Crystallography Open Database

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1544986 CIFC36 H34 Cl4 Cu4 I4 N6 S4C 1 2/c 125.9718; 10.2757; 17.5936
90; 90.94; 90		4694.72Lee, Hyeong-Hwan; Park, In-Hyeok; Kim, Seulgi; Lee, Eunji; Ju, Huiyeong; Jung, Jong Hwa; Ikeda, Mari; Habata, Yoichi; Lee, Shim Sung
Anion exchange coupled with the reduction and dimerisation of a copper(ii) nitrate complex of tripyridyl dithioether via a single-crystal-to-single-crystal transformation
Chem. Sci., 2017, 8, 2592
1544987 CIFC17 H15 Cu N5 O6 S2C 1 2/c 117.889; 12.2339; 20.7705
90; 101.703; 90		4451.18Lee, Hyeong-Hwan; Park, In-Hyeok; Kim, Seulgi; Lee, Eunji; Ju, Huiyeong; Jung, Jong Hwa; Ikeda, Mari; Habata, Yoichi; Lee, Shim Sung
Anion exchange coupled with the reduction and dimerisation of a copper(ii) nitrate complex of tripyridyl dithioether via a single-crystal-to-single-crystal transformation
Chem. Sci., 2017, 8, 2592
1544988 CIFC34 H30 Cu2 I2 N6 S4P 1 21/n 110.1355; 8.3969; 21.0712
90; 95.58; 90		1784.8Lee, Hyeong-Hwan; Park, In-Hyeok; Kim, Seulgi; Lee, Eunji; Ju, Huiyeong; Jung, Jong Hwa; Ikeda, Mari; Habata, Yoichi; Lee, Shim Sung
Anion exchange coupled with the reduction and dimerisation of a copper(ii) nitrate complex of tripyridyl dithioether via a single-crystal-to-single-crystal transformation
Chem. Sci., 2017, 8, 2592
1544989 CIFC17 H15 N3 S2P 1 21/n 110.5537; 9.2526; 16.335
90; 107.345; 90		1522.57Lee, Hyeong-Hwan; Park, In-Hyeok; Kim, Seulgi; Lee, Eunji; Ju, Huiyeong; Jung, Jong Hwa; Ikeda, Mari; Habata, Yoichi; Lee, Shim Sung
Anion exchange coupled with the reduction and dimerisation of a copper(ii) nitrate complex of tripyridyl dithioether via a single-crystal-to-single-crystal transformation
Chem. Sci., 2017, 8, 2592
1544991 CIFC18 H17 F3 O2 S2P c a 2111.2567; 11.6409; 27.0758
90; 90; 90		3548Li, Haoyu; Shan, Cuicui; Tung, Chen-Ho; Xu, Zhenghu
Dual gold and photoredox catalysis: visible light-mediated intermolecular atom transfer thiosulfonylation of alkenes
Chem. Sci., 2017, 8, 2610
1544992 CIFC12 H13 F3 O2 S2P -15.6786; 8.4547; 15.2755
95.353; 96.231; 102.129		707.68Li, Haoyu; Shan, Cuicui; Tung, Chen-Ho; Xu, Zhenghu
Dual gold and photoredox catalysis: visible light-mediated intermolecular atom transfer thiosulfonylation of alkenes
Chem. Sci., 2017, 8, 2610
1545006 CIFC252 H330 Ag28 P4 Pt S18C 1 2/c 150.8135; 29.3497; 49.1614
90; 110.274; 90		68775Kang, Xi; Zhou, Meng; Wang, Shuxin; Jin, Shan; Sun, Guodong; Zhu, Manzhou; Jin, Rongchao
The tetrahedral structure and luminescence properties of Bi-metallic Pt1Ag28(SR)18(PPh3)4 nanocluster
Chem. Sci., 2017, 8, 2581
1545025 CIFC45 H26 Cl N4 S2C 1 2/c 130.0933; 8.439; 26.6268
90; 95.566; 90		6730.2Okazaki, Masato; Takeda, Youhei; Data, Przemyslaw; Pander, Piotr; Higginbotham, Heather; Monkman, Andrew P.; Minakata, Satoshi
Thermally activated delayed fluorescent phenothiazine‒dibenzo[a,j]phenazine‒phenothiazine triads exhibiting tricolor-changing mechanochromic luminescence
Chem. Sci., 2017, 8, 2677
1545026 CIFC10 H8 S2P 1 21/c 15.81321; 7.5432; 10.2777
90; 93.249; 90		449.95Viglianti, Lucia; Leung, Nelson L. C.; Xie, Ni; Gu, Xinggui; Sung, Herman H. Y.; Miao, Qian; Williams, Ian D.; Licandro, Emanuela; Tang, Ben Zhong
Aggregation-induced emission: mechanistic study of the clusteroluminescence of tetrathienylethene
Chem. Sci., 2017, 8, 2629
1545027 CIFC18 H10 S4P 1 21/n 110.91901; 8.76755; 15.8755
90; 93.1272; 90		1517.55Viglianti, Lucia; Leung, Nelson L. C.; Xie, Ni; Gu, Xinggui; Sung, Herman H. Y.; Miao, Qian; Williams, Ian D.; Licandro, Emanuela; Tang, Ben Zhong
Aggregation-induced emission: mechanistic study of the clusteroluminescence of tetrathienylethene
Chem. Sci., 2017, 8, 2629
1545028 CIFC18 H12 S4P 1 21/n 19.316; 9.10329; 9.6346
90; 110.853; 90		763.55Viglianti, Lucia; Leung, Nelson L. C.; Xie, Ni; Gu, Xinggui; Sung, Herman H. Y.; Miao, Qian; Williams, Ian D.; Licandro, Emanuela; Tang, Ben Zhong
Aggregation-induced emission: mechanistic study of the clusteroluminescence of tetrathienylethene
Chem. Sci., 2017, 8, 2629
1545045 CIFC55 H23 Co F28 N4 O9 P3 YbC 1 2/c 124.588; 10.147; 24.582
90; 92.11; 90		6129Hu, Ji-Yun; Ning, Yingying; Meng, Yin-Shan; Zhang, Jing; Wu, Zhuo-Yan; Gao, Song; Zhang, Jun-Long
Highly near-IR emissive ytterbium(iii) complexes with unprecedented quantum yields
Chem. Sci., 2017, 8, 2702
1545046 CIFC57 H34 Cl5 Co F20 N4 O11 P3 YbC m c m15.8901; 19.2041; 22.9477
90; 90; 90		7002.6Hu, Ji-Yun; Ning, Yingying; Meng, Yin-Shan; Zhang, Jing; Wu, Zhuo-Yan; Gao, Song; Zhang, Jun-Long
Highly near-IR emissive ytterbium(iii) complexes with unprecedented quantum yields
Chem. Sci., 2017, 8, 2702
1545047 CIFC55 H25 Co D18 F8 N4 O9 P3 YbP -112.2948; 14.0793; 16.6204
72.8693; 73.873; 77.72		2614.22Hu, Ji-Yun; Ning, Yingying; Meng, Yin-Shan; Zhang, Jing; Wu, Zhuo-Yan; Gao, Song; Zhang, Jun-Long
Highly near-IR emissive ytterbium(iii) complexes with unprecedented quantum yields
Chem. Sci., 2017, 8, 2702
1545050 CIFC49 H42 F24 N8 O4 P4P 1 21/n 110.6431; 41.576; 13.8546
90; 110.763; 90		5732.5Wang, Yuping; Sun, Junling; Liu, Zhichang; Nassar, Majed S.; Botros, Youssry Y.; Stoddart, J. Fraser
Radically promoted formation of a molecular lasso
Chem. Sci., 2017, 8, 2562
1545090 CIFC22 H29 F N3 O9 PP 21 21 2111.355; 13.612; 16.835
90; 90; 90		2602.1McCabe Dunn, Jamie M.; Reibarkh, Mikhail; Sherer, Edward C.; Orr, Robert K.; Ruck, Rebecca T.; Simmons, Bryon; Bellomo, Ana
The protecting-group free selective 3′-functionalization of nucleosides
Chem. Sci., 2017, 8, 2804
1545091 CIFC18 H17 F5 N O5 PP 15.2533; 12.0015; 16.3874
74.879; 84.088; 80.148		980.85McCabe Dunn, Jamie M.; Reibarkh, Mikhail; Sherer, Edward C.; Orr, Robert K.; Ruck, Rebecca T.; Simmons, Bryon; Bellomo, Ana
The protecting-group free selective 3′-functionalization of nucleosides
Chem. Sci., 2017, 8, 2804
1545092 CIFC16 H15 Br O2C 1 2 119.2401; 7.48163; 19.9656
90; 104.461; 90		2782.94Kossler, D.; Cramer, N.
Neutral chiral cyclopentadienyl Ru(ii)Cl catalysts enable enantioselective [2+2]-cycloadditions
Chem. Sci., 2017, 8, 1862
1545093 CIFC54 H51 Cl O2 RuP 110.9092; 12.5543; 15.2599
86.71; 83.989; 89.249		2074.99Kossler, D.; Cramer, N.
Neutral chiral cyclopentadienyl Ru(ii)Cl catalysts enable enantioselective [2+2]-cycloadditions
Chem. Sci., 2017, 8, 1862
1545094 CIFC46 H50 Br Cl2 N3 O2 P2 PdP 21 21 2112.7416; 15.3629; 22.5851
90; 90; 90		4420.99Ji, Yining; Li, Hongming; Hyde, Alan M.; Chen, Qinghao; Belyk, Kevin M.; Lexa, Katrina W.; Yin, Jingjun; Sherer, Edward C.; Williamson, R. Thomas; Brunskill, Andrew; Ren, Sumei; Campeau, Louis-Charles; Davies, Ian W.; Ruck, Rebecca T.
A rational pre-catalyst design for bis-phosphine mono-oxide palladium catalyzed reactions
Chem. Sci., 2017, 8, 2841
1545095 CIFC18 H28 Br2 N2 P2 PdP 21 21 217.6802; 15.4523; 18.383
90; 90; 90		2181.63Ji, Yining; Li, Hongming; Hyde, Alan M.; Chen, Qinghao; Belyk, Kevin M.; Lexa, Katrina W.; Yin, Jingjun; Sherer, Edward C.; Williamson, R. Thomas; Brunskill, Andrew; Ren, Sumei; Campeau, Louis-Charles; Davies, Ian W.; Ruck, Rebecca T.
A rational pre-catalyst design for bis-phosphine mono-oxide palladium catalyzed reactions
Chem. Sci., 2017, 8, 2841
1545096 CIFC25 H32 Br N3 O P2 PdC 1 2 123.434; 10.7208; 10.6091
90; 95.3448; 90		2653.7Ji, Yining; Li, Hongming; Hyde, Alan M.; Chen, Qinghao; Belyk, Kevin M.; Lexa, Katrina W.; Yin, Jingjun; Sherer, Edward C.; Williamson, R. Thomas; Brunskill, Andrew; Ren, Sumei; Campeau, Louis-Charles; Davies, Ian W.; Ruck, Rebecca T.
A rational pre-catalyst design for bis-phosphine mono-oxide palladium catalyzed reactions
Chem. Sci., 2017, 8, 2841
1545097 CIFC26 H24 N2 O6 S2P 21 21 218.7715; 15.9157; 36.3389
90; 90; 90		5073.1Liu, Ren-Rong; Hu, Jiang-Ping; Hong, Jian-Jun; Lu, Chuan-Jun; Gao, Jian-Rong; Jia, Yi-Xia
Enantioselective [2 + 2] cycloaddition of N-allenamides with cyclic N-sulfonylketimines: access to polysubstituted azetidines bearing quaternary stereocenters
Chem. Sci., 2017, 8, 2811
1545143 CIFC31 H28 O2P 21 21 215.8387; 15.6232; 25.7309
90; 90; 90		2347.15Guo, Rui; Zheng, Xinxin; Zhang, Dayong; Zhang, Guozhu
Rhodium(i)-catalyzed stereoselective [4+2] cycloaddition of oxetanols with alkynes through C(sp(3))-C(sp(3)) bond cleavage.
Chemical science, 2017, 8, 3002-3006
1545144 CIFC26 H26 O3P 1 21 112.8937; 6.0514; 14.068
90; 107.517; 90		1046.75Guo, Rui; Zheng, Xinxin; Zhang, Dayong; Zhang, Guozhu
Rhodium(i)-catalyzed stereoselective [4+2] cycloaddition of oxetanols with alkynes through C(sp(3))-C(sp(3)) bond cleavage.
Chemical science, 2017, 8, 3002-3006
1545162 CIFC53 H90 N10 O11P 19.302; 9.7698; 16.9249
84.505; 86.765; 71.597		1452.19Tomsett, Michael; Maffucci, Irene; Le Bailly, Bryden A. F.; Byrne, Liam; Bijvoets, Stefan M.; Lizio, M. Giovanna; Raftery, James; Butts, Craig P.; Webb, Simon J.; Contini, Alessandro; Clayden, Jonathan
A tendril perversion in a helical oligomer: trapping and characterizing a mobile screw-sense reversal.
Chemical science, 2017, 8, 3007-3018
1545163 CIFC55 H93 N11 O11P 1 21 113.6336; 14.6369; 33.2755
90; 89.215; 90		6639.6Tomsett, Michael; Maffucci, Irene; Le Bailly, Bryden A. F.; Byrne, Liam; Bijvoets, Stefan M.; Lizio, M. Giovanna; Raftery, James; Butts, Craig P.; Webb, Simon J.; Contini, Alessandro; Clayden, Jonathan
A tendril perversion in a helical oligomer: trapping and characterizing a mobile screw-sense reversal.
Chemical science, 2017, 8, 3007-3018
1545166 CIFC41 H57 F7 N3 O12 PP 1 21 19.9986; 18.897; 12.05
90; 91.502; 90		2276Saito, Fumito; Bode, Jeffrey W.
Synthesis and stabilities of peptide-based [1]rotaxanes: molecular grafting onto lasso peptide scaffolds
Chem. Sci., 2017, 8, 2878
1545174 CIFC15 H12 B Cl O3P 21 21 2113.0121; 5.2339; 19.82
90; 90; 90		1349.82Hazra, Gurupada; Maity, Sanjay; Bhowmick, Sudipto; Ghorai, Prasanta
Organocatalytic, enantioselective synthesis of benzoxaboroles via Wittig/oxa-Michael reaction Cascade of α-formyl boronic acids.
Chemical science, 2017, 8, 3026-3030
1545175 CIFC14 H14 O4P 1 21 19.16074; 6.01447; 10.6243
90; 92.073; 90		584.984Orue, Ane; Uria, Uxue; Roca-López, David; Delso, Ignacio; Reyes, Efraím; Carrillo, Luisa; Merino, Pedro; Vicario, Jose L.
Racemic hemiacetals as oxygen-centered pronucleophiles triggering cascade 1,4-addition/Michael reaction through dynamic kinetic resolution under iminium catalysis. Development and mechanistic insights.
Chemical science, 2017, 8, 2904-2913
1545176 CIFC13 H20 O4P 21 21 215.5604; 6.6895; 33.0826
90; 90; 90		1230.55Orue, Ane; Uria, Uxue; Roca-López, David; Delso, Ignacio; Reyes, Efraím; Carrillo, Luisa; Merino, Pedro; Vicario, Jose L.
Racemic hemiacetals as oxygen-centered pronucleophiles triggering cascade 1,4-addition/Michael reaction through dynamic kinetic resolution under iminium catalysis. Development and mechanistic insights.
Chemical science, 2017, 8, 2904-2913
1545177 CIFC18 H22 O6P 21 21 218.9615; 10.02283; 17.71277
90; 90; 90		1590.95Orue, Ane; Uria, Uxue; Roca-López, David; Delso, Ignacio; Reyes, Efraím; Carrillo, Luisa; Merino, Pedro; Vicario, Jose L.
Racemic hemiacetals as oxygen-centered pronucleophiles triggering cascade 1,4-addition/Michael reaction through dynamic kinetic resolution under iminium catalysis. Development and mechanistic insights.
Chemical science, 2017, 8, 2904-2913
1545178 CIFC10 H11 N3 O6 SP 1 21 16.8159; 9.972; 17.7839
90; 98.748; 90		1194.68Rovira, Alexander R.; Fin, Andrea; Tor, Yitzhak
Expanding a fluorescent RNA alphabet: synthesis, photophysics and utility of isothiazole-derived purine nucleoside surrogates.
Chemical science, 2017, 8, 2983-2993
1545179 CIFC8 H8 Br N5 O SP 1 21/n 115.3538; 4.3958; 17.1443
90; 112.351; 90		1070.18Rovira, Alexander R.; Fin, Andrea; Tor, Yitzhak
Expanding a fluorescent RNA alphabet: synthesis, photophysics and utility of isothiazole-derived purine nucleoside surrogates.
Chemical science, 2017, 8, 2983-2993
1545180 CIFC10 H15.5 N4 O6.75 SP 18.0883; 10.9716; 16.0771
72.07; 80.273; 86.279		1337.78Rovira, Alexander R.; Fin, Andrea; Tor, Yitzhak
Expanding a fluorescent RNA alphabet: synthesis, photophysics and utility of isothiazole-derived purine nucleoside surrogates.
Chemical science, 2017, 8, 2983-2993
1545181 CIFC2.5 H2.5 Np0.12I -4 2 m8.598; 8.598; 10.5541
90; 90; 90		780.22Dutkiewicz, Michał S.; Apostolidis, Christos; Walter, Olaf; Arnold, Polly L.
Reduction chemistry of neptunium cyclopentadienide complexes: from structure to understanding
Chem. Sci., 2017, 8, 2553
1545182 CIFC32 H35 K1.5 Np1.5 O0.5C 1 2 122.6093; 14.7125; 9.0155
90; 90.415; 90		2998.8Dutkiewicz, Michał S.; Apostolidis, Christos; Walter, Olaf; Arnold, Polly L.
Reduction chemistry of neptunium cyclopentadienide complexes: from structure to understanding
Chem. Sci., 2017, 8, 2553
1545183 CIFC15 H15 NpC m c 2114.1208; 8.7037; 9.5917
90; 90; 90		1178.85Dutkiewicz, Michał S.; Apostolidis, Christos; Walter, Olaf; Arnold, Polly L.
Reduction chemistry of neptunium cyclopentadienide complexes: from structure to understanding
Chem. Sci., 2017, 8, 2553
1545184 CIFC19 H21 N2 NpP b c n13.6966; 8.3864; 14.6562
90; 90; 90		1683.5Dutkiewicz, Michał S.; Apostolidis, Christos; Walter, Olaf; Arnold, Polly L.
Reduction chemistry of neptunium cyclopentadienide complexes: from structure to understanding
Chem. Sci., 2017, 8, 2553
1545185 CIFC24 H39 Np Si3P b c a8.298; 22.1664; 28.917
90; 90; 90		5318.9Dutkiewicz, Michał S.; Apostolidis, Christos; Walter, Olaf; Arnold, Polly L.
Reduction chemistry of neptunium cyclopentadienide complexes: from structure to understanding
Chem. Sci., 2017, 8, 2553
1545242 CIFC22 H17 Br F N O2P 1 21/c 115.3026; 12.0184; 10.1214
90; 90.552; 90		1861.37Thornbury, Richard T.; Saini, Vaneet; Fernandes, Talita de A; Santiago, Celine B.; Talbot, Eric P. A.; Sigman, Matthew S.; McKenna, Jeffrey M.; Toste, F. Dean
The development and mechanistic investigation of a palladium-catalyzed 1,3-arylfluorination of chromenes.
Chemical science, 2017, 8, 2890-2897
1545255 CIFC30 H30 B2 F8 Fe N24P 63/m10.4852; 10.4852; 23.308
90; 90; 120		2219.2Giménez-Marqués, Mónica; Calvo Galve, Néstor; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Sastre, Germán; Vitórica-Yrezábal, Iñigo J.; Jiménez-Ruiz, Mónica; Rodríguez-Velamazán, J. Alberto; González, Miguel A.; Jordá, José L.; Coronado, Eugenio; Espallargas, Guillermo Mínguez
Gas confinement in compartmentalized coordination polymers for highly selective sorption
Chem. Sci., 2017, 8, 3109
1545256 CIFC30 H30 B2 F8 Fe N24P 63/m10.369; 10.369; 22.9628
90; 90; 120		2138.1Giménez-Marqués, Mónica; Calvo Galve, Néstor; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Sastre, Germán; Vitórica-Yrezábal, Iñigo J.; Jiménez-Ruiz, Mónica; Rodríguez-Velamazán, J. Alberto; González, Miguel A.; Jordá, José L.; Coronado, Eugenio; Espallargas, Guillermo Mínguez
Gas confinement in compartmentalized coordination polymers for highly selective sorption
Chem. Sci., 2017, 8, 3109
1545257 CIFC31.12 H30 Cl2 Fe N24 O10.24P 63/m10.55931; 10.55931; 23.6672
90; 90; 120		2285.33Giménez-Marqués, Mónica; Calvo Galve, Néstor; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Sastre, Germán; Vitórica-Yrezábal, Iñigo J.; Jiménez-Ruiz, Mónica; Rodríguez-Velamazán, J. Alberto; González, Miguel A.; Jordá, José L.; Coronado, Eugenio; Espallargas, Guillermo Mínguez
Gas confinement in compartmentalized coordination polymers for highly selective sorption
Chem. Sci., 2017, 8, 3109
1545258 CIFC31.63 H33.26 Cl2 Fe N24 O8P 63/m10.52034; 10.52034; 23.5917
90; 90; 120		2261.25Giménez-Marqués, Mónica; Calvo Galve, Néstor; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Sastre, Germán; Vitórica-Yrezábal, Iñigo J.; Jiménez-Ruiz, Mónica; Rodríguez-Velamazán, J. Alberto; González, Miguel A.; Jordá, José L.; Coronado, Eugenio; Espallargas, Guillermo Mínguez
Gas confinement in compartmentalized coordination polymers for highly selective sorption
Chem. Sci., 2017, 8, 3109
1545259 CIFC30.78 H33.12 Cl2 Fe N24 O8P 63/m10.5426; 10.5426; 23.6588
90; 90; 120		2277.29Giménez-Marqués, Mónica; Calvo Galve, Néstor; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Sastre, Germán; Vitórica-Yrezábal, Iñigo J.; Jiménez-Ruiz, Mónica; Rodríguez-Velamazán, J. Alberto; González, Miguel A.; Jordá, José L.; Coronado, Eugenio; Espallargas, Guillermo Mínguez
Gas confinement in compartmentalized coordination polymers for highly selective sorption
Chem. Sci., 2017, 8, 3109
1545260 CIFC31.044 H30 B2 F8 Fe N24 O2.088P 63/m10.57127; 10.57127; 23.4813
90; 90; 120		2272.52Giménez-Marqués, Mónica; Calvo Galve, Néstor; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Sastre, Germán; Vitórica-Yrezábal, Iñigo J.; Jiménez-Ruiz, Mónica; Rodríguez-Velamazán, J. Alberto; González, Miguel A.; Jordá, José L.; Coronado, Eugenio; Espallargas, Guillermo Mínguez
Gas confinement in compartmentalized coordination polymers for highly selective sorption
Chem. Sci., 2017, 8, 3109
1545261 CIFC31.8 H33.6 B2 F8 Fe N24P 63/m10.57281; 10.57281; 23.49996
90; 90; 120		2274.99Giménez-Marqués, Mónica; Calvo Galve, Néstor; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Sastre, Germán; Vitórica-Yrezábal, Iñigo J.; Jiménez-Ruiz, Mónica; Rodríguez-Velamazán, J. Alberto; González, Miguel A.; Jordá, José L.; Coronado, Eugenio; Espallargas, Guillermo Mínguez
Gas confinement in compartmentalized coordination polymers for highly selective sorption
Chem. Sci., 2017, 8, 3109
1545262 CIFC30.84 H33.36 B2 F8 Fe N24P 63/m10.5681; 10.5681; 23.4989
90; 90; 120		2272.86Giménez-Marqués, Mónica; Calvo Galve, Néstor; Palomino, Miguel; Valencia, Susana; Rey, Fernando; Sastre, Germán; Vitórica-Yrezábal, Iñigo J.; Jiménez-Ruiz, Mónica; Rodríguez-Velamazán, J. Alberto; González, Miguel A.; Jordá, José L.; Coronado, Eugenio; Espallargas, Guillermo Mínguez
Gas confinement in compartmentalized coordination polymers for highly selective sorption
Chem. Sci., 2017, 8, 3109
1545263 CIFC24 H26 Cl2 Co N4 O9P 1 21/c 118.258; 11.064; 14.334
90; 101.816; 90		2834.2Vallejo, J.; Pardo, E.; Viciano-Chumillas, M.; Castro, I.; Amorós, P.; Déniz, M.; Ruiz-Pérez, C.; Yuste-Vivas, C.; Krzystek, J.; Julve, M.; Lloret, F.; Cano, J.
Reversible solvatomagnetic switching in a single-ion magnet from an entatic state
Chem. Sci., 2017, 8, 3694
1545264 CIFC24 H24 Cl2 Co N4 O8P 1 21/c 118.0546; 11.9616; 13.4228
90; 105.413; 90		2794.6Vallejo, J.; Pardo, E.; Viciano-Chumillas, M.; Castro, I.; Amorós, P.; Déniz, M.; Ruiz-Pérez, C.; Yuste-Vivas, C.; Krzystek, J.; Julve, M.; Lloret, F.; Cano, J.
Reversible solvatomagnetic switching in a single-ion magnet from an entatic state
Chem. Sci., 2017, 8, 3694
1545265 CIFC38 H55 Cl Pb Ru Si2P 1 21/n 19.728; 18.602; 21.538
90; 95.419; 90		3880.1Nakada, Marisa; Kuwabara, Takuya; Furukawa, Shunsuke; Hada, Masahiko; Minoura, Mao; Saito, Masaichi
Synthesis and reactivity of a ruthenocene-type complex bearing an aromatic π-ligand with the heaviest group 14 element
Chem. Sci., 2017, 8, 3092
1545266 CIFC44 H69 I Pb Ru Si2P b c a10.393; 22.3163; 39.5129
90; 90; 90		9164.4Nakada, Marisa; Kuwabara, Takuya; Furukawa, Shunsuke; Hada, Masahiko; Minoura, Mao; Saito, Masaichi
Synthesis and reactivity of a ruthenocene-type complex bearing an aromatic π-ligand with the heaviest group 14 element
Chem. Sci., 2017, 8, 3092
1545267 CIFC40.55 H59.95 Cl0.15 Pb Ru Si2P 1 21/c 116.7796; 11.2019; 21.597
90; 98.91; 90		4010.5Nakada, Marisa; Kuwabara, Takuya; Furukawa, Shunsuke; Hada, Masahiko; Minoura, Mao; Saito, Masaichi
Synthesis and reactivity of a ruthenocene-type complex bearing an aromatic π-ligand with the heaviest group 14 element
Chem. Sci., 2017, 8, 3092
1545268 CIFC54 H87 Li O4 Pb Ru Si2P -112.7785; 14.3628; 15.1226
97.836; 96.992; 93.261		2721.5Nakada, Marisa; Kuwabara, Takuya; Furukawa, Shunsuke; Hada, Masahiko; Minoura, Mao; Saito, Masaichi
Synthesis and reactivity of a ruthenocene-type complex bearing an aromatic π-ligand with the heaviest group 14 element
Chem. Sci., 2017, 8, 3092
1545280 CIFC28 H40 F4 N P2 RhC 1 2/c 122.851; 9.929; 16.292
90; 131.487; 90		2769Pell, Christopher J.; Zhu, Yanjun; Huacuja, Rafael; Herbert, David E.; Hughes, Russell P.; Ozerov, Oleg V.
Fluorocarbene, fluoroolefin, and fluorocarbyne complexes of Rh
Chem. Sci., 2017, 8, 3178
1545281 CIFC27 H40 F2 N P2 RhP n a 2116.693; 16.565; 9.888
90; 90; 90		2734.2Pell, Christopher J.; Zhu, Yanjun; Huacuja, Rafael; Herbert, David E.; Hughes, Russell P.; Ozerov, Oleg V.
Fluorocarbene, fluoroolefin, and fluorocarbyne complexes of Rh
Chem. Sci., 2017, 8, 3178
1545282 CIFC28 H41 B11 Cl11 F N P2 RhP n a 2120.427; 19.756; 11.606
90; 90; 90		4684Pell, Christopher J.; Zhu, Yanjun; Huacuja, Rafael; Herbert, David E.; Hughes, Russell P.; Ozerov, Oleg V.
Fluorocarbene, fluoroolefin, and fluorocarbyne complexes of Rh
Chem. Sci., 2017, 8, 3178
1545287 CIFC56 H94 Cl4 Cu4 N10 O24P -112.2247; 12.3904; 15.0274
106.67; 96.765; 118.889		1817.8Goswami, V. E.; Walli, A.; Förster, M; Dechert, S.; Demeshko, S.; Holthausen, M. C.; Meyer, F.
Acid/base triggered interconversion of μ-η(2):η(2)-peroxido and bis(μ-oxido) dicopper intermediates capped by proton-responsive ligands.
Chemical science, 2017, 8, 3031-3037
1545288 CIFC40 H71 Cl2 Cu2 N5 O17P 1 21/c 110.9869; 18.6852; 13.1285
90; 108.876; 90		2550.2Goswami, V. E.; Walli, A.; Förster, M; Dechert, S.; Demeshko, S.; Holthausen, M. C.; Meyer, F.
Acid/base triggered interconversion of μ-η(2):η(2)-peroxido and bis(μ-oxido) dicopper intermediates capped by proton-responsive ligands.
Chemical science, 2017, 8, 3031-3037
1545289 CIFC36 H64 Cl2 Cu2 N4 O17P 1 21/c 116.6993; 15.6606; 17.7512
90; 92.035; 90		4639.4Goswami, V. E.; Walli, A.; Förster, M; Dechert, S.; Demeshko, S.; Holthausen, M. C.; Meyer, F.
Acid/base triggered interconversion of μ-η(2):η(2)-peroxido and bis(μ-oxido) dicopper intermediates capped by proton-responsive ligands.
Chemical science, 2017, 8, 3031-3037
1545290 CIFC34 H58 Cu2 N4 O8P n n a14.5909; 12.6902; 20.135
90; 90; 90		3728.23Goswami, V. E.; Walli, A.; Förster, M; Dechert, S.; Demeshko, S.; Holthausen, M. C.; Meyer, F.
Acid/base triggered interconversion of μ-η(2):η(2)-peroxido and bis(μ-oxido) dicopper intermediates capped by proton-responsive ligands.
Chemical science, 2017, 8, 3031-3037
1545291 CIFC28 H46 Cu2 F6 N4 O12 S2P 1 21/n 19.5488; 11.0676; 18.7942
90; 101.996; 90		1942.84Goswami, V. E.; Walli, A.; Förster, M; Dechert, S.; Demeshko, S.; Holthausen, M. C.; Meyer, F.
Acid/base triggered interconversion of μ-η(2):η(2)-peroxido and bis(μ-oxido) dicopper intermediates capped by proton-responsive ligands.
Chemical science, 2017, 8, 3031-3037
1545338 CIFC24 H44 Ce N O8 Pt2 S8P 4/m c c8.6742; 8.6742; 25.3428
90; 90; 90		1906.84Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545339 CIFC24 H44 Ho N O8 Pt2 S8P 4/m c c8.5991; 8.5991; 25.4694
90; 90; 90		1883.32Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545340 CIFC24 H44 La N O8 Pt2 S8P 4/m c c8.6867; 8.6867; 25.3813
90; 90; 90		1915.24Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545341 CIFC24 H44 Lu N O8 Pt2 S8P 4/m c c8.5697; 8.5697; 25.5067
90; 90; 90		1873.21Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545342 CIFC24 H44 N Nd O8 Pt2 S8P 4/m c c8.6502; 8.6502; 25.3992
90; 90; 90		1900.52Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545343 CIFC24 H44 N O8 Pr Pt2 S8P 4/m c c8.6615; 8.6615; 25.413
90; 90; 90		1906.52Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545344 CIFC24 H44 N O8 Pt2 S8 SmP 4/m c c8.6302; 8.6302; 25.4187
90; 90; 90		1893.19Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545345 CIFC24 H44 Dy N O8 Pt2 S8P 4/m c c8.6098; 8.6098; 25.515
90; 90; 90		1891.4Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545346 CIFC24 H44 N O8 Pt2 S8 TmP 4/m c c8.5844; 8.5844; 25.5043
90; 90; 90		1879.46Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545347 CIFC24 H44 N O8 Pt2 S8 YP 4/m c c8.5854; 8.5854; 25.5257
90; 90; 90		1881.48Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545348 CIFC24 H44 N O8 Pt2 S8 YbP 4/m c c8.5693; 8.5693; 25.5201
90; 90; 90		1874.02Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545349 CIFC24 H44 Er N O8 Pt2 S8P 4/m c c8.5857; 8.5857; 25.5107
90; 90; 90		1880.5Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545350 CIFC24 H44 N O8 Pt2 S8 TbP 4/m c c8.6049; 8.6049; 25.4824
90; 90; 90		1886.83Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545351 CIFC24 H44 Gd N O8 Pt2 S8P 4/m c c8.68; 8.68; 25.8359
90; 90; 90		1946.54Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545352 CIFC24 H44 Gd N O8 Pt2 S8P 4/m c c8.6134; 8.6134; 25.4434
90; 90; 90		1887.66Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545353 CIFC24 H44 Eu N O8 Pt2 S8P 4/m c c8.6247; 8.6247; 25.4329
90; 90; 90		1891.84Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545354 CIFC24 H44 Gd N O8 Pd2 S8P 4/m c c8.6832; 8.6832; 25.8856
90; 90; 90		1951.72Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545355 CIFC24 H44 N O8 Pd2 S8 YP 4/m c c8.6638; 8.6638; 25.8747
90; 90; 90		1942.19Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545356 CIFC40 H44 Dy O8 P Pt2 S8P 4/n12.6485; 12.6485; 15.1509
90; 90; 90		2423.9Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545357 CIFC40 H44 O8 P Pt2 S8 YP 4/n12.6436; 12.6436; 15.1616
90; 90; 90		2423.74Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545358 CIFC40 H44 Gd O8 P Pt2 S8P 4/n12.8; 12.8; 15.345
90; 90; 90		2514.1Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545359 CIFC40 H44 Ho O8 P Pt2 S8P 4/n12.6459; 12.6459; 15.14
90; 90; 90		2421.17Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545360 CIFC40 H44 O8 P Pt2 S8 TbP 4/n12.6486; 12.6486; 15.1552
90; 90; 90		2424.6Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545361 CIFC40 H44 Gd O8 P Pt2 S8P 4/n12.6662; 12.6662; 15.1584
90; 90; 90		2431.9Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545362 CIFC40 H44 Er O8 P Pt2 S8P 4/n12.6367; 12.6367; 15.1479
90; 90; 90		2418.91Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545363 CIFC40 H44 Gd O8 P Pd2 S8P 4/n12.8122; 12.8122; 15.3823
90; 90; 90		2525Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545364 CIFC40 H44 O8 P Pd2 S8 YP 4/n12.8004; 12.8004; 15.373
90; 90; 90		2518.87Sørensen, Mikkel A.; Weihe, Høgni; Vinum, Morten G.; Mortensen, Jesper S.; Doerrer, Linda H.; Bendix, Jesper
Imposing high-symmetry and tuneable geometry on lanthanide centres with chelating Pt and Pd metalloligands
Chem. Sci., 2017, 8, 3566
1545365 CIFC55 H80 B Mg N3 O3P 1 21/c 19.17488; 19.0562; 30.0078
90; 93.281; 90		5237.91Yang, Yan; Anker, Mathew D.; Fang, Jian; Mahon, Mary F.; Maron, Laurent; Weetman, Catherine; Hill, Michael S.
Hydrodeoxygenation of isocyanates: snapshots of a magnesium-mediated CO bond cleavage
Chem. Sci., 2017, 8, 3529
1545366 CIFC42 H59 Mg N3 OP 1 21/n 111.59209; 26.2784; 12.80407
90; 91.4753; 90		3899.1Yang, Yan; Anker, Mathew D.; Fang, Jian; Mahon, Mary F.; Maron, Laurent; Weetman, Catherine; Hill, Michael S.
Hydrodeoxygenation of isocyanates: snapshots of a magnesium-mediated CO bond cleavage
Chem. Sci., 2017, 8, 3529
1545367 CIFC38.5 H57 B Mg N2 O3P 1 21/n 113.48093; 14.64625; 18.8268
90; 94.1686; 90		3707.42Yang, Yan; Anker, Mathew D.; Fang, Jian; Mahon, Mary F.; Maron, Laurent; Weetman, Catherine; Hill, Michael S.
Hydrodeoxygenation of isocyanates: snapshots of a magnesium-mediated CO bond cleavage
Chem. Sci., 2017, 8, 3529
1545368 CIFC22 H37 B2 N O5P 1 21/n 111.549; 33.161; 13.3198
90; 105.633; 90		4912.46Yang, Yan; Anker, Mathew D.; Fang, Jian; Mahon, Mary F.; Maron, Laurent; Weetman, Catherine; Hill, Michael S.
Hydrodeoxygenation of isocyanates: snapshots of a magnesium-mediated CO bond cleavage
Chem. Sci., 2017, 8, 3529
1545369 CIFC19 H30 B N O3P 319.7577; 9.7577; 17.8748
90; 90; 120		1473.9Yang, Yan; Anker, Mathew D.; Fang, Jian; Mahon, Mary F.; Maron, Laurent; Weetman, Catherine; Hill, Michael S.
Hydrodeoxygenation of isocyanates: snapshots of a magnesium-mediated CO bond cleavage
Chem. Sci., 2017, 8, 3529
1545370 CIFC25 H43 B2 N O5P 21 21 2110.0273; 12.4499; 21.5324
90; 90; 90		2688.1Yang, Yan; Anker, Mathew D.; Fang, Jian; Mahon, Mary F.; Maron, Laurent; Weetman, Catherine; Hill, Michael S.
Hydrodeoxygenation of isocyanates: snapshots of a magnesium-mediated CO bond cleavage
Chem. Sci., 2017, 8, 3529
1545478 CIFC23 H33 Cl2 N O3 SI 1 2/a 126.9274; 5.87596; 29.0682
90; 90.0555; 90		4599.29Saint-Dizier, François; Simpkins, Nigel S.
First total synthesis of concavine
Chem. Sci., 2017, 8, 3384
1545511 CIFC47 H62 N6 TiP -110.2323; 13.2844; 16.9919
100.164; 104.521; 95.151		2179Heins, Spencer P.; Wolczanski, Peter T.; Cundari, Thomas R.; MacMillan, Samantha N.
Redox non-innocence permits catalytic nitrene carbonylation by (dadi)TiNAd (Ad = adamantyl)
Chem. Sci., 2017, 8, 3410
1545512 CIFC46 H55 N4 P TiP 1 21/c 118.3497; 10.3436; 25.5974
90; 108.022; 90		4620.1Heins, Spencer P.; Wolczanski, Peter T.; Cundari, Thomas R.; MacMillan, Samantha N.
Redox non-innocence permits catalytic nitrene carbonylation by (dadi)TiNAd (Ad = adamantyl)
Chem. Sci., 2017, 8, 3410
1545513 CIFC49 H62 N4 O TiP -113.1179; 13.2082; 13.7748
105.738; 99.727; 98.022		2220.5Heins, Spencer P.; Wolczanski, Peter T.; Cundari, Thomas R.; MacMillan, Samantha N.
Redox non-innocence permits catalytic nitrene carbonylation by (dadi)TiNAd (Ad = adamantyl)
Chem. Sci., 2017, 8, 3410
1545515 CIFC16 H16 I2P 1 c 18.4867; 11.5788; 16.5698
90; 92.762; 90		1626.35Janhsen, B.; Daniliuc, C. G.; Studer, A.
Intra- versus intermolecular electron transfer in radical nucleophilic aromatic substitution of dihalo(hetero)arenes ‒ a tool for estimating π-conjugation in aromatic systems
Chem. Sci., 2017, 8, 3547
1545516 CIFC16 H14 I2P 1 21/c 111.4988; 15.9491; 8.2449
90; 97.906; 90		1497.71Janhsen, B.; Daniliuc, C. G.; Studer, A.
Intra- versus intermolecular electron transfer in radical nucleophilic aromatic substitution of dihalo(hetero)arenes ‒ a tool for estimating π-conjugation in aromatic systems
Chem. Sci., 2017, 8, 3547
1545517 CIFC66 H62 N7 O7 SP -110.2417; 17.4702; 18.1698
117.24; 90.58; 92.649		2885.6Martinez-Cuezva, Alberto; Saura-Sanmartin, Adrian; Nicolas-Garcia, Tomas; Navarro, Cristian; Orenes, Raul-Angel; Alajarin, Mateo; Berna, Jose
Photoswitchable interlocked thiodiglycolamide as a cocatalyst of a chalcogeno-Baylis‒Hillman reaction
Chem. Sci., 2017, 8, 3775
1545518 CIFC52 H54 N2 O5P 21 21 2110.807; 27; 28.2406
90; 90; 90		8240.3Noda, Hidetoshi; Amemiya, Fuyuki; Weidner, Karin; Kumagai, Naoya; Shibasaki, Masakatsu
Catalytic asymmetric synthesis of CF3-substituted tertiary propargylic alcohols via direct aldol reaction of α-N3 amide
Chem. Sci., 2017, 8, 3260
1545519 CIFC20 H18 Cu F6 N10 O8 S2P -17.3568; 10.0126; 10.8607
110.106; 95.309; 106.922		702.02Noda, Hidetoshi; Amemiya, Fuyuki; Weidner, Karin; Kumagai, Naoya; Shibasaki, Masakatsu
Catalytic asymmetric synthesis of CF3-substituted tertiary propargylic alcohols via direct aldol reaction of α-N3 amide
Chem. Sci., 2017, 8, 3260
1545520 CIFC19 H13 Cl F3 N5 O2P 21 21 2110.7343; 12.0336; 28.9712
90; 90; 90		3742.28Noda, Hidetoshi; Amemiya, Fuyuki; Weidner, Karin; Kumagai, Naoya; Shibasaki, Masakatsu
Catalytic asymmetric synthesis of CF3-substituted tertiary propargylic alcohols via direct aldol reaction of α-N3 amide
Chem. Sci., 2017, 8, 3260
1545527 CIFC40 H58 N2 Na O7 P3P 21 21 2113.7779; 14.7189; 21.2291
90; 90; 90		4305.2Hansmann, Max M.; Ruiz, David A.; Liu, Liu (Leo); Jazzar, Rodolphe; Bertrand, Guy
(Phosphanyl)phosphaketenes as building blocks for novel phosphorus heterocycles
Chem. Sci., 2017, 8, 3720
1545528 CIFC45 H38 B F15 N2 O P2P 1 21/n 114.0829; 20.6872; 15.9795
90; 99.559; 90		4590.8Hansmann, Max M.; Ruiz, David A.; Liu, Liu (Leo); Jazzar, Rodolphe; Bertrand, Guy
(Phosphanyl)phosphaketenes as building blocks for novel phosphorus heterocycles
Chem. Sci., 2017, 8, 3720
1545529 CIFC27 H41 B N2 O P2P n m a12.9335; 20.866; 10.2861
90; 90; 90		2775.9Hansmann, Max M.; Ruiz, David A.; Liu, Liu (Leo); Jazzar, Rodolphe; Bertrand, Guy
(Phosphanyl)phosphaketenes as building blocks for novel phosphorus heterocycles
Chem. Sci., 2017, 8, 3720
1545530 CIFC218 H276 N4 Na2 O6 P6P -114.6157; 18.3339; 23.554
85.401; 81.374; 78.671		6110.2Hansmann, Max M.; Ruiz, David A.; Liu, Liu (Leo); Jazzar, Rodolphe; Bertrand, Guy
(Phosphanyl)phosphaketenes as building blocks for novel phosphorus heterocycles
Chem. Sci., 2017, 8, 3720
1545531 CIFC38 H53 N3 O P2P n m a21.5089; 17.8123; 9.2449
90; 90; 90		3541.9Hansmann, Max M.; Ruiz, David A.; Liu, Liu (Leo); Jazzar, Rodolphe; Bertrand, Guy
(Phosphanyl)phosphaketenes as building blocks for novel phosphorus heterocycles
Chem. Sci., 2017, 8, 3720
1545532 CIFC70 H99 N5 Na2 O11 P6P 1 21/c 127.6426; 11.7291; 24.5253
90; 103.246; 90		7740.1Hansmann, Max M.; Ruiz, David A.; Liu, Liu (Leo); Jazzar, Rodolphe; Bertrand, Guy
(Phosphanyl)phosphaketenes as building blocks for novel phosphorus heterocycles
Chem. Sci., 2017, 8, 3720
1545533 CIFC56.5 H55.25 N8 O17.25P -17.472; 20.571; 24.604
69.4; 84.5; 85.66		3520.1Hu, Xiaobo; Dawson, Simon J.; Mandal, Pradeep K.; de Hatten, Xavier; Baptiste, Benoit; Huc, Ivan
Optimizing side chains for crystal growth from water: a case study of aromatic amide foldamers
Chem. Sci., 2017, 8, 3741
1545534 CIFC172 H112 Ca2 N32 O111 S8C 1 2/c 134.1155; 45.9981; 33.3135
90; 109.407; 90		49307Hu, Xiaobo; Dawson, Simon J.; Mandal, Pradeep K.; de Hatten, Xavier; Baptiste, Benoit; Huc, Ivan
Optimizing side chains for crystal growth from water: a case study of aromatic amide foldamers
Chem. Sci., 2017, 8, 3741
1545535 CIFC103 H97 N16 O38.5P 1 21/n 128.255; 51.842; 30.331
90; 110.957; 90		41490Hu, Xiaobo; Dawson, Simon J.; Mandal, Pradeep K.; de Hatten, Xavier; Baptiste, Benoit; Huc, Ivan
Optimizing side chains for crystal growth from water: a case study of aromatic amide foldamers
Chem. Sci., 2017, 8, 3741
1545536 CIFC205.5 H135.5 Ca6.25 N32 O82.5P b c a34.859; 29.286; 51.432
90; 90; 90		52506Hu, Xiaobo; Dawson, Simon J.; Mandal, Pradeep K.; de Hatten, Xavier; Baptiste, Benoit; Huc, Ivan
Optimizing side chains for crystal growth from water: a case study of aromatic amide foldamers
Chem. Sci., 2017, 8, 3741
1545543 CIFC29 H50 Cl2 N2 O12 Pd3C 1 2/c 125.3774; 8.3627; 19.7264
90; 116.32; 90		3752.41He, Chuan; Gaunt, Matthew J.
Ligand-assisted palladium-catalyzed C‒H alkenylation of aliphatic amines for the synthesis of functionalized pyrrolidines
Chem. Sci., 2017, 8, 3586
1545549 CIFC61 H48 N8 S9 U2P 21 21 2128.579; 28.912; 33.323
90; 90; 90		27534Arnold, Polly L.; Stevens, Charlotte J.; Bell, Nicola L.; Lord, Rianne M.; Goldberg, Jonathan M.; Nichol, Gary S.; Love, Jason B.
Multi-electron reduction of sulfur and carbon disulfide using binuclear uranium(iii) borohydride complexes
Chem. Sci., 2017, 8, 3609
1545550 CIFC100 H112 N8 O2 S2 U2C 1 2/c 117.3745; 34.224; 17.013
90; 112.037; 90		9377.3Arnold, Polly L.; Stevens, Charlotte J.; Bell, Nicola L.; Lord, Rianne M.; Goldberg, Jonathan M.; Nichol, Gary S.; Love, Jason B.
Multi-electron reduction of sulfur and carbon disulfide using binuclear uranium(iii) borohydride complexes
Chem. Sci., 2017, 8, 3609
1545551 CIFC101 H105 N8 O2 S U2P -115.9605; 16.6905; 18.0699
67.132; 86.551; 82.45		4396.61Arnold, Polly L.; Stevens, Charlotte J.; Bell, Nicola L.; Lord, Rianne M.; Goldberg, Jonathan M.; Nichol, Gary S.; Love, Jason B.
Multi-electron reduction of sulfur and carbon disulfide using binuclear uranium(iii) borohydride complexes
Chem. Sci., 2017, 8, 3609
1545552 CIFC106 H130 B K N8 O5 U2P n m a29.6933; 29.9161; 10.8656
90; 90; 90		9652Arnold, Polly L.; Stevens, Charlotte J.; Bell, Nicola L.; Lord, Rianne M.; Goldberg, Jonathan M.; Nichol, Gary S.; Love, Jason B.
Multi-electron reduction of sulfur and carbon disulfide using binuclear uranium(iii) borohydride complexes
Chem. Sci., 2017, 8, 3609
1545553 CIFC110 H138 B N8 Na O6 U2C 1 2/c 115.5798; 33.7862; 20.7334
90; 105.543; 90		10514.6Arnold, Polly L.; Stevens, Charlotte J.; Bell, Nicola L.; Lord, Rianne M.; Goldberg, Jonathan M.; Nichol, Gary S.; Love, Jason B.
Multi-electron reduction of sulfur and carbon disulfide using binuclear uranium(iii) borohydride complexes
Chem. Sci., 2017, 8, 3609
1545595 CIFC39 H51 O3 PP -110.8957; 13.0496; 13.9607
101.403; 109.481; 104.921		1718.4Bura, Thomas; Beaupré, Serge; Légaré, Marc-André; Quinn, Jesse; Rochette, Etienne; Blaskovits, J. Terence; Fontaine, Frédéric-Georges; Pron, Agnieszka; Li, Yuning; Leclerc, Mario
Direct heteroarylation polymerization: guidelines for defect-free conjugated polymers
Chem. Sci., 2017, 8, 3913
1545596 CIFC39 H51 O3 PP 1 21/c 110.2109; 18.659; 35.308
90; 94.153; 90		6709.4Bura, Thomas; Beaupré, Serge; Légaré, Marc-André; Quinn, Jesse; Rochette, Etienne; Blaskovits, J. Terence; Fontaine, Frédéric-Georges; Pron, Agnieszka; Li, Yuning; Leclerc, Mario
Direct heteroarylation polymerization: guidelines for defect-free conjugated polymers
Chem. Sci., 2017, 8, 3913
1545631 CIFC36 H28 F3 Fe I2 N4 O6 SP -112.2308; 12.6838; 13.0436
83.137; 68.061; 70.096		1764.77Phonsri, Wasinee; Harding, Phimphaka; Liu, Lujia; Telfer, Shane G.; Murray, Keith S.; Moubaraki, Boujemaa; Ross, Tamsyn M.; Jameson, Guy N. L.; Harding, David J.
Solvent modified spin crossover in an iron(iii) complex: phase changes and an exceptionally wide hysteresis
Chem. Sci., 2017, 8, 3949
1545632 CIFC36 H28 F3 Fe I2 N4 O6 SP -112.4864; 12.4925; 13.6444
65.751; 82.594; 69.191		1813.6Phonsri, Wasinee; Harding, Phimphaka; Liu, Lujia; Telfer, Shane G.; Murray, Keith S.; Moubaraki, Boujemaa; Ross, Tamsyn M.; Jameson, Guy N. L.; Harding, David J.
Solvent modified spin crossover in an iron(iii) complex: phase changes and an exceptionally wide hysteresis
Chem. Sci., 2017, 8, 3949
1545633 CIFC35 H26 F3 Fe I2 N4 O6 SP -112.43; 12.336; 13.183
111.83; 99.23; 66.05		1714.8Phonsri, Wasinee; Harding, Phimphaka; Liu, Lujia; Telfer, Shane G.; Murray, Keith S.; Moubaraki, Boujemaa; Ross, Tamsyn M.; Jameson, Guy N. L.; Harding, David J.
Solvent modified spin crossover in an iron(iii) complex: phase changes and an exceptionally wide hysteresis
Chem. Sci., 2017, 8, 3949
1545634 CIFC36 H28 F3 Fe I2 N4 O6 SP -112.4632; 12.6561; 13.365
83.298; 67.3; 69.644		1823Phonsri, Wasinee; Harding, Phimphaka; Liu, Lujia; Telfer, Shane G.; Murray, Keith S.; Moubaraki, Boujemaa; Ross, Tamsyn M.; Jameson, Guy N. L.; Harding, David J.
Solvent modified spin crossover in an iron(iii) complex: phase changes and an exceptionally wide hysteresis
Chem. Sci., 2017, 8, 3949
1545635 CIFC35 H23 F3 Fe I2 N5 O5 SP -112.0127; 12.6193; 13.2123
110.546; 92.31; 111.271		1715.2Phonsri, Wasinee; Harding, Phimphaka; Liu, Lujia; Telfer, Shane G.; Murray, Keith S.; Moubaraki, Boujemaa; Ross, Tamsyn M.; Jameson, Guy N. L.; Harding, David J.
Solvent modified spin crossover in an iron(iii) complex: phase changes and an exceptionally wide hysteresis
Chem. Sci., 2017, 8, 3949
1545636 CIFC35 H26 F3 Fe I2 N4 O6 SP -111.476; 13.0698; 13.4649
71.342; 87.437; 68.674		1776.5Phonsri, Wasinee; Harding, Phimphaka; Liu, Lujia; Telfer, Shane G.; Murray, Keith S.; Moubaraki, Boujemaa; Ross, Tamsyn M.; Jameson, Guy N. L.; Harding, David J.
Solvent modified spin crossover in an iron(iii) complex: phase changes and an exceptionally wide hysteresis
Chem. Sci., 2017, 8, 3949
1545637 CIFC35 H26 F3 Fe I2 N4 O6 SP -111.5003; 13.1342; 13.5498
71.652; 87.488; 68.858		1806.23Phonsri, Wasinee; Harding, Phimphaka; Liu, Lujia; Telfer, Shane G.; Murray, Keith S.; Moubaraki, Boujemaa; Ross, Tamsyn M.; Jameson, Guy N. L.; Harding, David J.
Solvent modified spin crossover in an iron(iii) complex: phase changes and an exceptionally wide hysteresis
Chem. Sci., 2017, 8, 3949
1545638 CIFC35 H26 F3 Fe I2 N4 O6 SP -111.5289; 13.1814; 13.6233
71.947; 87.644; 68.871		1830.2Phonsri, Wasinee; Harding, Phimphaka; Liu, Lujia; Telfer, Shane G.; Murray, Keith S.; Moubaraki, Boujemaa; Ross, Tamsyn M.; Jameson, Guy N. L.; Harding, David J.
Solvent modified spin crossover in an iron(iii) complex: phase changes and an exceptionally wide hysteresis
Chem. Sci., 2017, 8, 3949
1545639 CIFC36 H28 F3 Fe I2 N4 O6 SP -112.232; 12.547; 13.279
81.89; 67.04; 68.25		1742.9Phonsri, Wasinee; Harding, Phimphaka; Liu, Lujia; Telfer, Shane G.; Murray, Keith S.; Moubaraki, Boujemaa; Ross, Tamsyn M.; Jameson, Guy N. L.; Harding, David J.
Solvent modified spin crossover in an iron(iii) complex: phase changes and an exceptionally wide hysteresis
Chem. Sci., 2017, 8, 3949
1545640 CIFC36 H26 F3 Fe I2 N4 O6 SP -110.3759; 12.8053; 13.8091
79.08; 76.267; 86.609		1749.85Phonsri, Wasinee; Harding, Phimphaka; Liu, Lujia; Telfer, Shane G.; Murray, Keith S.; Moubaraki, Boujemaa; Ross, Tamsyn M.; Jameson, Guy N. L.; Harding, David J.
Solvent modified spin crossover in an iron(iii) complex: phase changes and an exceptionally wide hysteresis
Chem. Sci., 2017, 8, 3949
1545641 CIFC36 H26 F3 Fe I2 N4 O6 SP -110.3585; 12.9759; 14.1074
78.558; 76.606; 86.265		1807.59Phonsri, Wasinee; Harding, Phimphaka; Liu, Lujia; Telfer, Shane G.; Murray, Keith S.; Moubaraki, Boujemaa; Ross, Tamsyn M.; Jameson, Guy N. L.; Harding, David J.
Solvent modified spin crossover in an iron(iii) complex: phase changes and an exceptionally wide hysteresis
Chem. Sci., 2017, 8, 3949
1545678 CIFC32 H38 Cs K2 O6P -19.8938; 13.3712; 15.521
64.492; 78.484; 71.755		1755Spisak, Sarah N.; Rogachev, Andrey Yu.; Zabula, Alexander V.; Filatov, Alexander S.; Clérac, Rodolphe; Petrukhina, Marina A.
Tuning the separation and coupling of corannulene trianion-radicals through sizable alkali metal belts
Chem. Sci., 2017, 8, 3137
1545989 CIFC61 H76 N2 O12P 1 21/n 112.9848; 19.382; 22.2953
90; 99.8421; 90		5528.5Zhu, Kelong; Baggi, Giorgio; Vukotic, V. Nicholas; Loeb, Stephen J.
Reversible mechanical protection: building a 3D “suit” around a T-shaped benzimidazole axle
Chem. Sci., 2017, 8, 3898
1545990 CIFC61 H71 N3 O10P b c a17.819; 17.457; 34.337
90; 90; 90		10681Zhu, Kelong; Baggi, Giorgio; Vukotic, V. Nicholas; Loeb, Stephen J.
Reversible mechanical protection: building a 3D “suit” around a T-shaped benzimidazole axle
Chem. Sci., 2017, 8, 3898
1546842 CIFC24 H20 N2 O6P n a 2128.9068; 7.9025; 8.9889
90; 90; 90		2053.39Preindl, Johannes; Chakrabarty, Shyamal; Waser, Jérôme
Dearomatization of electron poor six-membered N-heterocycles through [3 + 2] annulation with aminocyclopropanes
Chemical Science, 2017, 8, 7112-7118
1547319 CIFC30 H49 N5 O6P 1 21 18.3072; 7.8052; 25.7246
90; 97.491; 90		1653.7Colan E. Hughes; G. N. Manjunatha Reddy; Stefano Masiero; Steven P. Brown; P. Andrew Williams; Kenneth D. M. Harris
Determination of a complex crystal structure in the absence of single crystals: analysis of powder X-ray diffraction data, guided by solid-state NMR and periodic DFT calculations, reveals a new 2'-deoxyguanosine structural motif
Chemical Science, 2017, 8, 3971-3979
1553643 CIFC27 H33 B2 F11 Fe N6F -4 3 c29.3374; 29.3374; 29.3374
90; 90; 90		25250.2Thorarinsdottir, Agnes E.; Gaudette, Alexandra I.; Harris, T. David
Spin-crossover and high-spin iron(ii) complexes as chemical shift <sup>19</sup>F magnetic resonance thermometers.
Chemical science, 2017, 8, 2448-2456
1553644 CIFC26 H31.5 B2 F10 Fe N6.5P -111.4603; 14.9231; 18.6992
110.254; 106.434; 91.133		2853Thorarinsdottir, Agnes E.; Gaudette, Alexandra I.; Harris, T. David
Spin-crossover and high-spin iron(ii) complexes as chemical shift <sup>19</sup>F magnetic resonance thermometers.
Chemical science, 2017, 8, 2448-2456
1553645 CIFC25 H30 B2 F10 N6 ZnP 1 c 113.6092; 14.5112; 14.1222
90; 90.875; 90		2788.61Thorarinsdottir, Agnes E.; Gaudette, Alexandra I.; Harris, T. David
Spin-crossover and high-spin iron(ii) complexes as chemical shift <sup>19</sup>F magnetic resonance thermometers.
Chemical science, 2017, 8, 2448-2456
1553646 CIFC24 H27 B2 F11 Fe N6P 316.8376; 16.8376; 7.8829
90; 90; 120		1935.43Thorarinsdottir, Agnes E.; Gaudette, Alexandra I.; Harris, T. David
Spin-crossover and high-spin iron(ii) complexes as chemical shift <sup>19</sup>F magnetic resonance thermometers.
Chemical science, 2017, 8, 2448-2456
1553647 CIFC27 H33 B2 F11 N6 ZnF -4 3 c29.282; 29.282; 29.282
90; 90; 90		25107.4Thorarinsdottir, Agnes E.; Gaudette, Alexandra I.; Harris, T. David
Spin-crossover and high-spin iron(ii) complexes as chemical shift <sup>19</sup>F magnetic resonance thermometers.
Chemical science, 2017, 8, 2448-2456
1553648 CIFC8 H8 F6 N4 Ni Si Xe0.34P 4/m m m7.0187; 7.0187; 7.5098
90; 90; 90		369.95Elsaidi, Sameh K.; Mohamed, Mona H.; Simon, Cory M.; Braun, Efrem; Pham, Tony; Forrest, Katherine A.; Xu, Wenqian; Banerjee, Debasis; Space, Brian; Zaworotko, Michael J.; Thallapally, Praveen K.
Effect of ring rotation upon gas adsorption in SIFSIX-3-M (M = Fe, Ni) pillared square grid networks.
Chemical science, 2017, 8, 2373-2380
1553649 CIFC8 H8 F6 N4 Ni SiP 4/m m m7.00122; 7.00122; 7.49794
90; 90; 90		367.527Elsaidi, Sameh K.; Mohamed, Mona H.; Simon, Cory M.; Braun, Efrem; Pham, Tony; Forrest, Katherine A.; Xu, Wenqian; Banerjee, Debasis; Space, Brian; Zaworotko, Michael J.; Thallapally, Praveen K.
Effect of ring rotation upon gas adsorption in SIFSIX-3-M (M = Fe, Ni) pillared square grid networks.
Chemical science, 2017, 8, 2373-2380
1553650 CIFC8 H8 F6 N4 Ni SiP 4/m m m6.99732; 6.99732; 7.49177
90; 90; 90		366.816Elsaidi, Sameh K.; Mohamed, Mona H.; Simon, Cory M.; Braun, Efrem; Pham, Tony; Forrest, Katherine A.; Xu, Wenqian; Banerjee, Debasis; Space, Brian; Zaworotko, Michael J.; Thallapally, Praveen K.
Effect of ring rotation upon gas adsorption in SIFSIX-3-M (M = Fe, Ni) pillared square grid networks.
Chemical science, 2017, 8, 2373-2380
1553651 CIFC8 H8 F6 Fe N4 O SiP 4/m m m7.1831; 7.1831; 7.5839
90; 90; 90		391.31Elsaidi, Sameh K.; Mohamed, Mona H.; Simon, Cory M.; Braun, Efrem; Pham, Tony; Forrest, Katherine A.; Xu, Wenqian; Banerjee, Debasis; Space, Brian; Zaworotko, Michael J.; Thallapally, Praveen K.
Effect of ring rotation upon gas adsorption in SIFSIX-3-M (M = Fe, Ni) pillared square grid networks.
Chemical science, 2017, 8, 2373-2380

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