Crystallography Open Database

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4515459 CIFC32 H26 Mn N2 O3 PP 1 21/c 19.7663; 16.9042; 16.0896
90; 97.951; 90
2630.72Das, Uttam Kumar; Ben-David, Yehoshoa; Leitus, Gregory; Diskin-Posner, Yael; Milstein, David
Dehydrogenative Cross-Coupling of Primary Alcohols To Form Cross-Esters Catalyzed by a Manganese Pincer Complex
ACS Catalysis, 2018, 9, 479
4515460 CIFC18 H23 N3 O2P 1 21/c 18.3986; 10.167; 18.964
90; 101.38; 90
1587.5van der Puyl, Vincent A.; Derosa, Joseph; Engle, Keary M.
Directed, Nickel-Catalyzed Umpolung 1,2-Carboamination of Alkenyl Carbonyl Compounds
ACS Catalysis, 2018, 9, 224
4515461 CIFC20 H27 N3 O2P -19.4368; 11.2965; 18.1549
81.081; 81.652; 73.77
1825.2van der Puyl, Vincent A.; Derosa, Joseph; Engle, Keary M.
Directed, Nickel-Catalyzed Umpolung 1,2-Carboamination of Alkenyl Carbonyl Compounds
ACS Catalysis, 2018, 9, 224
4515462 CIFC22 H33 B F2 O4 SiP 21 21 217.4443; 10.4007; 31.5827
90; 90; 90
2445.32Guo, Wen-Hao; Zhao, Hai-Yang; Luo, Zhi-Ji; Zhang, Shu; Zhang, Xingang
Fluoroalkylation–Borylation of Alkynes: An Efficient Method To Obtain (Z)-Tri- and Tetrasubstituted Fluoroalkylated Alkenylboronates
ACS Catalysis, 2018, 9, 38
4515463 CIFC28 H47 B O8 P2 PdC 1 2/c 126.0162; 11.1134; 23.2857
90; 108.358; 90
6389.9Espinosa, Matthew R.; Charboneau, David J.; Garcia de Oliveira, André; Hazari, Nilay
Controlling Selectivity in the Hydroboration of Carbon Dioxide to the Formic Acid, Formaldehyde, and Methanol Oxidation Levels
ACS Catalysis, 2018, 9, 301
4515464 CIFC9 H15 B O2I 41/a c d :213.2301; 13.2301; 38.893
90; 90; 90
6807.7Espinosa, Matthew R.; Charboneau, David J.; Garcia de Oliveira, André; Hazari, Nilay
Controlling Selectivity in the Hydroboration of Carbon Dioxide to the Formic Acid, Formaldehyde, and Methanol Oxidation Levels
ACS Catalysis, 2018, 9, 301
4515465 CIFC15 H15 Cl N2P 1 21/n 18.473; 17.4446; 9.0374
90; 94.072; 90
1332.43Fu, Niankai; Shen, Yifan; Allen, Anthony R.; Song, Lu; Ozaki, Atsushi; Lin, Song
Mn-Catalyzed Electrochemical Chloroalkylation of Alkenes.
ACS catalysis, 2019, 9, 746-754
4515466 CIFC18 H14 F3 N O4P 1 21 111.8498; 9.5906; 14.708
90; 96.008; 90
1662.33Featherston, Aaron L.; Shugrue, Christopher R.; Mercado, Brandon Q.; Miller, Scott J.
Phosphothreonine (pThr)-Based Multifunctional Peptide Catalysis for Asymmetric Baeyer-Villiger Oxidations of Cyclobutanones.
ACS catalysis, 2019, 9, 242-252
4515467 CIFC17 H15 N O4P 1 21 113.5517; 9.2461; 11.8061
90; 106.796; 90
1416.2Featherston, Aaron L.; Shugrue, Christopher R.; Mercado, Brandon Q.; Miller, Scott J.
Phosphothreonine (pThr)-Based Multifunctional Peptide Catalysis for Asymmetric Baeyer-Villiger Oxidations of Cyclobutanones.
ACS catalysis, 2019, 9, 242-252
4515468 CIFC60 H79 N6 O15 PP 21 21 219.8665; 19.0145; 31.36
90; 90; 90
5883.3Featherston, Aaron L.; Shugrue, Christopher R.; Mercado, Brandon Q.; Miller, Scott J.
Phosphothreonine (pThr)-Based Multifunctional Peptide Catalysis for Asymmetric Baeyer-Villiger Oxidations of Cyclobutanones.
ACS catalysis, 2019, 9, 242-252
4515469 CIFC17 H14 Br N O4I 1 2 122.7393; 5.2121; 14.2943
90; 93.045; 90
1691.76Featherston, Aaron L.; Shugrue, Christopher R.; Mercado, Brandon Q.; Miller, Scott J.
Phosphothreonine (pThr)-Based Multifunctional Peptide Catalysis for Asymmetric Baeyer-Villiger Oxidations of Cyclobutanones.
ACS catalysis, 2019, 9, 242-252
4515470 CIFC17 H15 N O4P 1 21 110.8042; 8.4963; 15.825
90; 103.232; 90
1414.1Featherston, Aaron L.; Shugrue, Christopher R.; Mercado, Brandon Q.; Miller, Scott J.
Phosphothreonine (pThr)-Based Multifunctional Peptide Catalysis for Asymmetric Baeyer-Villiger Oxidations of Cyclobutanones.
ACS catalysis, 2019, 9, 242-252
4515471 CIFC18 H17 N O4P -19.806; 14.9855; 21.2136
89.141; 86.664; 88.303
3110.4Featherston, Aaron L.; Shugrue, Christopher R.; Mercado, Brandon Q.; Miller, Scott J.
Phosphothreonine (pThr)-Based Multifunctional Peptide Catalysis for Asymmetric Baeyer-Villiger Oxidations of Cyclobutanones.
ACS catalysis, 2019, 9, 242-252
4515472 CIFC36 H57 N7 O7C 1 2 126.466; 17.7566; 22.8328
90; 124.789; 90
8812.3Featherston, Aaron L.; Shugrue, Christopher R.; Mercado, Brandon Q.; Miller, Scott J.
Phosphothreonine (pThr)-Based Multifunctional Peptide Catalysis for Asymmetric Baeyer-Villiger Oxidations of Cyclobutanones.
ACS catalysis, 2019, 9, 242-252
4515473 CIFC20 H23 N O2P b c a13.76; 7.1297; 34.2631
90; 90; 90
3361.37Ho, Hon Eong; Stephens, Thomas C.; Payne, Thomas J.; O’Brien, Peter; Taylor, Richard J. K.; Unsworth, William P.
Merging π-Acid and Pd Catalysis: Dearomatizing Spirocyclization/Cross-Coupling Cascade Reactions of Alkyne-Tethered Aromatics
ACS Catalysis, 2018, 9, 504
4515474 CIFC45.67 H35.35 Cl3.35 N2 O2I 1 2/a 17.38319; 26.3138; 19.6731
90; 93.6518; 90
3814.33Ho, Hon Eong; Stephens, Thomas C.; Payne, Thomas J.; O’Brien, Peter; Taylor, Richard J. K.; Unsworth, William P.
Merging π-Acid and Pd Catalysis: Dearomatizing Spirocyclization/Cross-Coupling Cascade Reactions of Alkyne-Tethered Aromatics
ACS Catalysis, 2018, 9, 504
4515475 CIFC22 H40 Mn N3 O5 P2 SP b c a11.5; 14.765; 34.41
90; 90; 90
5843Bertini, Federica; Glatz, Mathias; Stöger, Berthold; Peruzzini, Maurizio; Veiros, Luis F.; Kirchner, Karl; Gonsalvi, Luca
Carbon Dioxide Reduction to Methanol Catalyzed by Mn(I) PNP Pincer Complexes under Mild Reaction Conditions
ACS Catalysis, 2018, 9, 632
4515476 CIFC27 H29 NP -18.9763; 10.84; 11.572
109.84; 99.23; 93.29
1037.8Tang, Bin; Hu, Xiaoyan; Liu, Chunli; Jiang, Tao; Alam, Fakhre; Chen, Yanhui
Tandem Cyclization/Hydroarylation of α,ω-Dienes Triggered by Scandium-Catalyzed C–H Activation
ACS Catalysis, 2018, 9, 599
4515477 CIFC23 H40 N Sc Si2P -19.616; 10.433; 13.436
100.936; 95.927; 95.808
1306.3Tang, Bin; Hu, Xiaoyan; Liu, Chunli; Jiang, Tao; Alam, Fakhre; Chen, Yanhui
Tandem Cyclization/Hydroarylation of α,ω-Dienes Triggered by Scandium-Catalyzed C‒H Activation
ACS Catalysis, 2018, 9, 599
4515478 CIFC15 H24 F6 N PC 1 c 119.003; 10.452; 8.8763
90; 96.73; 90
1750.9Tang, Bin; Hu, Xiaoyan; Liu, Chunli; Jiang, Tao; Alam, Fakhre; Chen, Yanhui
Tandem Cyclization/Hydroarylation of α,ω-Dienes Triggered by Scandium-Catalyzed C–H Activation
ACS Catalysis, 2018, 9, 599
4515479 CIFC29 H20 B F18 N6 RhP 1 21/c 118.0106; 9.0679; 19.7109
90; 96.859; 90
3196.1Avullala, Thirupataiah; Asgari, Parham; Hua, Yuanda; Bokka, Apparao; Ridlen, Shawn G.; Yum, Kyungsuk; Dias, H. V. Rasika; Jeon, Junha
Umpolung <i>α</i>-Silylation of Cyclopropyl Acetates via Low-Temperature Catalytic C-C Activation.
ACS catalysis, 2019, 9, 402-408
4515480 CIFC36 H48 Cl2 N2 O RuP 1 21/c 119.3364; 10.43031; 16.58648
90; 95.7369; 90
3328.48Małecki, Paweł; Gajda, Katarzyna; Gajda, Roman; Woźniak, Krzysztof; Trzaskowski, Bartosz; Kajetanowicz, Anna; Grela, Karol
Specialized Ruthenium Olefin Metathesis Catalysts Bearing Bulky Unsymmetrical NHC Ligands: Computations, Synthesis, and Application
ACS Catalysis, 2018, 9, 587
4515481 CIFC53 H50 Cl2 N2 O RuP 1 21/n 113.16; 10.12687; 37.8176
90; 98.1376; 90
4989.19Małecki, Paweł; Gajda, Katarzyna; Gajda, Roman; Woźniak, Krzysztof; Trzaskowski, Bartosz; Kajetanowicz, Anna; Grela, Karol
Specialized Ruthenium Olefin Metathesis Catalysts Bearing Bulky Unsymmetrical NHC Ligands: Computations, Synthesis, and Application
ACS Catalysis, 2018, 9, 587
4515482 CIFC41 H48 Br N3 O7P 21 21 2111.6704; 12.4895; 24.8148
90; 90; 90
3616.94Paria, Suva; Kang, Qi-Kai; Hatanaka, Miho; Maruoka, Keiji
Design of Efficient Chiral Bifunctional Phase-Transfer Catalysts Possessing an Amino Functionality for Asymmetric Aminations
ACS Catalysis, 2018, 9, 78
4515483 CIFC71 H72 N2 NiP 21 21 2114.9159; 18.747; 20.4012
90; 90; 90
5704.8Cai, Yuan; Zhang, Jia-Wen; Li, Feng; Liu, Jia-Ming; Shi, Shi-Liang
Nickel/N-Heterocyclic Carbene Complex-Catalyzed Enantioselective Redox-Neutral Coupling of Benzyl Alcohols and Alkynes to Allylic Alcohols
ACS Catalysis, 2018, 9, 1
4515484 CIFC23 H22 N2 O4 S2P 19.0036; 10.9036; 11.9944
103.063; 98.741; 91.068
1132Yang, Shengbiao; Wang, Lihong; Zhang, Hongwei; Liu, Chunyang; Zhang, Linli; Wang, Xiaomin; Zhang, Ge; Li, Yan; Zhang, Qian
Copper-Catalyzed Asymmetric Aminocyanation of Arylcyclopropanes for Synthesis of γ-Amino Nitriles
ACS Catalysis, 2018, 9, 716
4515485 CIFC37 H31 F2 I P2 PdC 1 2/c 112.09; 15.2246; 20.0614
90; 91.35; 90
3691.6Hori, Kaishi; Motohashi, Hirotaka; Saito, Daichi; Mikami, Koichi
Precatalyst Effects on Pd-Catalyzed Cross-Coupling Difluoromethylation of Aryl Boronic Acids
ACS Catalysis, 2018, 9, 417
4515486 CIFC56 H34 F16 Ir N4 PC 1 2/c 116.49; 22.606; 13.5064
90; 90.007; 90
5034.8Boyaala, Rabab; Touzani, Rachid; Roisnel, Thierry; Dorcet, Vincent; Caytan, Elsa; Jacquemin, Denis; Boixel, Julien; Guerchais, Véronique; Doucet, Henri; Soulé, Jean-François
Catalyst-Controlled Regiodivergent C‒H Arylation Site of Fluorinated 2-Arylpyridine Derivatives: Application to Luminescent Iridium(III) Complexes
ACS Catalysis, 2018, 9, 1320
4515487 CIFC49 H32 Cl2 F16 Ir N4 PP -111.7565; 12.8586; 18.657
81.314; 80.238; 73.409
2648.1Boyaala, Rabab; Touzani, Rachid; Roisnel, Thierry; Dorcet, Vincent; Caytan, Elsa; Jacquemin, Denis; Boixel, Julien; Guerchais, Véronique; Doucet, Henri; Soulé, Jean-François
Catalyst-Controlled Regiodivergent C‒H Arylation Site of Fluorinated 2-Arylpyridine Derivatives: Application to Luminescent Iridium(III) Complexes
ACS Catalysis, 2018, 9, 1320
4515488 CIFC56 H34 F16 Ir N4 PR -3 :H26.5472; 26.5472; 38.495
90; 90; 120
23494.8Boyaala, Rabab; Touzani, Rachid; Roisnel, Thierry; Dorcet, Vincent; Caytan, Elsa; Jacquemin, Denis; Boixel, Julien; Guerchais, Véronique; Doucet, Henri; Soulé, Jean-François
Catalyst-Controlled Regiodivergent C‒H Arylation Site of Fluorinated 2-Arylpyridine Derivatives: Application to Luminescent Iridium(III) Complexes
ACS Catalysis, 2018, 9, 1320
4515489 CIFC27 H43 Al Cl N3 Si3P -19.6279; 10.9013; 17.0857
98.271; 102.568; 108.408
1616.39Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A.
Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration
ACS Catalysis, 2018, 9, 874
4515490 CIFC24 H24 Al N3P 21 21 217.3795; 13.4511; 21.1096
90; 90; 90
2095.39Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A.
Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration
ACS Catalysis, 2018, 9, 874
4515491 CIFC18 H19 Al Cl N3P 1 21/c 18.9033; 22.602; 8.763
90; 100.967; 90
1731.2Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A.
Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration
ACS Catalysis, 2018, 9, 874
4515492 CIFC35 H44 Al N4P -19.0364; 10.9957; 16.5417
91.033; 97.953; 107.345
1550.72Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A.
Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration
ACS Catalysis, 2018, 9, 874
4515493 CIFC29 H33 Al N3P 1 21/n 19.6204; 24.1661; 10.8834
90; 94.131; 90
2523.68Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A.
Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration
ACS Catalysis, 2018, 9, 874
4515494 CIFC33 H48 Al N3 Si3P -19.2076; 12.1268; 16.763
98.513; 98.865; 103.694
1763.3Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A.
Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration
ACS Catalysis, 2018, 9, 874
4515495 CIFC15 H24 Al Cl4 N3 O7P 1 21/n 17.0617; 25.6486; 13.413
90; 105.218; 90
2344.2Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A.
Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration
ACS Catalysis, 2018, 9, 874
4515496 CIFC27 H37 Al Cl N3P 1 21/n 19.2525; 15.9339; 17.4939
90; 95.425; 90
2567.5Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A.
Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration
ACS Catalysis, 2018, 9, 874
4515497 CIFC27 H38 Al N3P -18.9098; 9.0012; 17.5788
89.93; 76.945; 69.158
1278.64Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A.
Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration
ACS Catalysis, 2018, 9, 874
4515498 CIFC33 H42 Al N3P 1 21/c 116.055; 10.4568; 35.146
90; 98.496; 90
5835.7Zhang, Guoqi; Wu, Jing; Zeng, Haisu; Neary, Michelle C.; Devany, Matthew; Zheng, Shengping; Dub, Pavel A.
Dearomatization and Functionalization of Terpyridine Ligands Leading to Unprecedented Zwitterionic Meisenheimer Aluminum Complexes and Their Use in Catalytic Hydroboration
ACS Catalysis, 2018, 9, 874
4515499 CIFC57 H34 B2 F30 Nd Si3C 1 2/c 139.687; 12.1443; 26.344
90; 98.409; 90
12561Schmidt, Bradley M.; Pindwal, Aradhana; Venkatesh, Amrit; Ellern, Arkady; Rossini, Aaron J.; Sadow, Aaron D.
Zwitterionic Trivalent (Alkyl)lanthanide Complexes in Ziegler-Type Butadiene Polymerization
ACS Catalysis, 2018, 9, 827
4515500 CIFC20 H16 O4I 1 a 16.101; 7.1857; 36.046
90; 94.848; 90
1574.6Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong
Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes
ACS Catalysis, 2018, 9, 810
4515501 CIFC23 H31 Cl Fe N2P 1 2/c 114.4785; 9.0523; 16.7522
90; 92.179; 90
2194Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong
Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes
ACS Catalysis, 2018, 9, 810
4515502 CIFC29 H35 Cl Fe N2P b c a16.5485; 10.4399; 31.246
90; 90; 90
5398.2Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong
Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes
ACS Catalysis, 2018, 9, 810
4515503 CIFC26 H38 Cl Fe N3P b c a11.9206; 15.6644; 27.735
90; 90; 90
5178.93Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong
Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes
ACS Catalysis, 2018, 9, 810
4515504 CIFC37 H40 Fe N2P 1 21/c 112.631; 15.5444; 16.5595
90; 105.365; 90
3135.1Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong
Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes
ACS Catalysis, 2018, 9, 810
4515505 CIFC25 H35 Cl Fe N2P 1 21/c 117.827; 15.8552; 11.0869
90; 104.133; 90
3038.9Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong
Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes
ACS Catalysis, 2018, 9, 810
4515506 CIFC24 H20 Fe2P 1 21/n 111.736; 10.478; 14.979
90; 102.775; 90
1796.4Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong
Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes
ACS Catalysis, 2018, 9, 810
4515507 CIFC28 H41 Cl Fe N2P 21 21 218.6146; 17.039; 19.7629
90; 90; 90
2900.9Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong
Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes
ACS Catalysis, 2018, 9, 810
4515508 CIFC32 H41 Cl Fe N2P 1 21/c 18.4344; 22.681; 15.3166
90; 90.017; 90
2930.1Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong
Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes
ACS Catalysis, 2018, 9, 810
4515509 CIFC26 H37 Cl Fe N2P 1 21/c 18.5309; 16.6841; 17.0048
90; 91.196; 90
2419.8Liang, Qiuming; Sheng, Kai; Salmon, Andrew; Zhou, Vivian Yue; Song, Datong
Active Iron(II) Catalysts toward gem-Specific Dimerization of Terminal Alkynes
ACS Catalysis, 2018, 9, 810
4515510 CIFC19 H13 N O4 SP -17.0423; 9.2936; 12.8025
89.117; 75.476; 77.243
790.39Shu, Chao; Shi, Chong-Yang; Sun, Qing; Zhou, Bo; Li, Tian-You; He, Qiao; Lu, Xin; Liu, Rai-Shung; Ye, Long-Wu
Generation of Endocyclic Vinyl Carbene Complexes via Gold-Catalyzed Oxidative Cyclization of Terminal Diynes: Toward Naphthoquinones and Carbazolequinones
ACS Catalysis, 2018, 9, 1019
4515511 CIFC30 H29 Al N4 OP -19.633; 11.189; 12.051
89.56; 71.1; 83.22
1220Mandal, Mukunda; Luke, Anna M.; Dereli, Büşra; Elwell, Courtney E.; Reineke, Theresa M.; Tolman, William B.; Cramer, Christopher J.
Computational Prediction and Experimental Verification of ε-Caprolactone Ring-Opening Polymerization Activity by an Aluminum Complex of an Indolide/Schiff-Base Ligand
ACS Catalysis, 2018, 9, 885
4515512 CIFC26 H30 N2 O3P 21 21 219.1036; 13.3256; 36.2038
90; 90; 90
4391.92Shen, Hong-Cheng; Zhang, Ling; Chen, Shu-Sen; Feng, Jiajie; Zhang, Bo-Wen; Zhang, Ying; Zhang, Xinhao; Wu, Yun-Dong; Gong, Liu-Zhu
Enantioselective Addition of Cyclic Ketones to Unactivated Alkenes Enabled by Amine/Pd(II) Cooperative Catalysis
ACS Catalysis, 2018, 9, 791
4515513 CIFC25 H27 Br N2 O2P 21 21 219.0909; 13.2501; 36.0908
90; 90; 90
4347.3Shen, Hong-Cheng; Zhang, Ling; Chen, Shu-Sen; Feng, Jiajie; Zhang, Bo-Wen; Zhang, Ying; Zhang, Xinhao; Wu, Yun-Dong; Gong, Liu-Zhu
Enantioselective Addition of Cyclic Ketones to Unactivated Alkenes Enabled by Amine/Pd(II) Cooperative Catalysis
ACS Catalysis, 2018, 9, 791
4516631 CIFC15 H12 Co2 N4 O7C 1 2/c 134.882; 10.203; 13.579
90; 112.867; 90
4453Wang, Hai-Hua; Hou, Lei; Li, Yong-Zhi; Jiang, Chen-Yu; Wang, Yao-Yu; Zhu, Zhonghua
Porous MOF with Highly Efficient Selectivity and Chemical Conversion for CO<sub>2</sub>.
ACS applied materials & interfaces, 2017, 9, 17969-17976
4516632 CIFC36 H24 Cl2 Cu12 N36 Na2 O24P -110.5333; 12.8234; 13.1215
84.199; 82.718; 67.584
1622.5Guo, Ling-Yu; Su, Hai-Feng; Kurmoo, Mohamedally; Wang, Xing-Po; Zhao, Quan-Qin; Lin, Shui-Chao; Tung, Chen-Ho; Sun, Di; Zheng, Lan-Sun
Multifunctional Triple-Decker Inverse 12-Metallacrown-4 Sandwiching Halides.
ACS applied materials & interfaces, 2017, 9, 19980-19987
4516633 CIFC36 H24 Br2 Cu12 N36 Na2 O24P -110.327; 13.165; 13.182
89.986; 81.289; 68.559
1645.9Guo, Ling-Yu; Su, Hai-Feng; Kurmoo, Mohamedally; Wang, Xing-Po; Zhao, Quan-Qin; Lin, Shui-Chao; Tung, Chen-Ho; Sun, Di; Zheng, Lan-Sun
Multifunctional Triple-Decker Inverse 12-Metallacrown-4 Sandwiching Halides.
ACS applied materials & interfaces, 2017, 9, 19980-19987
4516634 CIFC36 H24 Cu12 I2 N36 Na2 O24P -110.397; 13.176; 13.196
89.966; 81.245; 69.982
1676.1Guo, Ling-Yu; Su, Hai-Feng; Kurmoo, Mohamedally; Wang, Xing-Po; Zhao, Quan-Qin; Lin, Shui-Chao; Tung, Chen-Ho; Sun, Di; Zheng, Lan-Sun
Multifunctional Triple-Decker Inverse 12-Metallacrown-4 Sandwiching Halides.
ACS applied materials & interfaces, 2017, 9, 19980-19987
4516635 CIFC18 H12 Cl Cu6 K N18 O12P -110.602; 12.725; 13.11
83.607; 81.991; 67.784
1618Guo, Ling-Yu; Su, Hai-Feng; Kurmoo, Mohamedally; Wang, Xing-Po; Zhao, Quan-Qin; Lin, Shui-Chao; Tung, Chen-Ho; Sun, Di; Zheng, Lan-Sun
Multifunctional Triple-Decker Inverse 12-Metallacrown-4 Sandwiching Halides.
ACS applied materials & interfaces, 2017, 9, 19980-19987
4516636 CIFC18 H12 Br Cu6 K N18 O12P -110.2886; 13.1326; 13.1248
89.9; 68.551; 81.119
1627.88Guo, Ling-Yu; Su, Hai-Feng; Kurmoo, Mohamedally; Wang, Xing-Po; Zhao, Quan-Qin; Lin, Shui-Chao; Tung, Chen-Ho; Sun, Di; Zheng, Lan-Sun
Multifunctional Triple-Decker Inverse 12-Metallacrown-4 Sandwiching Halides.
ACS applied materials & interfaces, 2017, 9, 19980-19987
4516637 CIFC18 H12 Cu6 I K N18 O12P -110.336; 13.12; 13.11
89.928; 69.412; 81.047
1641.3Guo, Ling-Yu; Su, Hai-Feng; Kurmoo, Mohamedally; Wang, Xing-Po; Zhao, Quan-Qin; Lin, Shui-Chao; Tung, Chen-Ho; Sun, Di; Zheng, Lan-Sun
Multifunctional Triple-Decker Inverse 12-Metallacrown-4 Sandwiching Halides.
ACS applied materials & interfaces, 2017, 9, 19980-19987
4516638 CIFC45 H64 Cu6 F N33 O27P -112.9723; 15.0889; 17.921
90.4389; 90.3035; 93.3656
3501.6Guo, Ling-Yu; Su, Hai-Feng; Kurmoo, Mohamedally; Wang, Xing-Po; Zhao, Quan-Qin; Lin, Shui-Chao; Tung, Chen-Ho; Sun, Di; Zheng, Lan-Sun
Multifunctional Triple-Decker Inverse 12-Metallacrown-4 Sandwiching Halides.
ACS applied materials & interfaces, 2017, 9, 19980-19987
4516639 CIFC36 H34 B NP 1 21/c 113.112; 13.4058; 16.2914
90; 101.021; 90
2810.84Lee, Young Hoon; Park, Sunghee; Oh, Jihun; Shin, Jong Won; Jung, Jaehoon; Yoo, Seunghyup; Lee, Min Hyung
Rigidity-Induced Delayed Fluorescence by Ortho Donor-Appended Triarylboron Compounds: Record-High Efficiency in Pure Blue Fluorescent Organic Light-Emitting Diodes.
ACS applied materials & interfaces, 2017, 9, 24035-24042
4516640 CIFC36 H34 B N OP 1 21/c 115.361; 12.176; 14.9
90; 90.95; 90
2786.4Lee, Young Hoon; Park, Sunghee; Oh, Jihun; Shin, Jong Won; Jung, Jaehoon; Yoo, Seunghyup; Lee, Min Hyung
Rigidity-Induced Delayed Fluorescence by Ortho Donor-Appended Triarylboron Compounds: Record-High Efficiency in Pure Blue Fluorescent Organic Light-Emitting Diodes.
ACS applied materials & interfaces, 2017, 9, 24035-24042
4516641 CIFC36 H34 B NP 1 21/n 18.346; 18.245; 17.714
90; 93.04; 90
2693.6Lee, Young Hoon; Park, Sunghee; Oh, Jihun; Shin, Jong Won; Jung, Jaehoon; Yoo, Seunghyup; Lee, Min Hyung
Rigidity-Induced Delayed Fluorescence by Ortho Donor-Appended Triarylboron Compounds: Record-High Efficiency in Pure Blue Fluorescent Organic Light-Emitting Diodes.
ACS applied materials & interfaces, 2017, 9, 24035-24042
4516642 CIFC26 H18 Co4 N20 O10P -17.988; 9.978; 11.035
104.884; 98.534; 103.807
804.6Gong, Teng; Lou, Xiaobing; Gao, En-Qing; Hu, Bingwen
Pillared-Layer Metal-Organic Frameworks for Improved Lithium-Ion Storage Performance.
ACS applied materials & interfaces, 2017, 9, 21839-21847
4516643 CIFC22 H36 N2 O6P 21 21 215.6365; 7.316; 54.623
90; 90; 90
2252.5Nuthanakanti, Ashok; Srivatsan, Seergazhi G.
Surface-Tuned and Metal-Ion-Responsive Supramolecular Gels Based on Nucleolipids.
ACS applied materials & interfaces, 2017, 9, 22864-22874
4516644 CIFC26 H44 N2 O6P 21 21 215.5928; 7.2712; 63.511
90; 90; 90
2582.8Nuthanakanti, Ashok; Srivatsan, Seergazhi G.
Surface-Tuned and Metal-Ion-Responsive Supramolecular Gels Based on Nucleolipids.
ACS applied materials & interfaces, 2017, 9, 22864-22874
4516645 CIFC24 H40 N2 O6P 21 21 215.6059; 7.3036; 59.161
90; 90; 90
2422.24Nuthanakanti, Ashok; Srivatsan, Seergazhi G.
Surface-Tuned and Metal-Ion-Responsive Supramolecular Gels Based on Nucleolipids.
ACS applied materials & interfaces, 2017, 9, 22864-22874
4516646 CIFC45 H28 N10 Ni3 O18R -3 :H22.3712; 22.3712; 95.1715
90; 90; 120
41249.3Yu, Mei-Hui; Zhang, Ping; Feng, Rui; Yao, Zhao-Quan; Yu, Yi-Chen; Hu, Tong-Liang; Bu, Xian-He
Construction of a Multi-Cage-Based MOF with a Unique Network for Efficient CO<sub>2</sub> Capture.
ACS applied materials & interfaces, 2017, 9, 26177-26183
4516647 CIFC54 H24 Br6 Fe2 N6 O26P -3 1 m13.7841; 13.7841; 9.2424
90; 90; 120
1520.8Benmansour, Samia; Abhervé, Alexandre; Gómez-Claramunt, Patricia; Vallés-García, Cristina; Gómez-García, Carlos J
Nanosheets of Two-Dimensional Magnetic and Conducting Fe(II)/Fe(III) Mixed-Valence Metal-Organic Frameworks.
ACS applied materials & interfaces, 2017, 9, 26210-26218
4516648 CIFC54 H24 Cl6 Fe2 N6 O26P -3 1 m13.6909; 13.6909; 9.1968
90; 90; 120
1492.9Benmansour, Samia; Abhervé, Alexandre; Gómez-Claramunt, Patricia; Vallés-García, Cristina; Gómez-García, Carlos J
Nanosheets of Two-Dimensional Magnetic and Conducting Fe(II)/Fe(III) Mixed-Valence Metal-Organic Frameworks.
ACS applied materials & interfaces, 2017, 9, 26210-26218
4516649 CIFC27 H30 B3 N3 O9P -115.255; 15.812; 16.019
61.29; 71.61; 83
3214Gontarczyk, Krzysztof; Bury, Wojciech; Serwatowski, Janusz; Wieciński, Piotr; Woźniak, Krzysztof; Durka, Krzysztof; Luliński, Sergiusz
Hybrid Triazine-Boron Two-Dimensional Covalent Organic Frameworks: Synthesis, Characterization, and DFT Approach to Layer Interaction Energies.
ACS applied materials & interfaces, 2017, 9, 31129-31141
4516650 CIFC42 H33 In3 N0 O20 P2C 1 2/c 128.825; 11.472; 18.905
90; 106.62; 90
5990Du, Xi; Fan, Ruiqing; Qiang, Liangsheng; Xing, Kai; Ye, Haoxin; Ran, Xinya; Song, Yang; Wang, Ping; Yang, Yulin
Controlled Zn<sup>2+</sup>-Triggered Drug Release by Preferred Coordination of Open Active Sites within Functionalization Indium Metal Organic Frameworks.
ACS applied materials & interfaces, 2017, 9, 28939-28948
4516651 CIFC21 H12 In N0 O7 PR 3 :H14.1755; 14.1755; 9.5058
90; 90; 120
1654.2Du, Xi; Fan, Ruiqing; Qiang, Liangsheng; Xing, Kai; Ye, Haoxin; Ran, Xinya; Song, Yang; Wang, Ping; Yang, Yulin
Controlled Zn<sup>2+</sup>-Triggered Drug Release by Preferred Coordination of Open Active Sites within Functionalization Indium Metal Organic Frameworks.
ACS applied materials & interfaces, 2017, 9, 28939-28948
4516652 CIFC52 H36 Cd5 N8 O28I 1 2/a 116.039; 13.034; 42.157
90; 100.927; 90
8653Hong, Xu-Jia; Wei, Qin; Cai, Yue-Peng; Wu, Bing-Bing; Feng, Hai-Xing; Yu, Ying; Dong, Ren-Feng
Pillar-Layered Metal-Organic Framework with Sieving Effect and Pore Space Partition for Effective Separation of Mixed Gas C<sub>2</sub>H<sub>2</sub>/C<sub>2</sub>H<sub>4</sub>.
ACS applied materials & interfaces, 2017, 9, 29374-29379
4516742 CIFC78 H60 Cu3 N8 O15R -3 :H15.598; 15.598; 59.01
90; 90; 120
12434Wang, Xiao-Kun; Liu, Jiang; Zhang, Lei; Dong, Long-Zhang; Li, Shun-Li; Kan, Yu-He; Li, Dong-Sheng; Lan, Ya-Qian
Monometallic Catalytic Models Hosted in Stable Metal‒Organic Frameworks for Tunable CO2 Photoreduction
ACS Catalysis, 2019, 9, 1726
4516743 CIFC78 H66 Co3 N8 O18R -3 :H15.7439; 15.7439; 61.146
90; 90; 120
13125.7Wang, Xiao-Kun; Liu, Jiang; Zhang, Lei; Dong, Long-Zhang; Li, Shun-Li; Kan, Yu-He; Li, Dong-Sheng; Lan, Ya-Qian
Monometallic Catalytic Models Hosted in Stable Metal‒Organic Frameworks for Tunable CO2 Photoreduction
ACS Catalysis, 2019, 9, 1726
4516744 CIFC468 H450 N48 Ni18 O135R -3 :H15.7128; 15.7128; 60.539
90; 90; 120
12944.1Wang, Xiao-Kun; Liu, Jiang; Zhang, Lei; Dong, Long-Zhang; Li, Shun-Li; Kan, Yu-He; Li, Dong-Sheng; Lan, Ya-Qian
Monometallic Catalytic Models Hosted in Stable Metal‒Organic Frameworks for Tunable CO2 Photoreduction
ACS Catalysis, 2019, 9, 1726
4516815 CIFC11 H6 Br NP -14.7861; 5.9851; 7.9546
83.224; 75.23; 84.63
218.31Ossowski, Jakub; Wächter, Tobias; Silies, Laura; Kind, Martin; Noworolska, Agnieszka; Blobner, Florian; Gnatek, Dominika; Rysz, Jakub; Bolte, Michael; Feulner, Peter; Terfort, Andreas; Cyganik, Piotr; Zharnikov, Michael
Thiolate versus Selenolate: Structure, Stability, and Charge Transfer Properties.
ACS nano, 2015, 9, 4508-4526
4516816 CIFC11 H8 Br N OP 1 21/c 118.518; 6.151; 8.6436
90; 90.291; 90
984.53Ossowski, Jakub; Wächter, Tobias; Silies, Laura; Kind, Martin; Noworolska, Agnieszka; Blobner, Florian; Gnatek, Dominika; Rysz, Jakub; Bolte, Michael; Feulner, Peter; Terfort, Andreas; Cyganik, Piotr; Zharnikov, Michael
Thiolate versus Selenolate: Structure, Stability, and Charge Transfer Properties.
ACS nano, 2015, 9, 4508-4526
4518011 CIFC39 H72 N15 P3P 1 21/c 119.771; 13.978; 16.975
90; 90.001; 90
4691Wang, Lebin; Zhang, Jinbo; Zhao, Na; Ren, Chuanli; Liu, Shaofeng; Li, Zhibo
Synthesis of Tris-Phosphazene Bases with Triazine as Core and Their Applications for Efficient Ring-Opening Alternating Copolymerization of Epoxide and Anhydride: Notable Effect of Basicity and Molecular Size
ACS Macro Letters, 2020, 9, 1398-1402
4518012 CIFC21 H54 N15 P3P 1 2/c 123.6761; 7.0053; 22.401
90; 117.192; 90
3304.8Wang, Lebin; Zhang, Jinbo; Zhao, Na; Ren, Chuanli; Liu, Shaofeng; Li, Zhibo
Synthesis of Tris-Phosphazene Bases with Triazine as Core and Their Applications for Efficient Ring-Opening Alternating Copolymerization of Epoxide and Anhydride: Notable Effect of Basicity and Molecular Size
ACS Macro Letters, 2020, 9, 1398-1402
4518408 CIFC164 H312 N16 O19 Zn8P 1 21/c 117.095; 14.339; 38.364
90; 106.233; 90
9029.1Krupiński, Piotr; Grala, Agnieszka; Wolska-Pietkiewicz, Małgorzata; Danowski, Wojciech; Justyniak, Iwona; Lewiński, Janusz
From Uncommon Ethylzinc Complexes Supported by Ureate Ligands to Water-Soluble ZnO Nanocrystals: A Mechanochemical Approach
ACS Sustainable Chemistry & Engineering, 2021, 9, 1540-1549
4518484 CIFC26 H45 N8 O30 Zn3.5P -17.272; 11.453; 12.792
105.317; 97.72; 94.62
1010.7Li, Yixing; Zhang, Xiao; Lan, Jianwen; Li, Dazhi; Wang, Zhijiang; Xu, Ping; Sun, Jianmin
A High-Performance Zinc-Organic Framework with Accessible Open Metal Sites Catalyzes CO2 and Styrene Oxide into Styrene Carbonate under Mild Conditions
ACS Sustainable Chemistry & Engineering, 2021, 9, 2795-2803
4518547 CIFC20 H27 N O2P -17.9105; 10.1433; 12.1778
68.787; 73.015; 71.871
847.74Zhou, Kun; Hao, Hong-Yan; Mao, Yang-Jie; Wu, Qiu-Zi; Chen, Lei; Wang, Shuang; Jin, Wu; Xu, Zhen-Yuan; Lou, Shao-Jie; Xu, Dan-Qian
Solvent-less Dehydrogenative C–H Etherification with Alcohols Using Mechanochemistry
ACS Sustainable Chemistry & Engineering, 2021, 9, 4433-4439
4518570 CIFC14 H14 N4 O6 V2 ZnP 1 21/c 18.0272; 10.3866; 21.6398
90; 95.314; 90
1796.5Tian, Hongrui; Liu, Shumei; Zhang, Zhong; Dang, Tianyi; Lu, Ying; Liu, Shuxia
Highly Stable Polyoxovanadate-Based Zn‒MOF with Dual Active Sites as a Solvent-free Catalyst for C‒C Bond Formation
ACS Sustainable Chemistry & Engineering, 2021, 9, 4660-4667
4518716 CIFC12 H8 Br N O2 S2P -17.3124; 8.0674; 11.1844
90.429; 96.849; 93.54
653.76Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej
Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides
ACS Sustainable Chemistry & Engineering, 2021, 9, 7171-7178
4518717 CIFC12 H8 Br N O2 S2P -17.5012; 7.6684; 12.37
77.306; 82.115; 74.588
666.8Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej
Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides
ACS Sustainable Chemistry & Engineering, 2021, 9, 7171-7178
4518718 CIFC12 H8 Cl N O2 S2P -17.4862; 7.6173; 12.26
77.313; 81.768; 74.085
653.34Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej
Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides
ACS Sustainable Chemistry & Engineering, 2021, 9, 7171-7178
4518719 CIFC13 H11 N O2 S2P 1 21/c 16.637; 24.4347; 7.9539
90; 93.577; 90
1287.4Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej
Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides
ACS Sustainable Chemistry & Engineering, 2021, 9, 7171-7178
4518720 CIFC13 H9 Cl O2 S2P 1 21/c 15.4415; 7.9266; 30.427
90; 94.695; 90
1308Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej
Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides
ACS Sustainable Chemistry & Engineering, 2021, 9, 7171-7178
4518721 CIFC13 H9 Br O2 S2P 1 21/c 15.4811; 7.9282; 30.7236
90; 95.134; 90
1329.75Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej
Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides
ACS Sustainable Chemistry & Engineering, 2021, 9, 7171-7178
4518722 CIFC14 H14 O2 S2P 21 21 215.9037; 12.98; 17.9041
90; 90; 90
1371.99Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej
Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides
ACS Sustainable Chemistry & Engineering, 2021, 9, 7171-7178
4518723 CIFC12 H8 F2 S2P 21 21 215.7416; 13.0516; 14.497
90; 90; 90
1086.36Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej
Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides
ACS Sustainable Chemistry & Engineering, 2021, 9, 7171-7178
4518724 CIFC12 H8 Br2 S2C c c 27.7242; 28.033; 5.9565
90; 90; 90
1289.8Sobczak, Szymon; Ratajczyk, Paulina; Katrusiak, Andrzej
Squeezing Out the Catalysts: A Sustainable Approach to Disulfide Bond Exchange in Aryl Disulfides
ACS Sustainable Chemistry & Engineering, 2021, 9, 7171-7178
4519018 CIFC19 H15 F N O2 PP -18.6254; 8.9016; 10.8499
80.225; 85.954; 77.248
800.24Huke, Cameron D.; Taylor, Laurence J.; Argent, Stephen P.; Kays, Deborah L.
Catalyst-free Hydrophosphinylation of Isocyanates and Isothiocyanates under Low-Added-Solvent Conditions
ACS Sustainable Chemistry & Engineering, 2021, 9, 10704-10709
4519019 CIFC21 H20 N O4 PP -111.1796; 12.4375; 14.5087
102.974; 93.417; 104.758
1886.37Huke, Cameron D.; Taylor, Laurence J.; Argent, Stephen P.; Kays, Deborah L.
Catalyst-free Hydrophosphinylation of Isocyanates and Isothiocyanates under Low-Added-Solvent Conditions
ACS Sustainable Chemistry & Engineering, 2021, 9, 10704-10709
4519020 CIFC15 H16 N O2 PP -18.7838; 8.7951; 20.4442
90.45; 93.891; 117.301
1398.88Huke, Cameron D.; Taylor, Laurence J.; Argent, Stephen P.; Kays, Deborah L.
Catalyst-free Hydrophosphinylation of Isocyanates and Isothiocyanates under Low-Added-Solvent Conditions
ACS Sustainable Chemistry & Engineering, 2021, 9, 10704-10709

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