chak-Tong; Qiu, Renhua Nickel-Catalyzed Decarbonyloxidation of 3-Aryl Benzofuran-2(<i>3H</i>)-ones to 2-Hydroxybenzophenones. The Journal of organic chemistry, 2020, 85, 8533-8543
4038499	CIF	C22 H19 Br O4 S	P 21 21 21	11.0046; 11.4721; 15.6538 90; 90; 90	1976.23	Formánek, Bedřich; Tauchman, Jiří; Císařová, Ivana; Veselý, Jan Access to Spirocyclic Benzothiophenones with Multiple Stereocenters via an Organocatalytic Cascade Reaction. The Journal of organic chemistry, 2020, 85, 8510-8521
4038498	CIF	C29 H18 F6 N2 O	P 1 21/c 1	16.5939; 13.739; 10.851 90; 99.769; 90	2437.98	Zhu, Lifan; Guo, Hongyu; Feng, Xiujuan; Yamamoto, Yoshinori; Bao, Ming Copper-Catalyzed One-Pot Synthesis of 1,3-Enynes from 2-Chloro-<i>N</i>-(quinolin-8-yl)acetamides and Terminal Alkynes. The Journal of organic chemistry, 2020, 85, 8740-8748
4038497	CIF	C17 H18 N4 O6	P -1	8.5683; 10.3368; 11.1001 78.658; 75.05; 77.369	916.54	Brahmachari, Goutam; Nayek, Nayana; Karmakar, Indrajit; Nurjamal, Khondekar; Chandra, Swapan K.; Bhowmick, Anindita A Series of Functionalized 5-(2-Arylimidazo[1,2-a]pyridin-3-yl)pyrimidine-2,4(1H,3H)-diones: A Water-Mediated Three-Component Catalyst-Free Protocol Revisited. The Journal of organic chemistry, 2020
4038496	CIF	C54 H78 O8	P 1 21 1	13.7565; 10.3255; 16.8608 90; 100.716; 90	2353.2	Vargas-Romero, Katherine; Martínez-Torres, Fátima C; Aguilar-Granda, Andrés; Pérez-Estrada, Salvador; Flores-Alamo, Marcos; Rodríguez-Molina, Braulio; Iglesias-Arteaga, Martín A Synthesis and Solid-State Dynamics of a Crystalline Steroid Molecular Rotor without the Alkyne Axle: Steroid Dimers Based on a 1,4-Di(1,3-dioxan-2-yl)benzene Moiety. The Journal of organic chemistry, 2020, 85, 8501-8509
4038495	CIF	C54 H78 O8	P 1	13.4848; 13.8175; 14.4535 74.959; 88.351; 65.812	2363.3	Vargas-Romero, Katherine; Martínez-Torres, Fátima C; Aguilar-Granda, Andrés; Pérez-Estrada, Salvador; Flores-Alamo, Marcos; Rodríguez-Molina, Braulio; Iglesias-Arteaga, Martín A Synthesis and Solid-State Dynamics of a Crystalline Steroid Molecular Rotor without the Alkyne Axle: Steroid Dimers Based on a 1,4-Di(1,3-dioxan-2-yl)benzene Moiety. The Journal of organic chemistry, 2020, 85, 8501-8509
4038494	CIF	C36 H30 N4 O6	P 1 21/n 1	12.8709; 15.6947; 16.5272 90; 92.507; 90	3335.38	Husain, Ali; Ganesan, Asaithampi; Ghazal, Basma; Makhseed, Saad Multivalent Allyl-Substituted Macrocycles as Non-Aggregating Building Blocks. The Journal of organic chemistry, 2020
4038493	CIF	C147 H132 N16 O27 Zn	P 1 21/a 1	23.94; 28.05; 23.991 90; 119.85; 90	13973	Husain, Ali; Ganesan, Asaithampi; Ghazal, Basma; Makhseed, Saad Multivalent Allyl-Substituted Macrocycles as Non-Aggregating Building Blocks. The Journal of organic chemistry, 2020
4038492	CIF	C152 H128 N8 O24 Zn	P -1	12.8844; 13.9073; 20.6328 98.862; 106.525; 94.899	3469.4	Husain, Ali; Ganesan, Asaithampi; Ghazal, Basma; Makhseed, Saad Multivalent Allyl-Substituted Macrocycles as Non-Aggregating Building Blocks. The Journal of organic chemistry, 2020
4038491	CIF	C38 H32 N2 O6	P 1 21/n 1	12.6219; 16.3765; 16.6547 90; 100.607; 90	3383.7	Husain, Ali; Ganesan, Asaithampi; Ghazal, Basma; Makhseed, Saad Multivalent Allyl-Substituted Macrocycles as Non-Aggregating Building Blocks. The Journal of organic chemistry, 2020
4038490	CIF	C29 H28 Br N O4 S	P 1 21/c 1	27.088; 8.3022; 11.4695 90; 96.808; 90	2561.2	Wang, Yu-Jiang; Li, Xiao-Xiao; Chen, Zili Gold-Catalyzed Diastereoselective Formal Intermolecular [4 + 2 + 1] Cycloaddition of 1,3-Dien-8-yne with Diazo Ester. The Journal of organic chemistry, 2020
4038489	CIF	C18 H20 O3	P 1 21/n 1	10.274; 10.309; 14.243 90; 94.557; 90	1503.8	Wang, Yu-Jiang; Li, Xiao-Xiao; Chen, Zili Gold-Catalyzed Diastereoselective Formal Intermolecular [4 + 2 + 1] Cycloaddition of 1,3-Dien-8-yne with Diazo Ester. The Journal of organic chemistry, 2020
4038488	CIF	C24 H26 N O4 S	P 1 21/n 1	12.6268; 13.5454; 12.6269 90; 99.11; 90	2132.4	Wang, Yu-Jiang; Li, Xiao-Xiao; Chen, Zili Gold-Catalyzed Diastereoselective Formal Intermolecular [4 + 2 + 1] Cycloaddition of 1,3-Dien-8-yne with Diazo Ester. The Journal of organic chemistry, 2020
4038487	CIF	C36 H40 O8	P n a 21	8.8967; 11.4613; 30.389 90; 90; 90	3098.7	Wang, Yu-Jiang; Li, Xiao-Xiao; Chen, Zili Gold-Catalyzed Diastereoselective Formal Intermolecular [4 + 2 + 1] Cycloaddition of 1,3-Dien-8-yne with Diazo Ester. The Journal of organic chemistry, 2020
4038486	CIF	C17 H17 Br O3	P 1 21/n 1	9.2435; 11.0703; 15.3163 90; 102.368; 90	1530.9	Wang, Yu-Jiang; Li, Xiao-Xiao; Chen, Zili Gold-Catalyzed Diastereoselective Formal Intermolecular [4 + 2 + 1] Cycloaddition of 1,3-Dien-8-yne with Diazo Ester. The Journal of organic chemistry, 2020
4038485	CIF	C17 H17 F O3	P -1	7.5228; 8.6162; 12.1657 73.415; 83.009; 72.76	721.2	Wang, Yu-Jiang; Li, Xiao-Xiao; Chen, Zili Gold-Catalyzed Diastereoselective Formal Intermolecular [4 + 2 + 1] Cycloaddition of 1,3-Dien-8-yne with Diazo Ester. The Journal of organic chemistry, 2020
4038484	CIF	C17 H18 O3	P 61	8.6843; 8.6843; 32.226 90; 90; 120	2104.8	Wang, Yu-Jiang; Li, Xiao-Xiao; Chen, Zili Gold-Catalyzed Diastereoselective Formal Intermolecular [4 + 2 + 1] Cycloaddition of 1,3-Dien-8-yne with Diazo Ester. The Journal of organic chemistry, 2020
4038483	CIF	C26 H18 Cl3 N O3	P 1 21/c 1	10.783; 9.095; 22.4992 90; 96.644; 90	2191.71	Neal, Taylor A.; Eippert, Allyson B.; Chivington, Austin; Jamison, Andrew; Chukwuma, Chukwunalu; Moore, Curtis E.; Neal, Jennifer F.; Allen, Heather C.; Wysocki, Laura M.; Paul, Noel Michael; Badjic, Jovica D. One-Pot Aldol Cascade for the Preparation of Isospiropyrans, Flavylium Salts and bis-Spiropyrans. The Journal of organic chemistry, 2020
4038482	CIF	C17 H17 Cl O5	P 1 21/n 1	9.1565; 14.1329; 12.2218 90; 106.165; 90	1519.07	Neal, Taylor A.; Eippert, Allyson B.; Chivington, Austin; Jamison, Andrew; Chukwuma, Chukwunalu; Moore, Curtis E.; Neal, Jennifer F.; Allen, Heather C.; Wysocki, Laura M.; Paul, Noel Michael; Badjic, Jovica D. One-Pot Aldol Cascade for the Preparation of Isospiropyrans, Flavylium Salts and bis-Spiropyrans. The Journal of organic chemistry, 2020
4038481	CIF	C16 H13 Cl O4	P 1 21/c 1	5.9006; 15.9293; 14.4042 90; 101.031; 90	1328.87	Neal, Taylor A.; Eippert, Allyson B.; Chivington, Austin; Jamison, Andrew; Chukwuma, Chukwunalu; Moore, Curtis E.; Neal, Jennifer F.; Allen, Heather C.; Wysocki, Laura M.; Paul, Noel Michael; Badjic, Jovica D. One-Pot Aldol Cascade for the Preparation of Isospiropyrans, Flavylium Salts and bis-Spiropyrans. The Journal of organic chemistry, 2020
4038480	CIF	C26 H18 Br3 N O3	P 1 21/c 1	11.0228; 9.1224; 22.8268 90; 95.723; 90	2283.9	Neal, Taylor A.; Eippert, Allyson B.; Chivington, Austin; Jamison, Andrew; Chukwuma, Chukwunalu; Moore, Curtis E.; Neal, Jennifer F.; Allen, Heather C.; Wysocki, Laura M.; Paul, Noel Michael; Badjic, Jovica D. One-Pot Aldol Cascade for the Preparation of Isospiropyrans, Flavylium Salts and bis-Spiropyrans. The Journal of organic chemistry, 2020
4038479	CIF	C18 H18 O3	P 1 21/n 1	10.5278; 12.1806; 11.4454 90; 99.627; 90	1447.03	Neal, Taylor A.; Eippert, Allyson B.; Chivington, Austin; Jamison, Andrew; Chukwuma, Chukwunalu; Moore, Curtis E.; Neal, Jennifer F.; Allen, Heather C.; Wysocki, Laura M.; Paul, Noel Michael; Badjic, Jovica D. One-Pot Aldol Cascade for the Preparation of Isospiropyrans, Flavylium Salts and bis-Spiropyrans. The Journal of organic chemistry, 2020
4038478	CIF	C21 H24 N2 O2 S	P 1 21/c 1	17.7949; 11.2697; 10.0677 90; 104.349; 90	1956.02	Zheng, Nian; Liu, Ce; Ding, Ya-Nan; Shi, Wei-Yu; Zhang, Bo-Sheng; Liang, Yong-Min Copper-Catalyzed Three-Component Redox-Neutral Ring Opening of Benzothiazoles to 1-Amino-<i>N</i>-(2-(phenylthio)phenyl)methanimine. The Journal of organic chemistry, 2020, 85, 7666-7673
4038477	CIF	C18 H17 F3 N2 O S	P 1 21/n 1	7.56093; 10.6632; 22.1615 90; 91.968; 90	1785.69	Zheng, Nian; Liu, Ce; Ding, Ya-Nan; Shi, Wei-Yu; Zhang, Bo-Sheng; Liang, Yong-Min Copper-Catalyzed Three-Component Redox-Neutral Ring Opening of Benzothiazoles to 1-Amino-<i>N</i>-(2-(phenylthio)phenyl)methanimine. The Journal of organic chemistry, 2020, 85, 7666-7673
4038476	CIF	C17 H17 Cl N2 O S	P 1 21/c 1	16.4728; 9.39367; 22.5176 90; 106.731; 90	3336.87	Zheng, Nian; Liu, Ce; Ding, Ya-Nan; Shi, Wei-Yu; Zhang, Bo-Sheng; Liang, Yong-Min Copper-Catalyzed Three-Component Redox-Neutral Ring Opening of Benzothiazoles to 1-Amino-<i>N</i>-(2-(phenylthio)phenyl)methanimine. The Journal of organic chemistry, 2020, 85, 7666-7673
4038475	CIF	C19 H11 Br N4 O3	P 1 21/c 1	9.362; 29.313; 16.189 90; 115.546; 90	4008.4	Chen, Li-Jun; Yu, Jin-Hang; He, Bin; Xie, Jian-Wu; Liu, Yuan-Xiu; Zhu, Wei-Dong Umpolung Strategy for the Synthesis of Chiral Dispiro[2-amino-4,5-dihydrofuran-3-carbonitrile]bisoxindoles The Journal of Organic Chemistry, 2020