Crystallography Open Database

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1549538 CIFC23 H33 B Br N O6P 21 21 2110.0308; 12.6903; 19.943
90; 90; 90		2538.6Chen, Lili; Shen, Jun-Jian; Gao, Qian; Xu, Senmiao
Synthesis of cyclic chiral α-amino boronates by copper-catalyzed asymmetric dearomative borylation of indoles.
Chemical science, 2018, 9, 5855-5859
1549543 CIFC60 H48 N4 O4P -112.0014; 13.0411; 17.0476
88.379; 81.381; 74.642		2543.6Zhang, Hao; Wu, Yongzhen; Zhang, Weiwei; Li, Erpeng; Shen, Chao; Jiang, Huiyun; Tian, He; Zhu, Wei-Hong
Low cost and stable quinoxaline-based hole-transporting materials with a D-A-D molecular configuration for efficient perovskite solar cells.
Chemical science, 2018, 9, 5919-5928
1549544 CIFC59 H50 Cl2 N4 O4 S2P n a 2125.387; 27.537; 21.8595
90; 90; 90		15282Zhang, Hao; Wu, Yongzhen; Zhang, Weiwei; Li, Erpeng; Shen, Chao; Jiang, Huiyun; Tian, He; Zhu, Wei-Hong
Low cost and stable quinoxaline-based hole-transporting materials with a D-A-D molecular configuration for efficient perovskite solar cells.
Chemical science, 2018, 9, 5919-5928
1549545 CIFC13 H13 N O5 SP 21 21 214.9869; 11.7644; 22.1329
90; 90; 90		1298.49Aujard-Catot, Julien; Nguyen, Michel; Bijani, Christian; Pratviel, Geneviève; Bonduelle, Colin
Cd2+ coordination: an efficient structuring switch for polypeptide polymers
Polymer Chemistry, 2018, 9, 4100
1549553 CIFC4 H13 Cu O8 PP b c a10.0717; 9.612; 21.809
90; 90; 90		2111.3Köferstein, Roberto; Arnold, Michael; Robl, Christian
Crystal Structure and Characterization of Two Layered Copper(II) Coordination Polymers with Anions of 3-Phosphonopropionic Acid and (RS )-2-Phosphonobutyric Acid'
Zeitschrift für anorganische und allgemeine Chemie, 2018, 644, 205
1549554 CIFC3 H9 Cu O7 PP b c a8.1247; 9.19; 21.023
90; 90; 90		1569.7Köferstein, Roberto; Arnold, Michael; Robl, Christian
Crystal Structure and Characterization of Two Layered Copper(II) Coordination Polymers with Anions of 3-Phosphonopropionic Acid and (RS )-2-Phosphonobutyric Acid'
Zeitschrift für anorganische und allgemeine Chemie, 2018, 644, 205
1549555 CIFC19 H22 F3 N O3 SP 21 21 219.1363; 13.549; 15.3864
90; 90; 90		1904.65Pan, Chongqing; Guo, Wenjing; Gu, Zhenhua
Unusual biaryl torsional strain promotes reactivity in Cu-catalyzed Sommelet-Hauser rearrangement.
Chemical science, 2018, 9, 5850-5854
1549556 CIFC23 H25 N O2P -18.5712; 9.5542; 12.0362
91.908; 103.104; 97.556		949.62Pan, Chongqing; Guo, Wenjing; Gu, Zhenhua
Unusual biaryl torsional strain promotes reactivity in Cu-catalyzed Sommelet-Hauser rearrangement.
Chemical science, 2018, 9, 5850-5854
1549557 CIFC17 H18 F3 N O3 SP 21 21 218.0524; 10.279; 21.1646
90; 90; 90		1751.8Pan, Chongqing; Guo, Wenjing; Gu, Zhenhua
Unusual biaryl torsional strain promotes reactivity in Cu-catalyzed Sommelet-Hauser rearrangement.
Chemical science, 2018, 9, 5850-5854
1549558 CIFC17 H20 I2 In N O6P -18.5335; 8.9158; 15.6189
94.244; 92.845; 113.418		1083.39Kita, Yuji; Yata, Tetsuji; Nishimoto, Yoshihiro; Chiba, Kouji; Yasuda, Makoto
Selective oxymetalation of terminal alkynes <i>via</i> 6-<i>endo</i> cyclization: mechanistic investigation and application to the efficient synthesis of 4-substituted isocoumarins.
Chemical science, 2018, 9, 6041-6052
1549559 CIFC10 H8 I3 In O2P -17.2953; 10.6797; 10.9105
71.041; 73.634; 78.807		766.42Kita, Yuji; Yata, Tetsuji; Nishimoto, Yoshihiro; Chiba, Kouji; Yasuda, Makoto
Selective oxymetalation of terminal alkynes <i>via</i> 6-<i>endo</i> cyclization: mechanistic investigation and application to the efficient synthesis of 4-substituted isocoumarins.
Chemical science, 2018, 9, 6041-6052
1549560 CIFC16 H9 Cl O3P 21 21 213.8763; 12.0424; 26.146
90; 90; 90		1220.5Kita, Yuji; Yata, Tetsuji; Nishimoto, Yoshihiro; Chiba, Kouji; Yasuda, Makoto
Selective oxymetalation of terminal alkynes <i>via</i> 6-<i>endo</i> cyclization: mechanistic investigation and application to the efficient synthesis of 4-substituted isocoumarins.
Chemical science, 2018, 9, 6041-6052
1549561 CIFC9 H4 I N O4P -18.749; 9.0176; 12.167
92.712; 100.266; 92.8365		941.85Kita, Yuji; Yata, Tetsuji; Nishimoto, Yoshihiro; Chiba, Kouji; Yasuda, Makoto
Selective oxymetalation of terminal alkynes <i>via</i> 6-<i>endo</i> cyclization: mechanistic investigation and application to the efficient synthesis of 4-substituted isocoumarins.
Chemical science, 2018, 9, 6041-6052
1549562 CIF
HKL
Paper		C5 H17 I N Na O5P -15.8131; 7.6682; 26.7168
90.221; 91.168; 91.44		1190.29Nazarenko, Alexander Y.
Betaine (trimethylammonioacetate) binary compound with sodium iodide
IUCrData, 2018, 3, x180864
1549563 CIF
HKL
Paper		C19 H16 N4 O3P 1 21/c 137.0489; 13.3154; 6.917
90; 93.771; 90		3404.9El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Mostafa, Mohamed S.; Khidre, Rizk E.; Hegazy, Amany S.; Kariuki, Benson M.
(<i>E</i>)-1-[5-Methyl-1-(4-methylphenyl)-1<i>H</i>-1,2,3-triazol-4-yl]-3-(4-nitrophenyl)prop-2-en-1-one
IUCrData, 2018, 3, x180841
1549564 CIFC23 H30 N2P b c n15.5646; 7.8895; 15.9608
90; 90; 90		1959.9Walther, Patrick; Frey, Wolfgang; Naumann, Stefan
Polarized olefins as enabling (co)catalysts for the polymerization of γ-butyrolactone
Polymer Chemistry, 2018, 9, 3674
1549565 CIFC49 H46 Cl4 Os P2 SiP 1 21/c 111.60758; 16.9798; 22.4892
90; 94.829; 90		4416.76Ruan, Wenqing; Leung, Tsz-Fai; Shi, Chuan; Lee, Ka Ho; Sung, Herman H. Y.; Williams, Ian D.; Lin, Zhenyang; Jia, Guochen
Facile synthesis of polycyclic metallaarynes.
Chemical science, 2018, 9, 5994-5998
1549566 CIFC53 H48 Cl4 Os P2 SiI 1 2 113.9889; 16.453; 21.3301
90; 97.273; 90		4869.82Ruan, Wenqing; Leung, Tsz-Fai; Shi, Chuan; Lee, Ka Ho; Sung, Herman H. Y.; Williams, Ian D.; Lin, Zhenyang; Jia, Guochen
Facile synthesis of polycyclic metallaarynes.
Chemical science, 2018, 9, 5994-5998
1549567 CIFC55 H52 Cl8 Os P2 SiP 1 21/m 111.4227; 17.2735; 13.9125
90; 102.838; 90		2676.46Ruan, Wenqing; Leung, Tsz-Fai; Shi, Chuan; Lee, Ka Ho; Sung, Herman H. Y.; Williams, Ian D.; Lin, Zhenyang; Jia, Guochen
Facile synthesis of polycyclic metallaarynes.
Chemical science, 2018, 9, 5994-5998
1549568 CIFC36 H36 As Cl F6 N9 O6 S2P 1 21/c 114.2067; 15.9799; 18.6556
90; 94.05; 90		4224.6Swidan, Ala'aeddeen; Suter, Riccardo; Macdonald, Charles L. B.; Burford, Neil
Tris(benzoimidazol)amine (L) complexes of pnictogen(iii) and pnictogen(v) cations and assessment of the [LP]<sup>3+</sup>/[LPF<sub>2</sub>]<sup>3+</sup> redox couple.
Chemical science, 2018, 9, 5837-5841
1549569 CIFC37 H39 As F9 N9 O9 S3P 1 21/c 114.0065; 15.9167; 21.8331
90; 107.966; 90		4630.08Swidan, Ala'aeddeen; Suter, Riccardo; Macdonald, Charles L. B.; Burford, Neil
Tris(benzoimidazol)amine (L) complexes of pnictogen(iii) and pnictogen(v) cations and assessment of the [LP]<sup>3+</sup>/[LPF<sub>2</sub>]<sup>3+</sup> redox couple.
Chemical science, 2018, 9, 5837-5841
1549570 CIFC25 H19.5 N7.5 PP 1 21/n 113.0553; 25.1646; 14.6359
90; 114.619; 90		4371.2Swidan, Ala'aeddeen; Suter, Riccardo; Macdonald, Charles L. B.; Burford, Neil
Tris(benzoimidazol)amine (L) complexes of pnictogen(iii) and pnictogen(v) cations and assessment of the [LP]<sup>3+</sup>/[LPF<sub>2</sub>]<sup>3+</sup> redox couple.
Chemical science, 2018, 9, 5837-5841
1549571 CIFC37 H39 F11 N9 O9 P S3P -113.753; 14.06; 14.321
109.504; 98.444; 111.998		2300Swidan, Ala'aeddeen; Suter, Riccardo; Macdonald, Charles L. B.; Burford, Neil
Tris(benzoimidazol)amine (L) complexes of pnictogen(iii) and pnictogen(v) cations and assessment of the [LP]<sup>3+</sup>/[LPF<sub>2</sub>]<sup>3+</sup> redox couple.
Chemical science, 2018, 9, 5837-5841
1549572 CIFC36 H39 F7 N9 O6 S2 SbP -113.1877; 13.3482; 13.4824
79.6653; 63.0215; 84.7868		2080.63Swidan, Ala'aeddeen; Suter, Riccardo; Macdonald, Charles L. B.; Burford, Neil
Tris(benzoimidazol)amine (L) complexes of pnictogen(iii) and pnictogen(v) cations and assessment of the [LP]<sup>3+</sup>/[LPF<sub>2</sub>]<sup>3+</sup> redox couple.
Chemical science, 2018, 9, 5837-5841
1549573 CIFC39 H42 F9 N10 O9 P S3P -110.8599; 10.9646; 20.3805
81.217; 83.234; 89.295		2381.6Swidan, Ala'aeddeen; Suter, Riccardo; Macdonald, Charles L. B.; Burford, Neil
Tris(benzoimidazol)amine (L) complexes of pnictogen(iii) and pnictogen(v) cations and assessment of the [LP]<sup>3+</sup>/[LPF<sub>2</sub>]<sup>3+</sup> redox couple.
Chemical science, 2018, 9, 5837-5841
1549574 CIFC38 H40.5 F9 N9.5 O9 S3 SbP -112.726; 18.899; 20.823
102.659; 97.475; 99.315		4750Swidan, Ala'aeddeen; Suter, Riccardo; Macdonald, Charles L. B.; Burford, Neil
Tris(benzoimidazol)amine (L) complexes of pnictogen(iii) and pnictogen(v) cations and assessment of the [LP]<sup>3+</sup>/[LPF<sub>2</sub>]<sup>3+</sup> redox couple.
Chemical science, 2018, 9, 5837-5841
1549575 CIFC27 H28 N4 O2C 1 2/c 122.679; 10.176; 21.562
90; 94.879; 90		4958Zhang, Liang; Liu, Shuya; Zhao, Zhiguo; Su, Hongmei; Hao, Jingcheng; Wang, Yao
(Salen)Mn(iii)-catalyzed chemoselective acylazidation of olefins.
Chemical science, 2018, 9, 6085-6090
1549576 CIF
Paper		C14 H12 O3P 21 21 217.4539; 7.8553; 17.2286
90; 90; 90		1008.78Kotha, Sambasivarao; Cheekatla, Subba Rao; Gunta, Rama
Hexacyclo[6.5.1.0^1,5^.0^5,12^.0^7,11^.0^9,13^]tetradecane-4,6,14-trione
IUCrData, 2018, 3, x180852
1549577 CIFC23 H20 I4 N2 OP -17.3405; 11.1063; 16.76
83.668; 77.493; 78.301		1303.08Riel, Asia Marie S.; Decato, Daniel A.; Sun, Jiyu; Massena, Casey J.; Jessop, Morly J.; Berryman, Orion B.
The intramolecular hydrogen bonded-halogen bond: a new strategy for preorganization and enhanced binding.
Chemical science, 2018, 9, 5828-5836
1549578 CIFC23 H20 Br2 I2 N2 OP -17.28; 10.9585; 16.0936
89.758; 79.735; 78.541		1237.53Riel, Asia Marie S.; Decato, Daniel A.; Sun, Jiyu; Massena, Casey J.; Jessop, Morly J.; Berryman, Orion B.
The intramolecular hydrogen bonded-halogen bond: a new strategy for preorganization and enhanced binding.
Chemical science, 2018, 9, 5828-5836
1549579 CIFC24 H16 F7 I2 N3 O6 S2P -18.0582; 11.0044; 17.7067
99.618; 91.239; 104.624		1494.58Riel, Asia Marie S.; Decato, Daniel A.; Sun, Jiyu; Massena, Casey J.; Jessop, Morly J.; Berryman, Orion B.
The intramolecular hydrogen bonded-halogen bond: a new strategy for preorganization and enhanced binding.
Chemical science, 2018, 9, 5828-5836
1549580 CIFC24 H16 F6 I2 N2 O6 S2P b c n22.337; 12.7364; 10.9081
90; 90; 90		3103.3Riel, Asia Marie S.; Decato, Daniel A.; Sun, Jiyu; Massena, Casey J.; Jessop, Morly J.; Berryman, Orion B.
The intramolecular hydrogen bonded-halogen bond: a new strategy for preorganization and enhanced binding.
Chemical science, 2018, 9, 5828-5836
1549581 CIFC22 H16 Br2 F I2 N3P 1 21/c 110.9739; 17.8839; 12.1266
90; 102.951; 90		2319.4Riel, Asia Marie S.; Decato, Daniel A.; Sun, Jiyu; Massena, Casey J.; Jessop, Morly J.; Berryman, Orion B.
The intramolecular hydrogen bonded-halogen bond: a new strategy for preorganization and enhanced binding.
Chemical science, 2018, 9, 5828-5836
1549582 CIFC36 H44 F I4 N3P 1 21/c 117.086; 18.092; 13.3174
90; 111.458; 90		3831.3Riel, Asia Marie S.; Decato, Daniel A.; Sun, Jiyu; Massena, Casey J.; Jessop, Morly J.; Berryman, Orion B.
The intramolecular hydrogen bonded-halogen bond: a new strategy for preorganization and enhanced binding.
Chemical science, 2018, 9, 5828-5836
1549583 CIFC22 H16 Cl2 I2 N2P 1 21/c 19.1408; 18.1854; 13.7305
90; 100.82; 90		2241.83Riel, Asia Marie S.; Decato, Daniel A.; Sun, Jiyu; Massena, Casey J.; Jessop, Morly J.; Berryman, Orion B.
The intramolecular hydrogen bonded-halogen bond: a new strategy for preorganization and enhanced binding.
Chemical science, 2018, 9, 5828-5836
1549584 CIF
HKL
Paper		C18 H16 N4 O2P 1 21/n 19.2366; 10.2045; 16.1922
90; 92.144; 90		1525.1Moussaif, Ahmed; Ramli, Youssef; El Ghayati, Lhoussaine; Essassi, El Mokhtar; Mague, Joel T.
Ethyl 5-(4-methylphenyl)-2,4,5,7-tetraazatricyclo[6.4.0.0^2,6^]dodeca-1(8),3,6,9,11-pentaene-3-carboxylate
IUCrData, 2018, 3, x180892
1549585 CIF
HKL
Paper		C11 H14 N2 O5P 1 21/n 17.7306; 16.8048; 9.3113
90; 102.001; 90		1183.2Missioui, Mohcine; El Fal, Mohammed; Taoufik, Jamal; Essassi, El Mokhtar; Mague, Joel T.; Ramli, Youssef
2-(3-Methyl-2-oxo-1,2-dihydroquinoxalin-1-yl)acetic acid dihydrate
IUCrData, 2018, 3, x180882
1549586 CIF
HKL
Paper		C17 H13 Cl O3 SP 1 21/c 113.1301; 11.9592; 10.3738
90; 112.041; 90		1509.9Piontek, Aleksandra; Siodłak, Dawid; Zarychta, Bartosz
4-Chloronaphthalen-1-yl 4-methylbenzenesulfonate
IUCrData, 2018, 3, x180889
1549587 CIF
HKL
Paper		C24 H20 O6 S2P 1 21/n 112.227; 5.7229; 15.9353
90; 109.869; 90		1048.68Piontek, Aleksandra; Siodłak, Dawid; Zarychta, Bartosz
Naphthalene-2,6-diyl bis(4-methylbenzenesulfonate)
IUCrData, 2018, 3, x180890
1549588 CIFC17 H16 O2 SeP 16.7562; 7.5182; 8.7692
107.83; 98.976; 113.06		370.28García-López, Diego; Civit, Marc G.; Vogels, Christopher M.; Ricart, Josep M.; Westcott, Stephen A.; Fernández, Elena; Carbó, Jorge J.
Understanding the mechanism of transition metal-free anti addition to alkynes: the selenoboration case
Catalysis Science & Technology, 2018, 8, 3617
1549589 CIFC15 H23 Br2 Co N3 O2P 1 21/n 110.2514; 14.6308; 12.6552
90; 92.105; 90		1896.82Midya, Siba P.; Pitchaimani, Jayaraman; Landge, Vinod G.; Madhu, Vedichi; Balaraman, Ekambaram
Direct access toN-alkylated amines and iminesviaacceptorless dehydrogenative coupling catalyzed by a cobalt(ii)-NNN pincer complex
Catalysis Science & Technology, 2018, 8, 3469
1549590 CIFC15 H29 B2 Cl2 Co F8 N5 OP -16.838; 13.077; 13.377
89.44; 78.44; 82.78		1162.5Midya, Siba P.; Pitchaimani, Jayaraman; Landge, Vinod G.; Madhu, Vedichi; Balaraman, Ekambaram
Direct access toN-alkylated amines and iminesviaacceptorless dehydrogenative coupling catalyzed by a cobalt(ii)-NNN pincer complex
Catalysis Science & Technology, 2018, 8, 3469
1549591 CIFC32 H27 Cl3 N2 O7 SP 1 21 110.664; 10.372; 14.789
90; 104.778; 90		1581.7Hatano, Manabu; Okamoto, Haruka; Kawakami, Taro; Toh, Kohei; Nakatsuji, Hidefumi; Sakakura, Akira; Ishihara, Kazuaki
Enantioselective aza-Friedel-Crafts reaction of furan with α-ketimino esters induced by a conjugated double hydrogen bond network of chiral bis(phosphoric acid) catalysts.
Chemical science, 2018, 9, 6361-6367
1549592 CIFC15 H16 Br N O5P 1 21 15.8577; 14.389; 9.621
90; 94.654; 90		808.2Hatano, Manabu; Okamoto, Haruka; Kawakami, Taro; Toh, Kohei; Nakatsuji, Hidefumi; Sakakura, Akira; Ishihara, Kazuaki
Enantioselective aza-Friedel-Crafts reaction of furan with α-ketimino esters induced by a conjugated double hydrogen bond network of chiral bis(phosphoric acid) catalysts.
Chemical science, 2018, 9, 6361-6367
1549593 CIFC67 H60 Cl2 N2 O8 P2P 21 21 2111.4778; 13.6448; 36.849
90; 90; 90		5771Hatano, Manabu; Okamoto, Haruka; Kawakami, Taro; Toh, Kohei; Nakatsuji, Hidefumi; Sakakura, Akira; Ishihara, Kazuaki
Enantioselective aza-Friedel-Crafts reaction of furan with α-ketimino esters induced by a conjugated double hydrogen bond network of chiral bis(phosphoric acid) catalysts.
Chemical science, 2018, 9, 6361-6367
1549594 CIFC47 H56 O8 P2P -112.7831; 14.6459; 14.8
116.231; 101.896; 102.26		2282.2Hatano, Manabu; Okamoto, Haruka; Kawakami, Taro; Toh, Kohei; Nakatsuji, Hidefumi; Sakakura, Akira; Ishihara, Kazuaki
Enantioselective aza-Friedel-Crafts reaction of furan with α-ketimino esters induced by a conjugated double hydrogen bond network of chiral bis(phosphoric acid) catalysts.
Chemical science, 2018, 9, 6361-6367
1549595 CIFC26 H27 F N2 O4P -17.8572; 10.5461; 14.099
70.648; 88.911; 85.089		1098.2Mori, Keiji; Umehara, Nobuaki; Akiyama, Takahiko
Highly diastereoselective synthesis of tricyclic fused-pyrans by sequential hydride shift mediated double C(sp<sup>3</sup>)-H bond functionalization.
Chemical science, 2018, 9, 7327-7331
1549596 CIFC26 H28 N2 O4P -17.945; 10.546; 14.045
70.523; 88.065; 83.805		1103Mori, Keiji; Umehara, Nobuaki; Akiyama, Takahiko
Highly diastereoselective synthesis of tricyclic fused-pyrans by sequential hydride shift mediated double C(sp<sup>3</sup>)-H bond functionalization.
Chemical science, 2018, 9, 7327-7331
1549597 CIFC26 H28 N2 O4P 1 21/n 17.6953; 15.2435; 18.799
90; 97.426; 90		2186.7Mori, Keiji; Umehara, Nobuaki; Akiyama, Takahiko
Highly diastereoselective synthesis of tricyclic fused-pyrans by sequential hydride shift mediated double C(sp<sup>3</sup>)-H bond functionalization.
Chemical science, 2018, 9, 7327-7331
1549598 CIF
Paper		Al4.857 O9.571 Si1.143P b a m7.5787; 7.6707; 2.8836
90; 90; 90		167.635Klar, Paul Benjamin; Etxebarria, Iñigo; Madariaga, Gotzon
Exploiting superspace to clarify vacancy and Al/Si ordering in mullite
IUCrJ, 2018, 5
1549599 CIF
Paper		Al4.832 O9.584 Si1.168P b a m7.577; 7.6727; 2.8804
90; 90; 90		167.46Klar, Paul Benjamin; Etxebarria, Iñigo; Madariaga, Gotzon
Exploiting superspace to clarify vacancy and Al/Si ordering in mullite
IUCrJ, 2018, 5
1549600 CIF
Paper		Al4.868 O9.566 Si1.132P b a m7.5768; 7.676; 2.8833
90; 90; 90		167.69Klar, Paul Benjamin; Etxebarria, Iñigo; Madariaga, Gotzon
Exploiting superspace to clarify vacancy and Al/Si ordering in mullite
IUCrJ, 2018, 5
1549601 CIF
Paper		Al4.853 O9.574 Si1.147P b a m7.577; 7.6738; 2.8823
90; 90; 90		167.59Klar, Paul Benjamin; Etxebarria, Iñigo; Madariaga, Gotzon
Exploiting superspace to clarify vacancy and Al/Si ordering in mullite
IUCrJ, 2018, 5
1549602 CIFC52 H24 F16 I4 N4P 1 21/c 113.0184; 9.7153; 19.986
90; 104.649; 90		2445.6Sinnwell, Michael A.; Blad, Jared N.; Thomas, Logan R.; MacGillivray, Leonard R.
Structural flexibility of halogen bonds showed in a single-crystal-to-single-crystal [2+2] photodimerization
IUCrJ, 2018, 5
1549603 CIFC52 H24 F16 I4 N4P 1 21/c 112.9647; 10.2219; 19.519
90; 109.387; 90		2440.1Sinnwell, Michael A.; Blad, Jared N.; Thomas, Logan R.; MacGillivray, Leonard R.
Structural flexibility of halogen bonds showed in a single-crystal-to-single-crystal [2+2] photodimerization
IUCrJ, 2018, 5
1549604 CIF
HKL
Paper		C45 H39 F6 Fe O4 P3P 1 21/n 19.10074; 17.7897; 24.9408
90; 97.7826; 90		4000.71Ma, Yuzhi; Lindeman, Sergey; Donaldson, William A.
Dicarbonyl{[(<i>E</i>,<i>E</i>)-(2,3,4,5-η)-6-methoxy-6-oxo-2,4-hexadienyl]triphenylphosphonium}(triphenylphosphane-κ<i>P</i>)iron(1+) hexafluoridophosphate
IUCrData, 2018, 3, x180902
1549605 CIF
HKL
Paper		C12 H21 N O3 SP 1 21/c 111.737; 8.8719; 14.3722
90; 106.616; 90		1434.1Seye, Dame; Diop, Cheikh Abdoul Khadir; Diop, Libasse; Geiger, David K.
Diisopropylammonium benzenesulfonate
IUCrData, 2018, 3, x180876
1549606 CIF
HKL
Paper		C28 H30 Mo N2 O4 P2P b c a15.634; 17.716; 21.661
90; 90; 90		5999Höhne, Martha; Gongoll, Marc; Spannenberg, Anke; Müller, Bernd H.; Peulecke, Normen; Rosenthal, Uwe
Tetracarbonyl[<i>N</i>-(diphenylphosphanyl-κ<i>P</i>)-<i>N</i>,<i>N</i>'-diisopropyl-<i>P</i>-phenylphosphorus diamide-κ<i>P</i>]molybdenum(0) with an unknown solvent
IUCrData, 2018, 3, x180846
1549607 CIF
HKL
Paper		C19 H13 F3 N4P 1 21/c 115.0553; 15.7338; 6.9701
90; 99.54; 90		1628.2El Hafi, Mohamed; Boulhaoua, Mohammed; Lahmidi, Sanae; Ramli, Youssef; Essassi, El Mokhtar; Mague, Joel T.
1-Methyl-4-phenyl-3-[4-(trifluoromethyl)phenyl]-1<i>H</i>-pyrazolo[3,4-<i>d</i>]pyrimidine
IUCrData, 2018, 3, x180875
1549608 CIF
HKL
Paper		C12 H15 N O4 SP 1 21/c 18.834; 18.6849; 7.6927
90; 91.478; 90		1269.35Baryala, Yamna; El Bakri, Youness; Anouar, El Hassane; Zerzouf, Abdelfettahb; Essassi, El Mokhtar; Mague, Joel T.
Ethyl 3-methyl-1-oxo-4<i>H</i>-1,4-benzothiazine-2-carboxylate monohydrate
IUCrData, 2018, 3, x180887
1549609 CIFC28 H18 Cu3 N10 O15C 1 2/c 131.977; 18.3536; 14.7633
90; 91.413; 90		8661.8Ahmad, Nazir; Younus, Hussein A.; Chughtai, Adeel H.; Van Hecke, Kristof; Khattak, Zafar A. K.; Gaoke, Zhang; Danish, Muhammad; Verpoort, Francis
Synthesis of 2D MOF having potential for efficient dye adsorption and catalytic applications
Catalysis Science & Technology, 2018, 8, 4010
1549610 CIFC51 H59 N2 Ni SP 1 21/c 113.0333; 16.6343; 19.8726
90; 96.392; 90		4281.6Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W.
Synthesis and reactivity of a nickel(ii) thioperoxide complex: demonstration of sulfide-mediated N<sub>2</sub>O reduction.
Chemical science, 2018, 9, 6580-6588
1549611 CIFC55.66667 H72 N2 Ni SP -112.686; 19.394; 30.321
88.294; 80.235; 81.137		7264Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W.
Synthesis and reactivity of a nickel(ii) thioperoxide complex: demonstration of sulfide-mediated N<sub>2</sub>O reduction.
Chemical science, 2018, 9, 6580-6588
1549612 CIFC102 H172 K2 N4 Ni2 O12 S2P 1 21/n 118.558; 16.822; 19.0552
90; 96.441; 90		5911.2Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W.
Synthesis and reactivity of a nickel(ii) thioperoxide complex: demonstration of sulfide-mediated N<sub>2</sub>O reduction.
Chemical science, 2018, 9, 6580-6588
1549613 CIFC53 H89 K N4 Ni O6 SP 1 21/n 112.7125; 22.4934; 20.0532
90; 102.126; 90		5606.2Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W.
Synthesis and reactivity of a nickel(ii) thioperoxide complex: demonstration of sulfide-mediated N<sub>2</sub>O reduction.
Chemical science, 2018, 9, 6580-6588
1549614 CIFC56 H80 K N2 Ni O6 SP -113.1937; 13.2978; 16.6951
88.621; 74.52; 88.213		2821.1Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W.
Synthesis and reactivity of a nickel(ii) thioperoxide complex: demonstration of sulfide-mediated N<sub>2</sub>O reduction.
Chemical science, 2018, 9, 6580-6588
1549615 CIFC108.5 H175 K2 N8 Ni2 O14 S2P -111.847; 13.438; 19.455
94.052; 95.344; 91.766		3073.9Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W.
Synthesis and reactivity of a nickel(ii) thioperoxide complex: demonstration of sulfide-mediated N<sub>2</sub>O reduction.
Chemical science, 2018, 9, 6580-6588
1549616 CIFC37 H23 N OP 1 21/n 112.115; 11.1281; 19.686
90; 106.472; 90		2545.1Wang, Sha-Sha; Rong, Rong; Jin, Ling-Zhi; Yang, Shan-Shan; Li, Yin-Xiang; Zhang, He; Xiong, Yu-Wei; Sun, Li-Tao; Cao, Hong-Tao; Xie, Ling-Hai; Huang, Wei
Variable segment roles: modulation of the packing modes, nanocrystal morphologies and optical emissions.
Nanoscale, 2018, 10, 13310-13314
1549617 CIFC37 H23 N OP 1 21/c 19.4322; 16.5755; 16.9196
90; 90.836; 90		2645Wang, Sha-Sha; Rong, Rong; Jin, Ling-Zhi; Yang, Shan-Shan; Li, Yin-Xiang; Zhang, He; Xiong, Yu-Wei; Sun, Li-Tao; Cao, Hong-Tao; Xie, Ling-Hai; Huang, Wei
Variable segment roles: modulation of the packing modes, nanocrystal morphologies and optical emissions.
Nanoscale, 2018, 10, 13310-13314
1549618 CIFC37 H23 N OP -18.581; 9.167; 17.575
89.893; 79.223; 70.216		1275.1Wang, Sha-Sha; Rong, Rong; Jin, Ling-Zhi; Yang, Shan-Shan; Li, Yin-Xiang; Zhang, He; Xiong, Yu-Wei; Sun, Li-Tao; Cao, Hong-Tao; Xie, Ling-Hai; Huang, Wei
Variable segment roles: modulation of the packing modes, nanocrystal morphologies and optical emissions.
Nanoscale, 2018, 10, 13310-13314
1549619 CIFC24 H23 I N2 O3P 21 21 216.8489; 15.7645; 19.4642
90; 90; 90		2101.54Meazza, Marta; Kamlar, Martin; Jašíková, Lucie; Formánek, Bedřich; Mazzanti, Andrea; Roithová, Jana; Veselý, Jan; Rios, Ramon
Synergistic formal ring contraction for the enantioselective synthesis of spiropyrazolones.
Chemical science, 2018, 9, 6368-6373
1549620 CIFC18 H19 N O5 SP 21 21 2119.1685; 5.7871; 14.8903
90; 90; 90		1651.78Li, Wei; Wollenburg, Marco; Glorius, Frank
Enantioselective synthesis of 2-oxazolidinones by ruthenium(ii)-NHC-catalysed asymmetric hydrogenation of 2-oxazolones.
Chemical science, 2018, 9, 6260-6263
1549621 CIFC33 H22 N4 OP 1 21/c 19.3334; 19.56; 13.636
90; 94.259; 90		2482.5Ni, Fan; Zhu, Zece; Tong, Xiao; Xie, Mingjuan; Zhao, Qiang; Zhong, Cheng; Zou, Yang; Yang, Chuluo
Organic emitter integrating aggregation-induced delayed fluorescence and room-temperature phosphorescence characteristics, and its application in time-resolved luminescence imaging.
Chemical science, 2018, 9, 6150-6155
1549622 CIFC66 H44 N10 O8 ZnP 1 21/c 113.3069; 18.6034; 27.4104
90; 102.321; 90		6629.3Ni, Fan; Zhu, Zece; Tong, Xiao; Xie, Mingjuan; Zhao, Qiang; Zhong, Cheng; Zou, Yang; Yang, Chuluo
Organic emitter integrating aggregation-induced delayed fluorescence and room-temperature phosphorescence characteristics, and its application in time-resolved luminescence imaging.
Chemical science, 2018, 9, 6150-6155
1549623 CIFC33 H22 N6 O7 ZnP -110.4399; 11.3331; 13.2139
100.001; 99.774; 99.056		1488.9Ni, Fan; Zhu, Zece; Tong, Xiao; Xie, Mingjuan; Zhao, Qiang; Zhong, Cheng; Zou, Yang; Yang, Chuluo
Organic emitter integrating aggregation-induced delayed fluorescence and room-temperature phosphorescence characteristics, and its application in time-resolved luminescence imaging.
Chemical science, 2018, 9, 6150-6155
1549624 CIFC30 H30 Cl0 N8 O0 S2 ZnP 1 21/c 116.408; 8.6188; 21.365
90; 97.571; 90		2995Fang, Yan; Li, Jie; Han, Pei-Pei; Han, Qiu-Xia; Li, Ming-Xue
Less toxic zinc(ii), diorganotin(iv), gallium(iii) and cadmium(ii) complexes derived from 2-benzoylpyridine <i>N</i>,<i>N</i>-dimethylthiosemicarbazone: synthesis, crystal structures, cytotoxicity and investigations of mechanisms of action.
Toxicology research, 2018, 7, 987-993
1549625 CIFC30 H30 Ga N9 O3 S2P 1 21/n 118.441; 8.936; 21.809
90; 94.29; 90		3583.81Fang, Yan; Li, Jie; Han, Pei-Pei; Han, Qiu-Xia; Li, Ming-Xue
Less toxic zinc(ii), diorganotin(iv), gallium(iii) and cadmium(ii) complexes derived from 2-benzoylpyridine <i>N</i>,<i>N</i>-dimethylthiosemicarbazone: synthesis, crystal structures, cytotoxicity and investigations of mechanisms of action.
Toxicology research, 2018, 7, 987-993
1549626 CIFC30 H30 Cd Cl0 N8 O0 S2C 1 2/c 116.9715; 23.6235; 15.9881
90; 102.867; 90		6249.1Fang, Yan; Li, Jie; Han, Pei-Pei; Han, Qiu-Xia; Li, Ming-Xue
Less toxic zinc(ii), diorganotin(iv), gallium(iii) and cadmium(ii) complexes derived from 2-benzoylpyridine <i>N</i>,<i>N</i>-dimethylthiosemicarbazone: synthesis, crystal structures, cytotoxicity and investigations of mechanisms of action.
Toxicology research, 2018, 7, 987-993
1549627 CIFC29 H28 N4 O2 S SnP 1 21/c 117.15; 10.549; 16.45
90; 101.78; 90		2913Fang, Yan; Li, Jie; Han, Pei-Pei; Han, Qiu-Xia; Li, Ming-Xue
Less toxic zinc(ii), diorganotin(iv), gallium(iii) and cadmium(ii) complexes derived from 2-benzoylpyridine <i>N</i>,<i>N</i>-dimethylthiosemicarbazone: synthesis, crystal structures, cytotoxicity and investigations of mechanisms of action.
Toxicology research, 2018, 7, 987-993
1549628 CIF
HKL
Paper		C14 H16 N2 Na O10 Rb S2P n m a14.2754; 6.5831; 21.5365
90; 90; 90		2023.9Nazarenko, Alexander Y.
Sodium rubidium disaccharinate tetrahydrate
IUCrData, 2018, 3, x180867
1549629 CIFC48 H86 B Fe K2 N2 O6 P3P 1 n 112.8973; 12.5342; 17.2106
90; 98.668; 90		2750.4Deegan, Meaghan M.; Peters, Jonas C.
Electrophile-promoted Fe-to-N<sub>2</sub> hydride migration in highly reduced Fe(N<sub>2</sub>)(H) complexes.
Chemical science, 2018, 9, 6264-6270
1549630 CIFC64 H95 B Fe K N2 O10 P3P 1 21/c 111.3464; 35.5398; 15.8541
90; 90.839; 90		6392.5Deegan, Meaghan M.; Peters, Jonas C.
Electrophile-promoted Fe-to-N<sub>2</sub> hydride migration in highly reduced Fe(N<sub>2</sub>)(H) complexes.
Chemical science, 2018, 9, 6264-6270
1549631 CIFC47 H81 B Fe N3 P3 Si2P b c a11.3085; 24.2407; 37.5101
90; 90; 90		10282.5Deegan, Meaghan M.; Peters, Jonas C.
Electrophile-promoted Fe-to-N<sub>2</sub> hydride migration in highly reduced Fe(N<sub>2</sub>)(H) complexes.
Chemical science, 2018, 9, 6264-6270
1549632 CIFC49 H85 B Fe K N2 O P3 SiP -112.4653; 13.091; 21.997
97.411; 95.734; 117.826		3095Deegan, Meaghan M.; Peters, Jonas C.
Electrophile-promoted Fe-to-N<sub>2</sub> hydride migration in highly reduced Fe(N<sub>2</sub>)(H) complexes.
Chemical science, 2018, 9, 6264-6270
1549633 CIFC79.22 H90.92 B2 F24 Fe N P3P 1 21/c 127.577; 15.5573; 38.526
90; 100.863; 90		16232Deegan, Meaghan M.; Peters, Jonas C.
Electrophile-promoted Fe-to-N<sub>2</sub> hydride migration in highly reduced Fe(N<sub>2</sub>)(H) complexes.
Chemical science, 2018, 9, 6264-6270
1549634 CIFC14 H21 B10 NP 1 21/c 17.8295; 25.776; 11.1821
90; 128.014; 90		1778Lyu, Hairong; Quan, Yangjian; Xie, Zuowei
Rhodium catalyzed cascade cyclization featuring B-H and C-H activation: one-step construction of carborane-fused N-polyheterocycles.
Chemical science, 2018, 9, 6390-6394
1549635 CIFC14 H24 B10 Cl N OP 1 21/n 111.4617; 7.484; 23.7344
90; 96.0865; 90		2024.45Lyu, Hairong; Quan, Yangjian; Xie, Zuowei
Rhodium catalyzed cascade cyclization featuring B-H and C-H activation: one-step construction of carborane-fused N-polyheterocycles.
Chemical science, 2018, 9, 6390-6394
1549636 CIFC18 H22 B10 NA m a 27.224; 24.584; 11.2382
90; 90; 90		1995.85Lyu, Hairong; Quan, Yangjian; Xie, Zuowei
Rhodium catalyzed cascade cyclization featuring B-H and C-H activation: one-step construction of carborane-fused N-polyheterocycles.
Chemical science, 2018, 9, 6390-6394
1549637 CIFC30 H21.45 Cl O0.22 SiR -317.2923; 17.2923; 13.9863
90; 90; 120		3621.9Zipse, Hendrik; Marin-Luna, Marta; Poelloth, Benjamin; Zott, Fabian L.
Size-Dependent Rate Acceleration in the Silylation of Secondary Alcohols: the Bigger the Faster
Chemical Science, 2018
1549638 CIFC34 H34 O SiP 1 21/c 110.8826; 34.7232; 7.28
90; 104.291; 90		2665.83Zipse, Hendrik; Marin-Luna, Marta; Poelloth, Benjamin; Zott, Fabian L.
Size-Dependent Rate Acceleration in the Silylation of Secondary Alcohols: the Bigger the Faster
Chemical Science, 2018
1549640 CIFC49 H48 Br N O3P 21 21 2110.118; 14.0353; 28.194
90; 90; 90		4003.8Santra, Surojit; Porey, Arka; Jana, Barun; Guin, Joyram
N-Heterocyclic carbenes as chiral Brønsted base catalysts: a highly diastereo- and enantioselective 1,6-addition reaction.
Chemical science, 2018, 9, 6446-6450
1549641 CIFC35 H40 N2 O4P 1 21 114.151; 14.717; 16.184
90; 111.316; 90		3139.9Santra, Surojit; Porey, Arka; Jana, Barun; Guin, Joyram
N-Heterocyclic carbenes as chiral Brønsted base catalysts: a highly diastereo- and enantioselective 1,6-addition reaction.
Chemical science, 2018, 9, 6446-6450
1549642 CIFC36 H43 N2 O6 SP 1 21 111.571; 25.09; 11.915
90; 90; 90		3459.1Santra, Surojit; Porey, Arka; Jana, Barun; Guin, Joyram
N-Heterocyclic carbenes as chiral Brønsted base catalysts: a highly diastereo- and enantioselective 1,6-addition reaction.
Chemical science, 2018, 9, 6446-6450
1549643 CIFC138 H132 Dy10 N32 O54 P4P 1 21/c 124.731; 14.057; 25.496
90; 112.797; 90		8171Tian, Haiquan; Su, Jing-Bu; Bao, Song-Song; Kurmoo, Mohamedally; Huang, Xin-Da; Zhang, Yi-Quan; Zheng, Li-Min
Reversible ON-OFF switching of single-molecule-magnetism associated with single-crystal-to-single-crystal structural transformation of a decanuclear dysprosium phosphonate.
Chemical science, 2018, 9, 6424-6433
1549644 CIFC134 H148 Dy10 N32 O66 P4P 1 21/c 124.653; 14.5645; 26.067
90; 112.969; 90		8617.5Tian, Haiquan; Su, Jing-Bu; Bao, Song-Song; Kurmoo, Mohamedally; Huang, Xin-Da; Zhang, Yi-Quan; Zheng, Li-Min
Reversible ON-OFF switching of single-molecule-magnetism associated with single-crystal-to-single-crystal structural transformation of a decanuclear dysprosium phosphonate.
Chemical science, 2018, 9, 6424-6433
1549645 CIFC134 H148 Dy10 N32 O66 P4P 1 21/c 124.6145; 14.5657; 26.0805
90; 112.968; 90		8609.3Tian, Haiquan; Su, Jing-Bu; Bao, Song-Song; Kurmoo, Mohamedally; Huang, Xin-Da; Zhang, Yi-Quan; Zheng, Li-Min
Reversible ON-OFF switching of single-molecule-magnetism associated with single-crystal-to-single-crystal structural transformation of a decanuclear dysprosium phosphonate.
Chemical science, 2018, 9, 6424-6433
1549646 CIFC134 H112 Dy10 N32 O50 P4P 1 21/c 125.525; 14.312; 25.318
90; 111.413; 90		8611Tian, Haiquan; Su, Jing-Bu; Bao, Song-Song; Kurmoo, Mohamedally; Huang, Xin-Da; Zhang, Yi-Quan; Zheng, Li-Min
Reversible ON-OFF switching of single-molecule-magnetism associated with single-crystal-to-single-crystal structural transformation of a decanuclear dysprosium phosphonate.
Chemical science, 2018, 9, 6424-6433
1549647 CIFC140 H132 Cl6 Dy10 N32 O52 P4R 3 2 :H26.7135; 26.7135; 71.325
90; 90; 120		44079Tian, Haiquan; Su, Jing-Bu; Bao, Song-Song; Kurmoo, Mohamedally; Huang, Xin-Da; Zhang, Yi-Quan; Zheng, Li-Min
Reversible ON-OFF switching of single-molecule-magnetism associated with single-crystal-to-single-crystal structural transformation of a decanuclear dysprosium phosphonate.
Chemical science, 2018, 9, 6424-6433
1549648 CIFC70 H120 Cu13 F6 N6 O8 P S12C 1 2/c 133.833; 18.7022; 36.604
90; 111.908; 90		21489Chakrahari, Kiran Kumarvarma; Silalahi, Rhone P Brocha; Liao, Jian-Hong; Kahlal, Samia; Liu, Yu-Chiao; Lee, Jyh-Fu; Chiang, Ming-Hsi; Saillard, Jean-Yves; Liu, C. W.
Synthesis and structural characterization of inverse-coordination clusters from a two-electron superatomic copper nanocluster.
Chemical science, 2018, 9, 6785-6795
1549649 CIFC70 H120 Cu12 N6 O8 S13P 21 21 2118.2449; 23.218; 23.3841
90; 90; 90		9905.7Chakrahari, Kiran Kumarvarma; Silalahi, Rhone P Brocha; Liao, Jian-Hong; Kahlal, Samia; Liu, Yu-Chiao; Lee, Jyh-Fu; Chiang, Ming-Hsi; Saillard, Jean-Yves; Liu, C. W.
Synthesis and structural characterization of inverse-coordination clusters from a two-electron superatomic copper nanocluster.
Chemical science, 2018, 9, 6785-6795
1549650 CIFC85 H102 Cl0.7 Cu12.3 F30 N6 O P S12P n n a21.8103; 22.977; 22.0395
90; 90; 90		11044.8Chakrahari, Kiran Kumarvarma; Silalahi, Rhone P Brocha; Liao, Jian-Hong; Kahlal, Samia; Liu, Yu-Chiao; Lee, Jyh-Fu; Chiang, Ming-Hsi; Saillard, Jean-Yves; Liu, C. W.
Synthesis and structural characterization of inverse-coordination clusters from a two-electron superatomic copper nanocluster.
Chemical science, 2018, 9, 6785-6795
1549651 CIFC87.5 H131 Cl Cu12 F6 N6 O0.5 P S12P -117.6501; 19.8146; 32.8484
86.5157; 89.7691; 75.775		11114.5Chakrahari, Kiran Kumarvarma; Silalahi, Rhone P Brocha; Liao, Jian-Hong; Kahlal, Samia; Liu, Yu-Chiao; Lee, Jyh-Fu; Chiang, Ming-Hsi; Saillard, Jean-Yves; Liu, C. W.
Synthesis and structural characterization of inverse-coordination clusters from a two-electron superatomic copper nanocluster.
Chemical science, 2018, 9, 6785-6795
1549652 CIFC86 H128 Br Cu12 F6 N6 P S12P -117.7551; 19.6625; 32.767
85.8425; 85.698; 76.1094		11055.9Chakrahari, Kiran Kumarvarma; Silalahi, Rhone P Brocha; Liao, Jian-Hong; Kahlal, Samia; Liu, Yu-Chiao; Lee, Jyh-Fu; Chiang, Ming-Hsi; Saillard, Jean-Yves; Liu, C. W.
Synthesis and structural characterization of inverse-coordination clusters from a two-electron superatomic copper nanocluster.
Chemical science, 2018, 9, 6785-6795
1549653 CIFC132 H234 Cl5 Cu24 F6 N12 O12 P S24C 1 2/c 131.396; 19.8294; 33.181
90; 97.8261; 90		20465Chakrahari, Kiran Kumarvarma; Silalahi, Rhone P Brocha; Liao, Jian-Hong; Kahlal, Samia; Liu, Yu-Chiao; Lee, Jyh-Fu; Chiang, Ming-Hsi; Saillard, Jean-Yves; Liu, C. W.
Synthesis and structural characterization of inverse-coordination clusters from a two-electron superatomic copper nanocluster.
Chemical science, 2018, 9, 6785-6795
1549654 CIFC74 H128 Cu12 N6 O8 S13P 21 21 2119.1023; 23.8001; 24.5421
90; 90; 90		11157.7Chakrahari, Kiran Kumarvarma; Silalahi, Rhone P Brocha; Liao, Jian-Hong; Kahlal, Samia; Liu, Yu-Chiao; Lee, Jyh-Fu; Chiang, Ming-Hsi; Saillard, Jean-Yves; Liu, C. W.
Synthesis and structural characterization of inverse-coordination clusters from a two-electron superatomic copper nanocluster.
Chemical science, 2018, 9, 6785-6795
1549655 CIFC52 H62 Fe N5 O4 S2P -110.175; 16.218; 16.588
84.402; 81.108; 76.3		2622.2Cook, Sarah A.; Bogart, Justin A.; Levi, Noam; Weitz, Andrew C.; Moore, Curtis; Rheingold, Arnold L.; Ziller, Joseph W.; Hendrich, Michael P.; Borovik, A. S.
Mononuclear complexes of a tridentate redox-active ligand with sulfonamido groups: structure, properties, and reactivity.
Chemical science, 2018, 9, 6540-6547
1549656 CIFC62 H87 Co N6 O4.5 S2P 1 21/n 117.4061; 10.7648; 31.052
90; 91.3044; 90		5816.8Cook, Sarah A.; Bogart, Justin A.; Levi, Noam; Weitz, Andrew C.; Moore, Curtis; Rheingold, Arnold L.; Ziller, Joseph W.; Hendrich, Michael P.; Borovik, A. S.
Mononuclear complexes of a tridentate redox-active ligand with sulfonamido groups: structure, properties, and reactivity.
Chemical science, 2018, 9, 6540-6547
1549657 CIFC50 H72 Ga N5 O6 S2P 1 21/c 116.1329; 27.6083; 13.2048
90; 105.613; 90		5664.4Cook, Sarah A.; Bogart, Justin A.; Levi, Noam; Weitz, Andrew C.; Moore, Curtis; Rheingold, Arnold L.; Ziller, Joseph W.; Hendrich, Michael P.; Borovik, A. S.
Mononuclear complexes of a tridentate redox-active ligand with sulfonamido groups: structure, properties, and reactivity.
Chemical science, 2018, 9, 6540-6547
1549658 CIFC56 H70 Co N5 O5 S2P -118.006; 18.271; 18.568
110.972; 109.602; 95.477		5209.6Cook, Sarah A.; Bogart, Justin A.; Levi, Noam; Weitz, Andrew C.; Moore, Curtis; Rheingold, Arnold L.; Ziller, Joseph W.; Hendrich, Michael P.; Borovik, A. S.
Mononuclear complexes of a tridentate redox-active ligand with sulfonamido groups: structure, properties, and reactivity.
Chemical science, 2018, 9, 6540-6547
1549659 CIFC59 H93 Fe N5 O6 S2P -19.4615; 18.3994; 18.765
107.605; 100.024; 93.8094		3041.4Cook, Sarah A.; Bogart, Justin A.; Levi, Noam; Weitz, Andrew C.; Moore, Curtis; Rheingold, Arnold L.; Ziller, Joseph W.; Hendrich, Michael P.; Borovik, A. S.
Mononuclear complexes of a tridentate redox-active ligand with sulfonamido groups: structure, properties, and reactivity.
Chemical science, 2018, 9, 6540-6547
1549660 CIFC60 H82 Fe N6 O4 S2P -110.6709; 17.4933; 17.8715
113.478; 98.8759; 91.3574		3009.9Cook, Sarah A.; Bogart, Justin A.; Levi, Noam; Weitz, Andrew C.; Moore, Curtis; Rheingold, Arnold L.; Ziller, Joseph W.; Hendrich, Michael P.; Borovik, A. S.
Mononuclear complexes of a tridentate redox-active ligand with sulfonamido groups: structure, properties, and reactivity.
Chemical science, 2018, 9, 6540-6547
1549663 CIFC22 H21 N O3 SP -19.3819; 10.3076; 10.6318
90.7648; 114.212; 100.138		918.87Leitch, Jamie A.; Fuentes de Arriba, Angel L.; Tan, Joanne; Hoff, Oskar; Martínez, Carlos M; Dixon, Darren J.
Photocatalytic reverse polarity Povarov reaction.
Chemical science, 2018, 9, 6653-6658
1549664 CIF
HKL
Paper		C21 H24 N2 O SP 1 21/c 114.898; 14.878; 8.4007
90; 96.78; 90		1849Akrad, Rachida; Guerrab, Walid; Lazrak, Fatima; Ansar, Mhammed; Taoufik, Jamal; Mague, Joel T.; Ramli, Youssef
4,4-Diphenyl-1-propyl-2-propylsulfanyl-4,5-dihydro-1<i>H</i>-imidazol-5-one
IUCrData, 2018, 3, x180934
1549665 CIF
HKL
Paper		C15 H13 N3P 1 21/n 15.9642; 17.7004; 11.3963
90; 100.695; 90		1182.2El Ghayati, Lhoussaine; Ramli, Youssef; Moussaif, Ahmed; Koubachi, Jamal; Taha, Mohamed Labd; Essassi, El Mokhtar; Mague, Joel T.
2-Methyl-4-(pyridin-2-yl)-3<i>H</i>-1,5-benzodiazepine
IUCrData, 2018, 3, x180953
1549666 CIF
HKL
Paper		C17 H12 O4P 1 c 15.7029; 4.0346; 28.9081
90; 90.751; 90		665.09Djandé, Abdoulaye; Abou, Akoun; Kini, Félix; Kambo, Konan René; Giorgi, Michel
2-Oxo-2<i>H</i>-chromen-7-yl 4-methylbenzoate
IUCrData, 2018, 3, x180927
1549667 CIF
HKL
Paper		C16 H16 Cd2 O8P 1 21/n 19.8377; 7.07; 24.268
90; 100.12; 90		1661.6LaDuca, Andrew R.; LaDuca, Robert L.
Poly[(μ5-cis-cyclohex-4-ene-1,2-dicarboxylato)(μ3-cis-cyclohex-4-ene-1,2-dicarboxylato)dicadmium(II)]
IUCrData, 2018, 3
1549668 CIFC64 H48 Br2 N2 NiR 3 c :H33.739; 33.739; 26.116
90; 90; 120		25746Fang, Jun; Sui, Xuelin; Li, Yougui; Chen, Changle
Synthesis of polyolefin elastomers from unsymmetrical α-diimine nickel catalyzed olefin polymerization
Polymer Chemistry, 2018, 9, 4143
1549669 CIFC67 H54 Br2 Cl2 N2 NiP 1 21/c 117.9769; 12.1378; 29.0552
90; 116.588; 90		5669.4Fang, Jun; Sui, Xuelin; Li, Yougui; Chen, Changle
Synthesis of polyolefin elastomers from unsymmetrical α-diimine nickel catalyzed olefin polymerization
Polymer Chemistry, 2018, 9, 4143
1549670 CIFC16 H16 N2 O4P 1 21/n 110.3695; 6.0922; 11.4055
90; 98.355; 90		712.87Dolai, Malay; Saha, Urmila; Das, Avijit Kumar; Suresh Kumar, Gopinatha
Single sensors for multiple analytes employing fluorometric differentiation for Cr3+ and Al3+ in semi-aqueous medium with bio-activity and theoretical aspects
Analytical Methods, 2018, 10, 4063
1549671 CIFC110 H82 Cu4 N2 O24P -115.9653; 17.691; 18.2258
61.811; 88.11; 64.125		3983.8Craig, Gavin A.; Larpent, Patrick; Kusaka, Shinpei; Matsuda, Ryotaro; Kitagawa, Susumu; Furukawa, Shuhei
Switchable gate-opening effect in metal-organic polyhedra assemblies through solution processing.
Chemical science, 2018, 9, 6463-6469
1549672 CIFC152 H164 Cu4 O34P 1 21/n 118.5382; 25.36; 19.6509
90; 116.08; 90		8297.8Craig, Gavin A.; Larpent, Patrick; Kusaka, Shinpei; Matsuda, Ryotaro; Kitagawa, Susumu; Furukawa, Shuhei
Switchable gate-opening effect in metal-organic polyhedra assemblies through solution processing.
Chemical science, 2018, 9, 6463-6469
1549673 CIFC108.67 H59 N O24 Rh4P -117.9146; 18.0902; 27.6891
77.345; 83.125; 61.947		7725.35Craig, Gavin A.; Larpent, Patrick; Kusaka, Shinpei; Matsuda, Ryotaro; Kitagawa, Susumu; Furukawa, Shuhei
Switchable gate-opening effect in metal-organic polyhedra assemblies through solution processing.
Chemical science, 2018, 9, 6463-6469
1549674 CIF
HKL
Paper		C25 H20 N2 O5P -111.5219; 14.2321; 14.7033
72.201; 73.469; 73.647		2150.18Mahfoud, Asmae; Al Houari, Ghali; El Yazidi, Mohamed; Saadi, Mohamed; El Ammari, Lahcen
2-Methyl-3'-(4-methylphenyl)-4'-(2-nitrophenyl)-4'<i>H</i>-spiro[chroman-3,5'-isoxazol]-4-one
IUCrData, 2018, 3, x180962
1549675 CIF
HKL
Paper		C17 H13 N5 OP c a 2123.5234; 10.5928; 23.4895
90; 90; 90		5853.1El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Mostafa, Mohamed S.; Khidre, Rizk E.; Hegazy, Amany S.; Kariuki, Benson M.
2-(5-Methyl-1-phenyl-1<i>H</i>-1,2,3-triazol-4-yl)-5-phenyl-1,3,4-oxadiazole
IUCrData, 2018, 3, x180966
1549676 CIFC10 H24 N7 Ni O9C 1 2/c 112.8157; 8.8179; 15.3168
90; 106.818; 90		1656.88Bhowmick, Indrani; Roehl, Andrew J.; Neilson, James R.; Rappé, Anthony K; Shores, Matthew P.
Slow magnetic relaxation in octahedral low-spin Ni(iii) complexes.
Chemical science, 2018, 9, 6564-6571
1549677 CIFC10 H26 Co0.9 N9 Ni0.1 O15P -17.371; 8.496; 9.08
89.163; 76.951; 81.894		548.3Bhowmick, Indrani; Roehl, Andrew J.; Neilson, James R.; Rappé, Anthony K; Shores, Matthew P.
Slow magnetic relaxation in octahedral low-spin Ni(iii) complexes.
Chemical science, 2018, 9, 6564-6571
1549678 CIFC10 H26 N9 Ni O15P -17.4549; 9.0814; 16.935
88.505; 81.132; 76.008		1099.1Bhowmick, Indrani; Roehl, Andrew J.; Neilson, James R.; Rappé, Anthony K; Shores, Matthew P.
Slow magnetic relaxation in octahedral low-spin Ni(iii) complexes.
Chemical science, 2018, 9, 6564-6571
1549679 CIFC12 H24 Cl N6 Ni O4 S2P -17.59; 8.72; 15.75
83.72; 81.37; 80.39		1012Bhowmick, Indrani; Roehl, Andrew J.; Neilson, James R.; Rappé, Anthony K; Shores, Matthew P.
Slow magnetic relaxation in octahedral low-spin Ni(iii) complexes.
Chemical science, 2018, 9, 6564-6571
1549680 CIFC288 H378 Cd24 Cl8 N16 O82 P6 S24R -3 :H22.4712; 22.4712; 62.0494
90; 90; 120		27134.4Shi, Cheng; Zhang, Min; Hang, Xinxin; Bi, Yanfeng; Huang, Liangliang; Zhou, Kun; Xu, Zhenhe; Zheng, Zhiping
Assembly of thiacalix[4]arene-supported high-nuclearity Cd24 cluster with enhanced photocatalytic activity.
Nanoscale, 2018, 10, 14448-14454
1549681 CIFC88 H108 Cd4 N2 O11 S8C 1 2/c 132.799; 19.0653; 31.1251
90; 114.228; 90		17748.9Shi, Cheng; Zhang, Min; Hang, Xinxin; Bi, Yanfeng; Huang, Liangliang; Zhou, Kun; Xu, Zhenhe; Zheng, Zhiping
Assembly of thiacalix[4]arene-supported high-nuclearity Cd24 cluster with enhanced photocatalytic activity.
Nanoscale, 2018, 10, 14448-14454
1549682 CIFC72 H72 Cl9 N7 O8P 21 21 2113.2969; 22.3943; 25.1034
90; 90; 90		7475.2Lister, Francis G. A.; Eccles, Natasha; Pike, Sarah J.; Brown, Robert A.; Whitehead, George F. S.; Raftery, James; Webb, Simon J.; Clayden, Jonathan
Bis-pyrene probes of foldamer conformation in solution and in phospholipid bilayers.
Chemical science, 2018, 9, 6860-6870
1549683 CIFC53 H53 Cl3 N8 O5P 1 21 19.7198; 18.6592; 14.0802
90; 90.161; 90		2553.6Lister, Francis G. A.; Eccles, Natasha; Pike, Sarah J.; Brown, Robert A.; Whitehead, George F. S.; Raftery, James; Webb, Simon J.; Clayden, Jonathan
Bis-pyrene probes of foldamer conformation in solution and in phospholipid bilayers.
Chemical science, 2018, 9, 6860-6870
1549684 CIFC72 H87.5 N8 O11.75P 1 21 115.5782; 18.4753; 24.4315
90; 91.976; 90		7027.5Lister, Francis G. A.; Eccles, Natasha; Pike, Sarah J.; Brown, Robert A.; Whitehead, George F. S.; Raftery, James; Webb, Simon J.; Clayden, Jonathan
Bis-pyrene probes of foldamer conformation in solution and in phospholipid bilayers.
Chemical science, 2018, 9, 6860-6870
1549685 CIFC70.79 H77.17 N7 O10.4P 21 21 2122.0413; 23.2593; 25.4959
90; 90; 90		13070.9Lister, Francis G. A.; Eccles, Natasha; Pike, Sarah J.; Brown, Robert A.; Whitehead, George F. S.; Raftery, James; Webb, Simon J.; Clayden, Jonathan
Bis-pyrene probes of foldamer conformation in solution and in phospholipid bilayers.
Chemical science, 2018, 9, 6860-6870
1549686 CIFC70.57 H83.27 N7 O9.57P 21 21 2110.5967; 21.5835; 28.6986
90; 90; 90		6563.8Lister, Francis G. A.; Eccles, Natasha; Pike, Sarah J.; Brown, Robert A.; Whitehead, George F. S.; Raftery, James; Webb, Simon J.; Clayden, Jonathan
Bis-pyrene probes of foldamer conformation in solution and in phospholipid bilayers.
Chemical science, 2018, 9, 6860-6870
1549687 CIFC26 H17 Br2 N3P c a 2125.043; 10.3564; 8.256
90; 90; 90		2141.2Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro
Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins
Chemical Science, 2018
1549688 CIFC81 H67 Cl3 N10 O4P -114.7058; 15.449; 16.6352
90.453; 101.803; 113.116		3386Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro
Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins
Chemical Science, 2018
1549689 CIFC40 H33 N5P 1 21/n 110.1411; 25.4006; 12.1107
90; 94.978; 90		3107.8Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro
Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins
Chemical Science, 2018
1549690 CIFC47.5 H49 Cl N5C 1 2/c 121.584; 14.4183; 25.314
90; 94.247; 90		7856.2Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro
Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins
Chemical Science, 2018
1549691 CIFC52 H45 N5 O2P -111.495; 11.813; 16.576
90.499; 110.07; 105.303		2026.9Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro
Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins
Chemical Science, 2018
1549692 CIFC85 H52 Cl2 F24 N10P -112.9577; 14.3835; 20.7824
88.275; 83.194; 84.955		3830.41Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro
Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins
Chemical Science, 2018
1549693 CIFC43 H34 F6 N5P 1 21/c 120.794; 13.875; 25.322
90; 102.958; 90		7120Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro
Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins
Chemical Science, 2018
1549694 CIFC40 H37 N5 O2P 1 21/c 118.523; 9.319; 19.109
90; 95.74; 90		3282Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro
Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins
Chemical Science, 2018
1549695 CIFC44 H41 N5P -112.176; 12.713; 13.64
99.304; 104.311; 115.26		1762Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro
Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins
Chemical Science, 2018
1549696 CIFC33.5 H26 Br N4 O0.5C 1 2/c 113.751; 15.095; 26.536
90; 100.513; 90		5416Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro
Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins
Chemical Science, 2018
1549697 CIFC40 H27 F6 N5P -113.025; 14.1499; 18.8806
87.297; 73.304; 82.748		3306.2Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro
Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins
Chemical Science, 2018
1549698 CIFC79.98 H59 Cl3 N10R -350.519; 50.519; 13.4259
90; 90; 120		29675Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro
Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins
Chemical Science, 2018
1549699 CIFC46 H33 N5P -16.5341; 12.836; 20.895
106.223; 90.002; 91.44		1682.1Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro
Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins
Chemical Science, 2018
1549700 CIFC252 H300 N20P b c a30.1086; 31.9945; 46.8128
90; 90; 90		45095.2Umetani, Masataka; Tanaka, Takayuki; Osuka, Atsuhiro
Conjugated double helices via self-dimerization of α,α’-Dianilinotripyrrins
Chemical Science, 2018
1549701 CIFC34 H30 Cl N OP 1 21/a 19.6998; 20.0864; 13.8561
90; 107.551; 90		2574Kuramoto, Yutaro; Nakagiri, Takanobu; Matsui, Yasunori; Ohta, Eisuke; Ogaki, Takuya; Ikeda, Hiroshi
A leaning amine-ketone dyad with a nonconjugated linker: solvatofluorochromism and dual fluorescence associated with intramolecular charge transfer.
Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 1157-1168
1549702 CIF
HKL
Paper		C17 H18 N2 O2 S2P 1 21/n 17.3167; 15.5894; 15.5627
90; 101.82; 90		1737.49Aziz, Hamid; Saeed, Aamer; Simpson, Jim
5,5-Diphenyl-2-thioxoimidazolidin-4-one dimethyl sulfoxide monosolvate
IUCrData, 2018, 3, x181010
1549703 CIF
HKL
Paper		C15 H18 N2 OP 1 21/c 111.4283; 9.2294; 12.3632
90; 96.89; 90		1294.6Al Garadi, Wedad; Ramli, Youssef; El Ghayati, Lhoussaine; Moussaif, Ahmed; Essassi, El Mokhtar; Mague, Joel T.
4-Phenyl-5a,6,7,8,9,9a-hexahydro-1<i>H</i>-1,5-benzodiazepin-2(5<i>H</i>)-one
IUCrData, 2018, 3, x181011
1549704 CIFC14 H26 N O4 SbP b c a8.0941; 43.971; 8.3622
90; 90; 90		2976.2Moaven, Shiva; Yu, Jingze; Vega, Maythe; Unruh, Daniel K.; Cozzolino, Anthony F.
Self-assembled reversed bilayers directed by pnictogen bonding to form vesicles in solution.
Chemical communications (Cambridge, England), 2018, 54, 8849-8852
1549705 CIFC52 H60 B F24 Fe P4I -413.2989; 13.2989; 17.4417
90; 90; 90		3084.75Doyle, Laurence R.; Scott, Daniel J.; Hill, Peter J.; Fraser, Duncan A. X.; Myers, William K.; White, Andrew J. P.; Green, Jennifer C.; Ashley, Andrew E.
Reversible coordination of N<sub>2</sub> and H<sub>2</sub> to a homoleptic <i>S</i> = 1/2 Fe(i) diphosphine complex in solution and the solid state.
Chemical science, 2018, 9, 7362-7369
1549706 CIFC19 H18 N2 OP 1 21/c 111.268; 16.335; 9.5163
90; 114.91; 90		1588.6Lv, Honggui; Xiao, Li-Jun; Zhao, Dongbing; Zhou, Qi-Lin
Nickel(0)-catalyzed linear-selective hydroarylation of unactivated alkenes and styrenes with aryl boronic acids.
Chemical science, 2018, 9, 6839-6843
1549707 CIFC47 H52 Fe N5 O6 PP -112.7848; 13.0223; 13.1304
93.792; 92.468; 90.347		2179.2Hong, Seungwoo; Yan, James J.; Karmalkar, Deepika G.; Sutherlin, Kyle D.; Kim, Jin; Lee, Yong-Min; Goo, Yire; Mascharak, Pradip K.; Hedman, Britt; Hodgson, Keith O.; Karlin, Kenneth D.; Solomon, Edward I.; Nam, Wonwoo
A mononuclear nonheme {FeNO}<sup>6</sup> complex: synthesis and structural and spectroscopic characterization.
Chemical science, 2018, 9, 6952-6960
1549708 CIFC51 H94 Fe N7 O6P 1 21/c 118.404; 18.521; 17.725
90; 102.745; 90		5893Hong, Seungwoo; Yan, James J.; Karmalkar, Deepika G.; Sutherlin, Kyle D.; Kim, Jin; Lee, Yong-Min; Goo, Yire; Mascharak, Pradip K.; Hedman, Britt; Hodgson, Keith O.; Karlin, Kenneth D.; Solomon, Edward I.; Nam, Wonwoo
A mononuclear nonheme {FeNO}<sup>6</sup> complex: synthesis and structural and spectroscopic characterization.
Chemical science, 2018, 9, 6952-6960
1549709 CIFC39 H33 F12 N7 P2 RuP -111.0216; 14.4762; 14.5765
83.804; 85.851; 69.748		2167.64Al-Afyouni, Malik H; Rohrabaugh, Jr, Thomas N; Al-Afyouni, Kathlyn F; Turro, Claudia
New Ru(ii) photocages operative with near-IR light: new platform for drug delivery in the PDT window.
Chemical science, 2018, 9, 6711-6720
1549710 CIFC39 H29 F12 N7 P2 RuP -111.9502; 13.3979; 13.5014
82.904; 83.437; 79.213		2097.98Al-Afyouni, Malik H; Rohrabaugh, Jr, Thomas N; Al-Afyouni, Kathlyn F; Turro, Claudia
New Ru(ii) photocages operative with near-IR light: new platform for drug delivery in the PDT window.
Chemical science, 2018, 9, 6711-6720
1549711 CIFC30 H25 F3 N4 O2 P0.5 RuC 1 2/m 118.547; 23.5958; 17.833
90; 119.975; 90		6760.4Al-Afyouni, Malik H; Rohrabaugh, Jr, Thomas N; Al-Afyouni, Kathlyn F; Turro, Claudia
New Ru(ii) photocages operative with near-IR light: new platform for drug delivery in the PDT window.
Chemical science, 2018, 9, 6711-6720
1549712 CIFC40 H58 Cl N8 O8P -19.2108; 9.4525; 29.308
87.928; 83.132; 71.201		2398.2Chen, Xiao-Xiao; Liu, Qi; Guo, Yan; Yan, Hui; Li, Jing; Lv, Dong-Mei; Zhang, Jun-Hong; Liu, Min; Yao, Chun-Hong; Wei, Xi-Lian
Effects of additives on the viscoelastic responses of cationic gemini surfactant solutions.
Soft matter, 2018, 14, 6696-6707
1549713 CIFC42 H46 Mn0.5 N6 O14 S2P -19.7187; 11.2496; 21.8708
88.401; 83.848; 64.446		2144.39Fidalgo-Marijuan, Arkaitz; Amayuelas, Eder; Barandika, Gotzone; Larrea, Edurne S.; Bazán, Begoña; Urtiaga, Miren Karmele; Iglesias, Marta; Arriortua, María Isabel
Double role of metalloporphyrins in catalytic bioinspired supramolecular metal‒organic frameworks (SMOFs)
IUCrJ, 2018, 5
1549714 CIF
HKL
Paper		C22 H15 N O2 SP b c a9.265; 10.3523; 36.0698
90; 90; 90		3459.6Bakhouch, Mohamed; El Yazidi, Mohamed; Al Houari, Ghali; Saadi, Mohamed; El Ammari, Lahcen
3',4'-Diphenyl-3<i>H</i>,4'<i>H</i>-spiro[benzo[<i>b</i>]thiophene-2,5'-isoxazol]-3-one
IUCrData, 2018, 3, x181019
1549715 CIFC86 H157 K2 Mn8 N O42P 1 21/n 118.998; 15.678; 20.236
90; 100.84; 90		5920Mousazade, Younes; Mohammadi, Mohammad Reza; Chernev, Petko; Bikas, Rahman; Bagheri, Robabeh; Song, Zhenlun; Lis, Tadeusz; Dau, Holger; Najafpour, Mohammad Mahdi
Water oxidation by a manganese‒potassium cluster: Mn oxide as a kinetically dominant “true” catalyst for water oxidation
Catalysis Science & Technology, 2018, 8, 4390
1549716 CIFC13 H18 N2 SP 21 21 220.7206; 9.8606; 6.3486
90; 90; 90		1297.13Formica, Michele; Sorin, Geoffroy; Farley, Alistair J. M.; Díaz, Jesús; Paton, Robert S.; Dixon, Darren J.
Bifunctional iminophosphorane catalysed enantioselective sulfa-Michael addition of alkyl thiols to alkenyl benzimidazoles.
Chemical science, 2018, 9, 6969-6974
1549717 CIFC39.5 H48.9 N6.5 O16.2 Zn2C 1 2/c 125.386; 25.15; 17.6282
90; 114.178; 90		10268Zhang, Yiwen; Su, Kongzhao; Hao, Miao; Liu, Lin; Han, Zheng-Bo; Yuan, Daqiang
Two metal‒organic frameworks based on pyridyl‒tricarboxylate ligands as size-selective catalysts for solvent-free cyanosilylation reaction
CrystEngComm, 2018, 20, 6070
1549718 CIFC42.15 H54.35 Cd2 N6.05 O16.05C 1 2/c 126.4534; 24.3372; 17.6488
90; 109.622; 90		10702.5Zhang, Yiwen; Su, Kongzhao; Hao, Miao; Liu, Lin; Han, Zheng-Bo; Yuan, Daqiang
Two metal‒organic frameworks based on pyridyl‒tricarboxylate ligands as size-selective catalysts for solvent-free cyanosilylation reaction
CrystEngComm, 2018, 20, 6070
1549719 CIFC24 H19 N O9P 1 21/c 19.662; 15.701; 14.746
90; 94.165; 90		2231.1Mal, Kajal; Naskar, Barnali; Mondal, Animesh; Goswami, Sanchita; Prodhan, Chandraday; Chaudhuri, Keya; Mukhopadhyay, Chhanda
Dihydroindeno[1,2-b]pyrroles: new Al<sup>3+</sup> selective off-on chemosensors for bio-imaging in living HepG2 cells.
Organic & biomolecular chemistry, 2018, 16, 5920-5931
1549720 CIF
HKL
Paper		C14 H18 N2 O3P n a 2112.2836; 14.5343; 7.8596
90; 90; 90		1403.2Rasheeda, Kedila; Samshuddin, Seranthimata; Swathi, Phadke N.; Alva, Vijaya D. P.; Mague, Joel T.; Ramli, Youssef
2-(4-Hydroxyphenyl)-4,6-dimethyl-2,3-dihydropyrimidin-1-ium acetate
IUCrData, 2018, 3, x181046
1549721 CIF
HKL
Paper		C19 H16 O5P 21 21 214.6852; 17.5786; 18.8573
90; 90; 90		1553.07Goyal, Navneet; Do, Camilla; Donahue, James P.; Mague, Joel T.; Foroozesh, Maryam
Ethyl 2-[2-(4-oxo-4<i>H</i>-chromen-2-yl)phenoxy]acetate
IUCrData, 2018, 3, x180993
1549723 CIFC24 H19 Cl4 RhP 1 21/c 114.3151; 6.8774; 23.4347
90; 106.959; 90		2206.84Yang, Junfeng; Shen, Yixiao; Lim, Yang Jie; Yoshikai, Naohiko
Divergent ring-opening coupling between cyclopropanols and alkynes under cobalt catalysis.
Chemical science, 2018, 9, 6928-6934
1549724 CIFC15 H9 F7.05P b c m12.069; 30.5791; 36.076
90; 90; 90		13314.2Font, Marc; Spencer, Andrew R. A.; Larrosa, Igor
<i>meta</i>-C-H arylation of fluoroarenes <i>via</i> traceless directing group relay strategy.
Chemical science, 2018, 9, 7133-7137
1549725 CIFC15 H12 F2 O2P 1 21/c 113.442; 13.4424; 7.0546
90; 93.892; 90		1271.8Font, Marc; Spencer, Andrew R. A.; Larrosa, Igor
<i>meta</i>-C-H arylation of fluoroarenes <i>via</i> traceless directing group relay strategy.
Chemical science, 2018, 9, 7133-7137
1549726 CIFC29 H39 Cl5 Cu N2 O6 S2P 1 21/c 18.4746; 9.5148; 45.506
90; 91.765; 90		3667.6Olavarría-Contreras, Ignacio José; Etcheverry-Berríos, Alvaro; Qian, Wenjie; Gutiérrez-Cerón, Cristian; Campos-Olguín, Aldo; Sañudo, E Carolina; Dulić, Diana; Ruiz, Eliseo; Aliaga-Alcalde, Núria; Soler, Monica; van der Zant, Herre S. J.
Electric-field induced bistability in single-molecule conductance measurements for boron coordinated curcuminoid compounds.
Chemical science, 2018, 9, 6988-6996
1549727 CIFC21 H20 O2 S2P 1 21/n 113.7982; 5.5253; 24.9052
90; 103.39; 90		1847.14Olavarría-Contreras, Ignacio José; Etcheverry-Berríos, Alvaro; Qian, Wenjie; Gutiérrez-Cerón, Cristian; Campos-Olguín, Aldo; Sañudo, E Carolina; Dulić, Diana; Ruiz, Eliseo; Aliaga-Alcalde, Núria; Soler, Monica; van der Zant, Herre S. J.
Electric-field induced bistability in single-molecule conductance measurements for boron coordinated curcuminoid compounds.
Chemical science, 2018, 9, 6988-6996
1549728 CIFC17 H13 N2 O3P 1 21/c 113.2523; 8.0408; 12.7339
90; 91.04; 90		1356.69Qin, Qi-Pin; Wang, Shulong; Tan, Mingxiong; Wang, Zhen-Feng; Huang, Xiao-Ling; Wei, Qingmin; Shi, Bei-Bei; Zou, Bi-Qun; Liang, Hong
Synthesis and antitumor mechanisms of two novel platinum(II) complexes with 3-(2′-benzimidazolyl)-7-methoxycoumarin
Metallomics, 2018
1549729 CIFC21 H23 Cl3 N2 O5 Pt2 S2P -19.4211; 12.9359; 13.8521
66.332; 88.609; 71.401		1454.91Qin, Qi-Pin; Wang, Shulong; Tan, Mingxiong; Wang, Zhen-Feng; Huang, Xiao-Ling; Wei, Qingmin; Shi, Bei-Bei; Zou, Bi-Qun; Liang, Hong
Synthesis and antitumor mechanisms of two novel platinum(II) complexes with 3-(2′-benzimidazolyl)-7-methoxycoumarin
Metallomics, 2018
1549730 CIFC98 H60 Cu9 N36 O6 SC 1 2/c 132.7; 10.89; 30.813
90; 114.97; 90		9947Yu, Fei; Kurmoo, Mohamedally; Zhuang, Gui-Lin; Zuo, Jing-Lin
Hierarchical tandem assembly of planar [3×3] building units into {3×[3×3]} oligomers: mixed-valency, electrical conductivity and magnetism.
Chemical science, 2018, 9, 7498-7504
1549731 CIFC294 H180 Cu27 N114 O4 SP 1 21/n 114.7327; 47.3434; 51.2702
90; 97.581; 90		35448.2Yu, Fei; Kurmoo, Mohamedally; Zhuang, Gui-Lin; Zuo, Jing-Lin
Hierarchical tandem assembly of planar [3×3] building units into {3×[3×3]} oligomers: mixed-valency, electrical conductivity and magnetism.
Chemical science, 2018, 9, 7498-7504
1549732 CIFC22 H23 Cl N2 O2C 1 2/c 127.997; 4.918; 28.971
90; 108.987; 90		3772Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J.
The importance of configurational disorder in crystal structure prediction: the case of loratadine.
Faraday discussions, 2018, 211, 209-234
1549733 CIFC22 H23 Cl N2 O2C 1 2/c 135.652; 5.206; 22.743
90; 117.418; 90		3747Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J.
The importance of configurational disorder in crystal structure prediction: the case of loratadine.
Faraday discussions, 2018, 211, 209-234
1549734 CIFC22 H23 Cl N2 O2C 1 2/c 127.844; 4.867; 28.892
90; 108.98; 90		3702Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J.
The importance of configurational disorder in crystal structure prediction: the case of loratadine.
Faraday discussions, 2018, 211, 209-234
1549735 CIFC22 H23 Cl N2 O2C 1 2/c 128.502; 5.051; 29.231
90; 109.51; 90		3967Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J.
The importance of configurational disorder in crystal structure prediction: the case of loratadine.
Faraday discussions, 2018, 211, 209-234
1549736 CIFC22 H23 Cl N2 O2C 1 2/c 128.301; 4.998; 29.154
90; 109.217; 90		3894Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J.
The importance of configurational disorder in crystal structure prediction: the case of loratadine.
Faraday discussions, 2018, 211, 209-234
1549737 CIFC22 H23 Cl N2 O2C 1 2/c 128.201; 4.972; 29.106
90; 109.077; 90		3857Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J.
The importance of configurational disorder in crystal structure prediction: the case of loratadine.
Faraday discussions, 2018, 211, 209-234
1549738 CIFC22 H23 Cl N2 O2C 1 2/c 127.906; 4.886; 28.927
90; 109.016; 90		3728.9Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J.
The importance of configurational disorder in crystal structure prediction: the case of loratadine.
Faraday discussions, 2018, 211, 209-234
1549739 CIFC8 H4.19 Al I0.82 O5I m m a16.501; 6.6194; 13.21
90; 90; 90		1442.9Tahmouresilerd, Babak; Larson, Patrick J.; Unruh, Daniel K.; Cozzolino, Anthony F.
Make room for iodine: systematic pore tuning of multivariate metal‒organic frameworks for the catalytic oxidation of hydroquinones using hypervalent iodine
Catalysis Science & Technology, 2018, 8, 4349
1549740 CIFC8 H4.3 Al I0.7 O5.25I m m a17.107; 6.622; 12.229
90; 90; 90		1385.3Tahmouresilerd, Babak; Larson, Patrick J.; Unruh, Daniel K.; Cozzolino, Anthony F.
Make room for iodine: systematic pore tuning of multivariate metal‒organic frameworks for the catalytic oxidation of hydroquinones using hypervalent iodine
Catalysis Science & Technology, 2018, 8, 4349
1549741 CIFC12 H14 Er I N2P 21 21 2110.7394; 10.7693; 12.2067
90; 90; 90		1411.8Hilgar, J. D.; Bernbeck, M. G.; Flores, B. S.; Rinehart, J. D.
Metal-ligand pair anisotropy in a series of mononuclear Er-COT complexes.
Chemical science, 2018, 9, 7204-7209
1549742 CIFC16 H24 Er I O2P 1 21/n 18.4793; 9.3962; 22.2154
90; 97.496; 90		1754.8Hilgar, J. D.; Bernbeck, M. G.; Flores, B. S.; Rinehart, J. D.
Metal-ligand pair anisotropy in a series of mononuclear Er-COT complexes.
Chemical science, 2018, 9, 7204-7209
1549743 CIFC18 H18 Er I N2P 1 21/n 110.818; 8.8916; 18.3519
90; 96.53; 90		1753.8Hilgar, J. D.; Bernbeck, M. G.; Flores, B. S.; Rinehart, J. D.
Metal-ligand pair anisotropy in a series of mononuclear Er-COT complexes.
Chemical science, 2018, 9, 7204-7209
1549744 CIFC27 H38 B Er N6 OP 1 21/c 18.2903; 31.84; 10.584
90; 102.02; 90		2732.5Hilgar, J. D.; Bernbeck, M. G.; Flores, B. S.; Rinehart, J. D.
Metal-ligand pair anisotropy in a series of mononuclear Er-COT complexes.
Chemical science, 2018, 9, 7204-7209
1549745 CIFC16 H21 F3 N2 O2P 1 21/c 113.0203; 10.3915; 12.893
90; 103.151; 90		1698.68Png, Zhuang Mao; Cabrera-Pardo, Jaime R; Peiró Cadahía, Jorge; Gaunt, Matthew J.
Diastereoselective C-H carbonylative annulation of aliphatic amines: a rapid route to functionalized γ-lactams.
Chemical science, 2018, 9, 7628-7633
1549746 CIFC36.25 H64.5 Cl4.5 F4 N2 O8 Pd3P -111.8915; 14.4371; 15.9414
84.9399; 77.9747; 68.7283		2494.14Png, Zhuang Mao; Cabrera-Pardo, Jaime R; Peiró Cadahía, Jorge; Gaunt, Matthew J.
Diastereoselective C-H carbonylative annulation of aliphatic amines: a rapid route to functionalized γ-lactams.
Chemical science, 2018, 9, 7628-7633
1549747 CIFC38 H35 Cl3 F20 N P PdP -113.2478; 19.4015; 20.3563
115.227; 91.1995; 105.389		4509.24Png, Zhuang Mao; Cabrera-Pardo, Jaime R; Peiró Cadahía, Jorge; Gaunt, Matthew J.
Diastereoselective C-H carbonylative annulation of aliphatic amines: a rapid route to functionalized γ-lactams.
Chemical science, 2018, 9, 7628-7633
1549748 CIFC48 H35 N3 O2P 1 21/c 17.9859; 19.6476; 23.8539
90; 106.74; 90		3584.15Xiong, Jingwen; Li, Zongzhi; Tan, Jihua; Ji, Shaomin; Sun, Jianwei; Li, Xianwei; Huo, Yanping
Two new quinoline-based regenerable fluorescent probes with AIE characteristics for selective recognition of Cu<sup>2+</sup> in aqueous solution and test strips.
The Analyst, 2018, 143, 4870-4886
1549749 CIFC31 H53 Rh2 S2P 1 21/n 110.855; 28.6007; 10.8441
90; 119.239; 90		2937.7Serrano-Maldonado, A.; Rozenel, S. S.; Jimenez-Santiago, J. L.; Guerrero-Ríos, I.; Martin, E.
Rh nanoparticles from thiolate dimers: selective and reusable hydrogenation catalysts in ionic liquids
Catalysis Science & Technology, 2018, 8, 4373
1549750 CIFC40 H74 Rh2 S2P 1 21/m 18.734; 26.987; 8.39
90; 90; 90		1977.6Serrano-Maldonado, A.; Rozenel, S. S.; Jimenez-Santiago, J. L.; Guerrero-Ríos, I.; Martin, E.
Rh nanoparticles from thiolate dimers: selective and reusable hydrogenation catalysts in ionic liquids
Catalysis Science & Technology, 2018, 8, 4373
1549751 CIFC28 Al2 Cl6 F56 Li2 N2 O6C 1 2/c 130.4136; 11.7318; 20.6258
90; 129.575; 90		5672.6Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo
Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>).
Chemical science, 2018, 9, 7058-7068
1549752 CIFC24 Al2 F55 N O7P 1 21/n 110.6841; 18.2966; 22.3798
90; 94.822; 90		4359.38Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo
Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>).
Chemical science, 2018, 9, 7058-7068
1549753 CIFC36 H8 Ag Al2 F59 O6C 1 c 113.1028; 29.39; 14.129
90; 99.674; 90		5363.6Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo
Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>).
Chemical science, 2018, 9, 7058-7068
1549754 CIFC42 H12 Ag Al2 F61 O6P -115.4856; 17.6866; 22.5679
76.093; 84.023; 81.617		5920.4Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo
Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>).
Chemical science, 2018, 9, 7058-7068
1549755 CIFC15 H6 Al F27 O6P 1 21/c 110.8066; 13.958; 17.2977
90; 90.19; 90		2609.15Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo
Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>).
Chemical science, 2018, 9, 7058-7068
1549756 CIFC28 H8 Ag Al F40 O4P 1 21/n 114.1565; 18.4564; 14.651
90; 91.2; 90		3827.1Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo
Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>).
Chemical science, 2018, 9, 7058-7068
1549757 CIFC30 H12 Ag Al F34 O3P 1 21/n 110.2659; 17.4605; 20.9905
90; 99.098; 90		3715.17Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo
Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>).
Chemical science, 2018, 9, 7058-7068
1549758 CIFC50 H58 Ag Al2 Br2 Cl4 F55 O6 Si2P -115.476; 16.615; 18.2967
89.488; 67.742; 70.537		4068.1Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo
Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>).
Chemical science, 2018, 9, 7058-7068
1549759 CIFC21 H18 Al F28 Li O12P 1 21/c 135.9221; 10.7468; 19.3985
90; 102.381; 90		7314.6Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo
Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>).
Chemical science, 2018, 9, 7058-7068
1549760 CIFC20 H10 Ag B F22 O2P 1 21/c 134.3712; 10.6465; 13.7845
90; 100.452; 90		4960.5Martens, Arthur; Weis, Philippe; Krummer, Michael Christian; Kreuzer, Marvin; Meierhöfer, Andreas; Meier, Stefan C.; Bohnenberger, Jan; Scherer, Harald; Riddlestone, Ian; Krossing, Ingo
Facile and systematic access to the least-coordinating WCA [(R<sup>F</sup>O)<sub>3</sub>Al-F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> and its more Lewis-basic brother [F-Al(OR<sup>F</sup>)<sub>3</sub>]<sup>-</sup> (R<sup>F</sup> = C(CF<sub>3</sub>)<sub>3</sub>).
Chemical science, 2018, 9, 7058-7068
1549761 CIFC48.25 H44.5 Cl0.5 N2 O9P -114.0049; 23.6564; 26.0431
71.035; 82.975; 82.271		8057.2Homberg, Alexandre; Brun, Elodie; Zinna, Francesco; Pascal, Simon; Górecki, Marcin; Monnier, Luc; Besnard, Céline; Pescitelli, Gennaro; Di Bari, Lorenzo; Lacour, Jérôme
Combined reversible switching of ECD and quenching of CPL with chiral fluorescent macrocycles.
Chemical science, 2018, 9, 7043-7052
1549762 CIFC48 H42 N2 O6P -111.8363; 12.6884; 14.8869
108.968; 104.837; 104.872		1897.35Homberg, Alexandre; Brun, Elodie; Zinna, Francesco; Pascal, Simon; Górecki, Marcin; Monnier, Luc; Besnard, Céline; Pescitelli, Gennaro; Di Bari, Lorenzo; Lacour, Jérôme
Combined reversible switching of ECD and quenching of CPL with chiral fluorescent macrocycles.
Chemical science, 2018, 9, 7043-7052
1549763 CIFCa4.83 F Mn0.15 O12 P3 Sr0.02P 63/m9.384; 9.384; 6.8842
90; 90; 120		525Arima, H.; Kida, Y.; Mikouchi, T.; Sugiyama, K.
The location of Mn (MnO: 2.0 wt%) in fluorapatit from Lavra da Golconda, near Governador Valadares, Minas Gerais, Brazil
Journal of Mineralogical and Petrological Sciences, 2018, 113, 119-125
1549764 CIFAl2 Ca0.96 F4.28 H3.72 O3.72 Sr0.04C 1 2/c 16.7103; 11.1619; 7.3741
90; 94.919; 90		550.28Hongu, H.; Yoshiasa, A.; Teshima, A.; Isobe, H.; Sugiyama, K.; Arima, H.; Nakatsuka, A.; Momma, K.; Miyawaki, R.
Crystal structure refinement and chemical formula of prosopite, CaAl2F4[(OH)4-xFx] x = 0.0-1.0
Journal of Mineralogical and Petrological Sciences, 2018, 113, 152-158
1549765 CIFC10 H10 Br2 Co N2P 1 21/c 18.6842; 18.1757; 8.5209
90; 100.878; 90		1320.8Majcher, Anna M.; Dąbczyński, Paweł; Marzec, Mateusz M.; Ceglarska, Magdalena; Rysz, Jakub; Bernasik, Andrzej; Ohkoshi, Shin-Ichi; Stefańczyk, Olaf
Between single ion magnets and macromolecules: a polymer/transition metal-based semi-solid solution.
Chemical science, 2018, 9, 7277-7286
1549766 CIFC14 H14 Br2 Co N2C 1 2/c 19.1275; 12.1835; 14.8264
90; 95.764; 90		1640.4Majcher, Anna M.; Dąbczyński, Paweł; Marzec, Mateusz M.; Ceglarska, Magdalena; Rysz, Jakub; Bernasik, Andrzej; Ohkoshi, Shin-Ichi; Stefańczyk, Olaf
Between single ion magnets and macromolecules: a polymer/transition metal-based semi-solid solution.
Chemical science, 2018, 9, 7277-7286
1549767 CIFC20 H32 P Si2 TbP n m a12.8319; 18.8787; 9.3269
90; 90; 90		2259.4Chen, Shi-Ming; Xiong, Jin; Zhang, Yi-Quan; Yuan, Qiong; Wang, Bing-Wu; Gao, Song
A soft phosphorus atom to "harden" an erbium(iii) single-ion magnet.
Chemical science, 2018, 9, 7540-7545
1549768 CIFC20 H32 Er P Si2P 1 21/c 115.1266; 10.815; 14.256
90; 95.164; 90		2322.73Chen, Shi-Ming; Xiong, Jin; Zhang, Yi-Quan; Yuan, Qiong; Wang, Bing-Wu; Gao, Song
A soft phosphorus atom to "harden" an erbium(iii) single-ion magnet.
Chemical science, 2018, 9, 7540-7545
1549769 CIFC20 H32 Dy P Si2P n m a12.8248; 18.9114; 9.3047
90; 90; 90		2256.7Chen, Shi-Ming; Xiong, Jin; Zhang, Yi-Quan; Yuan, Qiong; Wang, Bing-Wu; Gao, Song
A soft phosphorus atom to "harden" an erbium(iii) single-ion magnet.
Chemical science, 2018, 9, 7540-7545
1549770 CIFC20 H32 P Si2 TmP 1 21/c 115.0719; 10.8053; 14.3183
90; 95.125; 90		2322.5Chen, Shi-Ming; Xiong, Jin; Zhang, Yi-Quan; Yuan, Qiong; Wang, Bing-Wu; Gao, Song
A soft phosphorus atom to "harden" an erbium(iii) single-ion magnet.
Chemical science, 2018, 9, 7540-7545
1549771 CIFC20 H32 P Si2 YP 1 21/c 115.2388; 10.8568; 14.217
90; 95.18; 90		2342.5Chen, Shi-Ming; Xiong, Jin; Zhang, Yi-Quan; Yuan, Qiong; Wang, Bing-Wu; Gao, Song
A soft phosphorus atom to "harden" an erbium(iii) single-ion magnet.
Chemical science, 2018, 9, 7540-7545
1549775 CIFC25 H15 N S2P b c a18.7793; 7.4521; 50.3987
90; 90; 90		7053.06Kitano, Hiroyuki; Matsuoka, Wataru; Ito, Hideto; Itami, Kenichiro
Annulative π-extension of indoles and pyrroles with diiodobiaryls by Pd catalysis: rapid synthesis of nitrogen-containing polycyclic aromatic compounds.
Chemical science, 2018, 9, 7556-7561
1549776 CIFC29 H19 NP 1 21/n 110.6434; 9.1028; 20.109
90; 102.565; 90		1901.6Kitano, Hiroyuki; Matsuoka, Wataru; Ito, Hideto; Itami, Kenichiro
Annulative π-extension of indoles and pyrroles with diiodobiaryls by Pd catalysis: rapid synthesis of nitrogen-containing polycyclic aromatic compounds.
Chemical science, 2018, 9, 7556-7561
1549777 CIFC41 H27 N O S4P 1 21/c 116.1846; 27.2713; 7.6092
90; 97.89; 90		3326.7Kitano, Hiroyuki; Matsuoka, Wataru; Ito, Hideto; Itami, Kenichiro
Annulative π-extension of indoles and pyrroles with diiodobiaryls by Pd catalysis: rapid synthesis of nitrogen-containing polycyclic aromatic compounds.
Chemical science, 2018, 9, 7556-7561
1549778 CIFC220 H194.5 Au24.01 Cl3 P10 Pd0.99 S5P -120.474; 31.755; 36.216
75.393; 74.91; 84.029		21981Nair, Lakshmi V.; Hossain, Sakiat; Takagi, Shunjiro; Imai, Yukari; Hu, Guoxiang; Wakayama, Shota; Kumar, Bharat; Kurashige, Wataru; Jiang, De-En; Negishi, Yuichi
Hetero-biicosahedral [Au<sub>24</sub>Pd(PPh<sub>3</sub>)<sub>10</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>5</sub>Cl<sub>2</sub>]<sup>+</sup> nanocluster: selective synthesis and optical and electrochemical properties.
Nanoscale, 2018, 10, 18969-18979
1549779 CIF
HKL
Paper		C25 H24 N4 O3 SP 1 2/c 18.3287; 13.8956; 20.3124
90; 90.635; 90		2350.7El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Yousif, Emad; Hegazy, Amany S.; Kariuki, Benson M.
Ethyl 2-anilino-4-methyl-5-[5-methyl-1-(4-methylphenyl)-1<i>H</i>-1,2,3-triazole-4-carbonyl]thiophene-3-carboxylate
IUCrData, 2018, 3, x181106
1549780 CIF
HKL
Paper		H4 N O3 VP b c m4.9045; 11.7945; 5.8231
90; 90; 90		336.84Pérez-Benítez, Aarón; Bernès, Sylvain
Redetermination of ammonium metavanadate
IUCrData, 2018, 3
1549781 CIF
HKL
Paper		C19 H14 O2P b c n19.7403; 9.3294; 15.0595
90; 90; 90		2773.4Devassia, Tomson; Mathew, Eason M.; Sithambaresan, M.; Unnikrishnan, P. A.; Kurup, M. R. Prathapachandra
10-Methyl-9,11-annulated dibenzobarrelene
IUCrData, 2018, 3, x181102
1549782 CIFC23 H19 B N2P -19.5765; 10.1909; 10.8774
115.915; 106.476; 90.377		905.1Yang, Kai; Zhang, Guan; Song, Qiuling
Four-coordinate triarylborane synthesis <i>via</i> cascade B-Cl/C-B cross-metathesis and C-H bond borylation.
Chemical science, 2018, 9, 7666-7672
1549783 CIFC17 H14 B F N2P 1 21/n 19.1839; 11.282; 14.148
90; 101.51; 90		1436.4Yang, Kai; Zhang, Guan; Song, Qiuling
Four-coordinate triarylborane synthesis <i>via</i> cascade B-Cl/C-B cross-metathesis and C-H bond borylation.
Chemical science, 2018, 9, 7666-7672
1549784 CIFC59.5 H22 Cl7 F20 N5 S3P -113.89; 14.796; 16.218
96.6694; 96.2744; 112.822		3007.7Higashino, Tomohiro; Kumagai, Atsushi; Sakaki, Shigeyoshi; Imahori, Hiroshi
Reversible π-system switching of thiophene-fused thiahexaphyrins by solvent and oxidation/reduction.
Chemical science, 2018, 9, 7528-7539
1549785 CIFC65 H20.5 Cl1.5 F20 N5 S3P -113.765; 17.271; 24.19
94.738; 102.606; 93.061		5577.9Higashino, Tomohiro; Kumagai, Atsushi; Sakaki, Shigeyoshi; Imahori, Hiroshi
Reversible π-system switching of thiophene-fused thiahexaphyrins by solvent and oxidation/reduction.
Chemical science, 2018, 9, 7528-7539
1549786 CIFC32 H33 N5 O5 UP -110.3182; 12.47104; 12.8143
82.2874; 68.197; 79.3609		1500.76Faizova, Radmila; White, Sarah; Scopelliti, Rosario; Mazzanti, Marinella
The effect of iron binding on uranyl(v) stability.
Chemical science, 2018, 9, 7520-7527
1549787 CIFC64 H64 Fe N10 O10 U2C 1 2/c 146.746; 13.2744; 24.296
90; 145.84; 90		8465Faizova, Radmila; White, Sarah; Scopelliti, Rosario; Mazzanti, Marinella
The effect of iron binding on uranyl(v) stability.
Chemical science, 2018, 9, 7520-7527
1549788 CIFC69 H69 I2 N11 O6 U2P 1 21/n 114.3842; 14.1543; 16.8027
90; 93.045; 90		3416.2Faizova, Radmila; White, Sarah; Scopelliti, Rosario; Mazzanti, Marinella
The effect of iron binding on uranyl(v) stability.
Chemical science, 2018, 9, 7520-7527
1549789 CIFC63 H99 K2 N8 O17 UP -112.542; 13.779; 23.86
81.55; 78.59; 86.58		3996Faizova, Radmila; White, Sarah; Scopelliti, Rosario; Mazzanti, Marinella
The effect of iron binding on uranyl(v) stability.
Chemical science, 2018, 9, 7520-7527
1549790 CIFC99 H99 Fe3 I2 N17 O10 U2P -113.7743; 21.1783; 24.452
99.7615; 95.7326; 98.8026		6888.7Faizova, Radmila; White, Sarah; Scopelliti, Rosario; Mazzanti, Marinella
The effect of iron binding on uranyl(v) stability.
Chemical science, 2018, 9, 7520-7527
1549791 CIFC50 H54 Fe N8 O5 UP 1 21/c 119.5691; 13.9341; 19.6431
90; 118.26; 90		4717.8Faizova, Radmila; White, Sarah; Scopelliti, Rosario; Mazzanti, Marinella
The effect of iron binding on uranyl(v) stability.
Chemical science, 2018, 9, 7520-7527
1549792 CIFC69 H69 Fe I N11 O8 U2P 1 21/n 115.964; 23.884; 20.0642
90; 105.849; 90		7359.3Faizova, Radmila; White, Sarah; Scopelliti, Rosario; Mazzanti, Marinella
The effect of iron binding on uranyl(v) stability.
Chemical science, 2018, 9, 7520-7527
1549793 CIF
HKL
Paper		C10 H7 Cl N3 Na O2P 1 21/c 111.6462; 6.3754; 14.7003
90; 92.711; 90		1090.26El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Yousif, Emad; Hegazy, Amany S.; Kariuki, Benson M.
Sodium 1-(4-chlorophenyl)-5-methyl-1<i>H</i>-1,2,3-triazole-4-carboxylate
IUCrData, 2018, 3, x181127
1549794 CIF
HKL
Paper		C37 H31 B Cl3 F4 N P2P -19.6306; 10.813; 17.0381
91.826; 95.619; 90.734		1764.6Manandhar, Rachana; Rath, Nigam P.; Jones, Myron W.
Bis(triphenylphosphine)iminium tetrafluoroborate chloroform monosolvate
IUCrData, 2018, 3, x181108
1549795 CIF
HKL
Paper		C15 H22 I NP b c a15.631; 11.614; 16.976
90; 90; 90		3082da Costa Duarte, Rodrigo; Kommers Reimann, Louise; Severo Rodembusch, Fabiano; Gustavo Teixeira Alves Duarte, Luís
1-Butyl-2,3,3-trimethylindol-1-ium iodide
IUCrData, 2018, 3, x181130
1549796 CIFC58 H84 Mn2 N4P 1 21/n 114.1097; 14.319; 14.2262
90; 111.886; 90		2667.1Mukhopadhyay, Tufan K.; Flores, Marco; Groy, Thomas L.; Trovitch, Ryan J.
A β-diketiminate manganese catalyst for alkene hydrosilylation: substrate scope, silicone preparation, and mechanistic insight.
Chemical science, 2018, 9, 7673-7680
1549797 CIFC41 H58 Mn N2P 1 21/c 112.443; 13.455; 22.132
90; 102.382; 90		3619Mukhopadhyay, Tufan K.; Flores, Marco; Groy, Thomas L.; Trovitch, Ryan J.
A β-diketiminate manganese catalyst for alkene hydrosilylation: substrate scope, silicone preparation, and mechanistic insight.
Chemical science, 2018, 9, 7673-7680
1549798 CIFC40 H33 F6 Fe N5 O6 S2C 1 2/c 142.348; 11.696; 18.645
90; 92.882; 90		9223Rana, Sujoy; Biswas, Jyoti Prasad; Sen, Asmita; Clémancey, Martin; Blondin, Geneviève; Latour, Jean-Marc; Rajaraman, Gopalan; Maiti, Debabrata
Selective C-H halogenation over hydroxylation by non-heme iron(iv)-oxo.
Chemical science, 2018, 9, 7843-7858
1549799 CIFC64 H53 Cl6 Fe3 N11P b c a18.9606; 18.7387; 34.1557
90; 90; 90		12135.4Rana, Sujoy; Biswas, Jyoti Prasad; Sen, Asmita; Clémancey, Martin; Blondin, Geneviève; Latour, Jean-Marc; Rajaraman, Gopalan; Maiti, Debabrata
Selective C-H halogenation over hydroxylation by non-heme iron(iv)-oxo.
Chemical science, 2018, 9, 7843-7858
1549800 CIFC33 H27 Br Cl7 Fe N5 O4P -19.9553; 13.1814; 16.2767
92.662; 96.422; 105.743		2036.29Rana, Sujoy; Biswas, Jyoti Prasad; Sen, Asmita; Clémancey, Martin; Blondin, Geneviève; Latour, Jean-Marc; Rajaraman, Gopalan; Maiti, Debabrata
Selective C-H halogenation over hydroxylation by non-heme iron(iv)-oxo.
Chemical science, 2018, 9, 7843-7858
1549801 CIFC33 H27 Cl8 Fe N5 O4P -19.68503; 9.74597; 20.3011
92.2266; 101.563; 98.3455		1852.88Rana, Sujoy; Biswas, Jyoti Prasad; Sen, Asmita; Clémancey, Martin; Blondin, Geneviève; Latour, Jean-Marc; Rajaraman, Gopalan; Maiti, Debabrata
Selective C-H halogenation over hydroxylation by non-heme iron(iv)-oxo.
Chemical science, 2018, 9, 7843-7858
1549802 CIFC64 H53 Br6 Fe3 N11P b c a19.0269; 18.8487; 35.2474
90; 90; 90		12640.9Rana, Sujoy; Biswas, Jyoti Prasad; Sen, Asmita; Clémancey, Martin; Blondin, Geneviève; Latour, Jean-Marc; Rajaraman, Gopalan; Maiti, Debabrata
Selective C-H halogenation over hydroxylation by non-heme iron(iv)-oxo.
Chemical science, 2018, 9, 7843-7858
1549803 CIF
HKL
Paper		C16 H12 O3P 1 21/n 113.2958; 5.1981; 18.8162
90; 109.212; 90		1228.02Padgett, Clifford W.; Lynch, Will E.; Sheriff, Kirkland; Dean, Raven; Zingales, Sarah
3-Hydroxy-2-(4-methylphenyl)-4<i>H</i>-chromen-4-one
IUCrData, 2018, 3, x181138
1549804 CIF
HKL
Paper		C18 H18 Cl N3 OP 659.9013; 9.9013; 28.981
90; 90; 120		2460.5Lee, Ji Hye; Koh, Dongsoo
2-Amino-4-(4-methoxyphenyl)-6-(4-methylphenyl)pyrimidin-1-ium chloride
IUCrData, 2018, 3, x181152
1549805 CIFC32 H40 F2 SnP 1 21/c 117.1715; 17.8894; 9.4518
90; 101.309; 90		2847.1Ming, Jialin; Shi, Qi; Hayashi, Tamio
Addition of arylstannanes to alkynes giving <i>ortho</i>-alkenylarylstannanes catalysed cooperatively by a rhodium complex and zinc chloride.
Chemical science, 2018, 9, 7700-7704
1549806 CIFC90 H68 B2 F30 Fe2 O2P 1 21/c 114.0463; 17.6303; 16.8395
90; 100.648; 90		4098.34Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard
The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals.
Chemical science, 2018, 9, 8011-8018
1549807 CIFC51 H22 B2 F30 N O3P -113.8373; 14.8923; 15.4147
63.462; 80.689; 88.721		2799.88Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard
The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals.
Chemical science, 2018, 9, 8011-8018
1549808 CIFC69 H25 B2 Cl4 F30 O2P -113.3556; 14.9486; 17.5414
95.477; 111.222; 102.632		3126.3Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard
The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals.
Chemical science, 2018, 9, 8011-8018
1549809 CIFC72 H29 B2 Cl6 F30 O2P -112.3256; 16.7558; 17.1303
90.82; 97.535; 103.218		3410.8Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard
The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals.
Chemical science, 2018, 9, 8011-8018
1549810 CIFC71 H40 B2 Cl2 F30 Fe O2P 1 21 112.6071; 13.6253; 20.3659
90; 100.362; 90		3441.31Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard
The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals.
Chemical science, 2018, 9, 8011-8018
1549811 CIFC72 H42 B2 Cl4 F30 Fe O2P -111.863; 13.004; 13.207
106.631; 116.366; 92.518		1714Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard
The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals.
Chemical science, 2018, 9, 8011-8018
1549812 CIFC68 H36 B2 F30 Fe O2P -113.3457; 14.575; 17.8933
91.771; 97.044; 102.641		3364.49Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard
The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals.
Chemical science, 2018, 9, 8011-8018
1549813 CIFC90 H68 B2 F30 Fe2 O2P 1 21/n 126.8002; 12.9058; 27.8292
90; 116.473; 90		8616.2Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard
The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals.
Chemical science, 2018, 9, 8011-8018
1549814 CIFC51 H22 B2 F30 N O3P -111.8064; 14.9813; 15.3306
91.992; 103.172; 108.496		2487Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard
The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals.
Chemical science, 2018, 9, 8011-8018
1549815 CIFC61 H19 B2 F30 O2P -113.791; 14.0959; 18.1102
109.569; 109.658; 90.652		3093.2Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard
The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals.
Chemical science, 2018, 9, 8011-8018
1549816 CIFC62 H34 B2 F30 Fe O2P -19.5809; 10.9166; 14.2783
74.722; 79.532; 85.172		1415.59Tao, Xin; Daniliuc, Constantin G.; Knitsch, Robert; Hansen, Michael Ryan; Eckert, Hellmut; Lübbesmeyer, Maximilian; Studer, Armido; Kehr, Gerald; Erker, Gerhard
The special role of B(C<sub>6</sub>F<sub>5</sub>)<sub>3</sub> in the single electron reduction of quinones by radicals.
Chemical science, 2018, 9, 8011-8018
1549817 CIFC10 H8 N4 OP 1 21/c 13.7576; 14.428; 9.4611
90; 100.599; 90		504.18Chen, Ming; Hu, Xianglong; Liu, Junkai; Li, Baixue; Leung, Nelson L. C.; Viglianti, Lucia; Cheung, Tsz Shing; Sung, Herman H. Y.; Kwok, Ryan T. K.; Williams, Ian D.; Qin, Anjun; Lam, Jacky W. Y.; Tang, Ben Zhong
Rational design of red AIEgens with a new core structure from non-emissive heteroaromatics.
Chemical science, 2018, 9, 7829-7834
1549818 CIFC34 H22 N4P -15.772; 9.9613; 10.8529
87.644; 77.477; 89.901		608.63Chen, Ming; Hu, Xianglong; Liu, Junkai; Li, Baixue; Leung, Nelson L. C.; Viglianti, Lucia; Cheung, Tsz Shing; Sung, Herman H. Y.; Kwok, Ryan T. K.; Williams, Ian D.; Qin, Anjun; Lam, Jacky W. Y.; Tang, Ben Zhong
Rational design of red AIEgens with a new core structure from non-emissive heteroaromatics.
Chemical science, 2018, 9, 7829-7834
1549819 CIF
HKL		C17 H20 N6 O2P -17.3968; 10.6475; 12.7769
106.577; 100.809; 108.208		872.83El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Yousif, Emad; Hegazy, Amany S.; Kariuki, Benson M.
5-Methyl-1-(4-methylphenyl)-<i>N</i>'-[1-(1<i>H</i>-pyrrol-2-yl)ethylidene]-1<i>H</i>-1,2,3-triazole-4-carbohydrazide monohydrate
IUCrData, 2018, 3, x181162
1549820 CIFC7 H8 Cu I N2 O2P -14.2503; 10.1169; 11.3784
81.03; 88.843; 82.58		479.24Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar
Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors.
Chemical science, 2018, 9, 8000-8010
1549821 CIFC7 H8 Cu I N2 O2P -14.0958; 9.372; 10.9859
85.224; 88.977; 84.909		418.56Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar
Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors.
Chemical science, 2018, 9, 8000-8010
1549822 CIFC7 H8 Cu I N2 O2P -13.9623; 8.824; 10.6104
87.89; 88.524; 87.3		370.2Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar
Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors.
Chemical science, 2018, 9, 8000-8010
1549823 CIFC7 H8 Cu I N2 O2P -14.0071; 9.009; 10.7254
87.042; 88.693; 86.485		385.87Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar
Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors.
Chemical science, 2018, 9, 8000-8010
1549824 CIFC7 H8 Cu I N2 O2P -14.1474; 9.5705; 11.1208
84.163; 88.992; 84.152		436.83Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar
Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors.
Chemical science, 2018, 9, 8000-8010
1549825 CIFC7 H8 Cu I N2 O2P -14.0175; 9.064; 10.7655
86.743; 88.765; 86.231		390.48Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar
Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors.
Chemical science, 2018, 9, 8000-8010
1549826 CIFC7 H8 Cu I N2 O2P -14.0406; 9.151; 10.8365
86.375; 88.849; 85.829		398.78Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar
Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors.
Chemical science, 2018, 9, 8000-8010
1549827 CIFC7 H8 Cu I N2 O2P -13.9759; 8.862; 10.6257
87.71; 88.616; 87.1		373.52Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar
Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors.
Chemical science, 2018, 9, 8000-8010
1549828 CIFC7 H8 Cu I N2 O2P -14.1864; 9.741; 11.2181
83.217; 88.956; 83.522		451.36Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar
Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors.
Chemical science, 2018, 9, 8000-8010
1549829 CIFC7 H8 Cu I N2 O2P -13.989; 8.933; 10.667
87.474; 88.623; 86.839		379.07Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar
Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors.
Chemical science, 2018, 9, 8000-8010
1549830 CIFC7 H8 Cu I N2 O2P -14.068; 9.26; 10.911
85.828; 88.899; 85.395		408.56Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar
Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors.
Chemical science, 2018, 9, 8000-8010
1549831 CIFC7 H8 Cu I N2 O2P -13.997; 8.9646; 10.6952
87.267; 88.673; 86.652		382.06Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar
Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors.
Chemical science, 2018, 9, 8000-8010
1549832 CIFC7 H8 Cu I N2 O2P -14.0313; 9.11; 10.8051
86.619; 88.825; 86.015		395.12Conesa-Egea, Javier; Nogal, Noemí; Martínez, José Ignacio; Fernández-Moreira, Vanesa; Rodríguez-Mendoza, Ulises R; González-Platas, Javier; Gómez-García, Carlos J; Delgado, Salomé; Zamora, Félix; Amo-Ochoa, Pilar
Smart composite films of nanometric thickness based on copper-iodine coordination polymers. Toward sensors.
Chemical science, 2018, 9, 8000-8010
1549833 CIFC71 H102 Fe4 O6P 1 21/n 112.2994; 22.698; 23.587
90; 99.188; 90		6500.3Carpenter, Stephanie H.; Baker, Tessa M.; Munoz, Salvador; Brennessel, William W.; Neidig, Michael L.
Multinuclear Iron-Phenyl Species in Reactions of Simple Iron Salts and PhMgBr: Identification of Fe4(μ-Ph)6(THF)4 as a Key Reactive Species for Cross-Coupling
Chemical Science, 2018
1549834 CIFC76 H114 Br2 F4 Fe2 Mg2 O14.5P -112.3417; 15.4069; 21.5668
100.062; 99.279; 94.4973		3960.9Carpenter, Stephanie H.; Baker, Tessa M.; Munoz, Salvador; Brennessel, William W.; Neidig, Michael L.
Multinuclear Iron-Phenyl Species in Reactions of Simple Iron Salts and PhMgBr: Identification of Fe4(μ-Ph)6(THF)4 as a Key Reactive Species for Cross-Coupling
Chemical Science, 2018
1549835 CIFC94 H140 Fe2 Mg2 O16P -112.4649; 12.9212; 15.2879
69.5966; 81.444; 88.91		2280.7Carpenter, Stephanie H.; Baker, Tessa M.; Munoz, Salvador; Brennessel, William W.; Neidig, Michael L.
Multinuclear Iron-Phenyl Species in Reactions of Simple Iron Salts and PhMgBr: Identification of Fe4(μ-Ph)6(THF)4 as a Key Reactive Species for Cross-Coupling
Chemical Science, 2018
1549836 CIFC18 H30 Fe0.58 Mg0.42 O6P 1 21/c 115.2106; 11.1429; 12.9636
90; 114.031; 90		2006.76Carpenter, Stephanie H.; Baker, Tessa M.; Munoz, Salvador; Brennessel, William W.; Neidig, Michael L.
Multinuclear Iron-Phenyl Species in Reactions of Simple Iron Salts and PhMgBr: Identification of Fe4(μ-Ph)6(THF)4 as a Key Reactive Species for Cross-Coupling
Chemical Science, 2018
1549837 CIFC60 H78 Fe4 O6F d d d20.134; 24.672; 43.274
90; 90; 90		21496Carpenter, Stephanie H.; Baker, Tessa M.; Munoz, Salvador; Brennessel, William W.; Neidig, Michael L.
Multinuclear Iron-Phenyl Species in Reactions of Simple Iron Salts and PhMgBr: Identification of Fe4(μ-Ph)6(THF)4 as a Key Reactive Species for Cross-Coupling
Chemical Science, 2018
1549838 CIFC58 H74 Fe4 O4P 1 21/c 116.159; 17.191; 18.694
90; 98.545; 90		5135.3Carpenter, Stephanie H.; Baker, Tessa M.; Munoz, Salvador; Brennessel, William W.; Neidig, Michael L.
Multinuclear Iron-Phenyl Species in Reactions of Simple Iron Salts and PhMgBr: Identification of Fe4(μ-Ph)6(THF)4 as a Key Reactive Species for Cross-Coupling
Chemical Science, 2018
1549839 CIFC52 H56 F6 Fe4 O4I 41/a m d15.5897; 15.5897; 45.3118
90; 90; 90		11012.5Carpenter, Stephanie H.; Baker, Tessa M.; Munoz, Salvador; Brennessel, William W.; Neidig, Michael L.
Multinuclear Iron-Phenyl Species in Reactions of Simple Iron Salts and PhMgBr: Identification of Fe4(μ-Ph)6(THF)4 as a Key Reactive Species for Cross-Coupling
Chemical Science, 2018
1549840 CIFC86 H118 F6 Fe2 Mg2 O14P -112.7545; 12.82; 14.971
96.604; 108.178; 113.494		2050.9Carpenter, Stephanie H.; Baker, Tessa M.; Munoz, Salvador; Brennessel, William W.; Neidig, Michael L.
Multinuclear Iron-Phenyl Species in Reactions of Simple Iron Salts and PhMgBr: Identification of Fe4(μ-Ph)6(THF)4 as a Key Reactive Species for Cross-Coupling
Chemical Science, 2018
1549841 CIFC80 H112 Fe2 Mg N6 O9.5P 42/n20.048; 20.048; 19.32
90; 90; 90		7765.1Carpenter, Stephanie H.; Baker, Tessa M.; Munoz, Salvador; Brennessel, William W.; Neidig, Michael L.
Multinuclear Iron-Phenyl Species in Reactions of Simple Iron Salts and PhMgBr: Identification of Fe4(μ-Ph)6(THF)4 as a Key Reactive Species for Cross-Coupling
Chemical Science, 2018
1549842 CIFC69 H59 Br2 Co N9 O9 S2P 18.8042; 13.872; 15.012
113.273; 91.702; 108.265		1574.4Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi
Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation.
Chemical science, 2018, 9, 7986-7991
1549843 CIFC69 H59 Br2 Co N9 O9 S2P 18.933; 14.009; 15.07
113.024; 91.175; 108.218		1627Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi
Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation.
Chemical science, 2018, 9, 7986-7991
1549844 CIFC69 H55 Br2 Co N9 O7 S2P 18.7198; 13.8688; 15.15
112.076; 90.143; 106.456		1615.99Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi
Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation.
Chemical science, 2018, 9, 7986-7991
1549845 CIFC69 H55 Br2 Co N9 O7 S2P 18.6715; 13.689; 15.1994
112.725; 90.764; 106.662		1578.49Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi
Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation.
Chemical science, 2018, 9, 7986-7991
1549846 CIFC69 H59 Br2 Co N9 O9 S2P 18.8606; 13.9125; 14.9455
65.422; 87.897; 71.56		1579.8Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi
Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation.
Chemical science, 2018, 9, 7986-7991
1549847 CIFC69 H55 Br2 Co N9 O7 S2P 18.6306; 13.5529; 15.2106
113.16; 91.252; 106.863		1546.66Shao, Dong; Shi, Le; Yin, Lei; Wang, Bao-Lin; Wang, Zhen-Xing; Zhang, Yi-Quan; Wang, Xin-Yi
Reversible on-off switching of both spin crossover and single-molecule magnet behaviours <i>via</i> a crystal-to-crystal transformation.
Chemical science, 2018, 9, 7986-7991
1549848 CIFC23 H22 Br N O4P 21 21 218.3737; 10.0127; 24.658
90; 90; 90		2067.41Liu, Yang; Liu, Xiangyuan; Li, Jiangtao; Zhao, Xiaowei; Qiao, Baokun; Jiang, Zhiyong
Catalytic enantioselective radical coupling of activated ketones with <i>N</i>-aryl glycines.
Chemical science, 2018, 9, 8094-8098
1549849 CIFC26 H32 N2 O8 SP 16.25857; 10.36; 11.9013
64.561; 87.812; 84.16		693.22Liu, Yang; Liu, Xiangyuan; Li, Jiangtao; Zhao, Xiaowei; Qiao, Baokun; Jiang, Zhiyong
Catalytic enantioselective radical coupling of activated ketones with <i>N</i>-aryl glycines.
Chemical science, 2018, 9, 8094-8098
1549850 CIFC144 Dy12 O64F m -3 m24.8328; 24.8328; 24.8328
90; 90; 90		15313.6Liu, Chong; Eliseeva, Svetlana V.; Luo, Tian-Yi; Muldoon, Patrick F.; Petoud, Stéphane; Rosi, Nathaniel L.
Near infrared excitation and emission in rare earth MOFs <i>via</i> encapsulation of organic dyes.
Chemical science, 2018, 9, 8099-8102
1549851 CIFC42 H24 Dy3 N6 O16F m -3 m29.9107; 29.9107; 29.9107
90; 90; 90		26759.6Liu, Chong; Eliseeva, Svetlana V.; Luo, Tian-Yi; Muldoon, Patrick F.; Petoud, Stéphane; Rosi, Nathaniel L.
Near infrared excitation and emission in rare earth MOFs <i>via</i> encapsulation of organic dyes.
Chemical science, 2018, 9, 8099-8102
1549852 CIFC42 H24 Dy3 O20F m -3 m27.5659; 27.5659; 27.5659
90; 90; 90		20946.7Liu, Chong; Eliseeva, Svetlana V.; Luo, Tian-Yi; Muldoon, Patrick F.; Petoud, Stéphane; Rosi, Nathaniel L.
Near infrared excitation and emission in rare earth MOFs <i>via</i> encapsulation of organic dyes.
Chemical science, 2018, 9, 8099-8102
1549853 CIFC19 H15 Br N2 O3P 1 21/c 110.499; 20.581; 8.367
90; 108.054; 90		1718.9Lovato, Kaitlyn; Guo, Lirong; Xu, Qing-Long; Liu, Fengting; Yousufuddin, Muhammed; Ess, Daniel H.; Kürti, László; Gao, Hongyin
Transition metal-free direct dehydrogenative arylation of activated C(sp<sup>3</sup>)-H bonds: synthetic ambit and DFT reactivity predictions.
Chemical science, 2018, 9, 7992-7999
1549854 CIFC18 H13 F3 N2 O4P 1 21/c 118.29; 10.7507; 9.233
90; 98.659; 90		1794.8Lovato, Kaitlyn; Guo, Lirong; Xu, Qing-Long; Liu, Fengting; Yousufuddin, Muhammed; Ess, Daniel H.; Kürti, László; Gao, Hongyin
Transition metal-free direct dehydrogenative arylation of activated C(sp<sup>3</sup>)-H bonds: synthetic ambit and DFT reactivity predictions.
Chemical science, 2018, 9, 7992-7999
1549855 CIFC21 H33 Cl2 N Si TiP -18.268; 11.8794; 12.9943
71.395; 78.04; 70.734		1134.41Williams, Thomas J.; Buffet, Jean-Charles; Turner, Zoë R.; O'Hare, Dermot
Group 4 permethylindenyl constrained geometry complexes for ethylene polymerisation catalysis
Catalysis Science & Technology, 2018, 8, 5454
1549856 CIFC32 H49 Cl2 N Si TiP -19.966; 12.4507; 15.2615
112.445; 108.902; 90.786		1635.29Williams, Thomas J.; Buffet, Jean-Charles; Turner, Zoë R.; O'Hare, Dermot
Group 4 permethylindenyl constrained geometry complexes for ethylene polymerisation catalysis
Catalysis Science & Technology, 2018, 8, 5454
1549857 CIFC20 H31 Cl2 N Si TiP 1 21/c 111.5225; 12.9843; 15.2891
90; 104.979; 90		2209.7Williams, Thomas J.; Buffet, Jean-Charles; Turner, Zoë R.; O'Hare, Dermot
Group 4 permethylindenyl constrained geometry complexes for ethylene polymerisation catalysis
Catalysis Science & Technology, 2018, 8, 5454
1549858 CIFC23 H26 Ir N O3P b c a16.13031; 14.54437; 17.33703
90; 90; 90		4067.36Pèrez-Miqueo, Jorge; San Nacianceno, Virginia; Urquiola, F. Borja; Freixa, Zoraida
Revisiting the iridacycle-catalyzed hydrosilylation of enolizable imines
Catalysis Science & Technology, 2018, 8, 6316
1549859 CIFC21 H15 N3 O3P 1 21/c 110.2072; 22.8173; 7.0823
90; 90.009; 90		1649.47Das, Deb Kumar; Kumar Pampana, V. Kishore; Hwang, Kuo Chu
Copper catalyzed photoredox synthesis of α-keto esters, quinoxaline, and naphthoquinone: controlled oxidation of terminal alkynes to glyoxals.
Chemical science, 2018, 9, 7318-7326
1549860 CIFC9 H7 N O5P -17.2306; 7.3257; 8.8664
106.573; 100.859; 94.501		437.69Das, Deb Kumar; Kumar Pampana, V. Kishore; Hwang, Kuo Chu
Copper catalyzed photoredox synthesis of α-keto esters, quinoxaline, and naphthoquinone: controlled oxidation of terminal alkynes to glyoxals.
Chemical science, 2018, 9, 7318-7326
1549861 CIFC12 H12 Cu N2 O6P -15.0866; 7.5068; 9.0684
76.038; 85.125; 72.229		319.98Das, Deb Kumar; Kumar Pampana, V. Kishore; Hwang, Kuo Chu
Copper catalyzed photoredox synthesis of α-keto esters, quinoxaline, and naphthoquinone: controlled oxidation of terminal alkynes to glyoxals.
Chemical science, 2018, 9, 7318-7326
1549862 CIFC800.5 H916 Cl20.5 Cu8 N43 O114P -130.0973; 30.8663; 31.9583
91.509; 102.049; 94.109		28934Le Poul, Nicolas; Colasson, Benoit; Thiabaud, Grégory; Dit Fouque, Dany Jeanne; Iacobucci, Claudio; Memboeuf, Antony; Douziech, Bénédicte; Řezáč, Jan; Prangé, Thierry; de la Lande, Aurélien; Reinaud, Olivia; Le Mest, Yves
Gating the electron transfer at a monocopper centre through the supramolecular coordination of water molecules within a protein chamber mimic.
Chemical science, 2018, 9, 8282-8290
1549863 CIFC42 H28 Br2P -19.928; 11.964; 13.33
91.365; 90.705; 93.476		1579.8Kasun, Zachary A.; Sato, Hiroki; Nie, Jing; Mori, Yasuyuki; Bender, Jon A.; Roberts, Sean T.; Krische, Michael J.
Alternating oligo(<i>o</i>,<i>p</i>-phenylenes) <i>via</i> ruthenium catalyzed diol-diene benzannulation: orthogonality to cross-coupling enables <i>de novo</i> nanographene and PAH construction.
Chemical science, 2018, 9, 7866-7873
1549864 CIFC60 H38P -19.859; 13.666; 14.502
91.78; 96.21; 110.33		1816.5Kasun, Zachary A.; Sato, Hiroki; Nie, Jing; Mori, Yasuyuki; Bender, Jon A.; Roberts, Sean T.; Krische, Michael J.
Alternating oligo(<i>o</i>,<i>p</i>-phenylenes) <i>via</i> ruthenium catalyzed diol-diene benzannulation: orthogonality to cross-coupling enables <i>de novo</i> nanographene and PAH construction.
Chemical science, 2018, 9, 7866-7873
1549865 CIFC34.33333 H18.66667 Cl0.66667 S2P 1 21/n 19.2129; 21.272; 36.423
90; 91.73; 90		7135Kasun, Zachary A.; Sato, Hiroki; Nie, Jing; Mori, Yasuyuki; Bender, Jon A.; Roberts, Sean T.; Krische, Michael J.
Alternating oligo(<i>o</i>,<i>p</i>-phenylenes) <i>via</i> ruthenium catalyzed diol-diene benzannulation: orthogonality to cross-coupling enables <i>de novo</i> nanographene and PAH construction.
Chemical science, 2018, 9, 7866-7873
1549866 CIFC25 H35 N O3P -16.74; 11.686; 15.408
80.71; 80.08; 74.51		1143.5Gude, Venkatesh; Rout, Duttanjali; Panigrahi, Mruganka Kumar; Biradha, Kumar
Origin of green photoluminescence in four-ring bent-core molecules with ESIPT, selective sensing of zinc ions by turn-on emission and their liquid crystal properties.
Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 1386-1395
1549867 CIFC35 H36 N2 O6P 1 21/c 16.5854; 61.276; 7.3258
90; 90.629; 90		2956Gude, Venkatesh; Rout, Duttanjali; Panigrahi, Mruganka Kumar; Biradha, Kumar
Origin of green photoluminescence in four-ring bent-core molecules with ESIPT, selective sensing of zinc ions by turn-on emission and their liquid crystal properties.
Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 1386-1395
1549868 CIFC20 H20 Cl N3 O2 PdP 1 21 110.7684; 9.0383; 10.859
90; 118.567; 90		928.22Wu, Xiaolu; Yang, Zhi; Yan, Xinwen; Zhang, Pengfei; Wang, Lin; Guo, Ge; Dong, Yuping; Li, Xiaofang
Polymerization of 1-chloro-2-phenylacetylene by cationic monoanionic tridentate (S,S)-bis(oxazolinylphenyl)amido-ligated palladium catalysts: is it a coordination‒insertion mechanism?
Polymer Chemistry, 2018, 9, 4856
1549869 CIF
HKL
Paper		C25 H47 N O7P 21 21 217.9093; 13.3712; 25.3669
90; 90; 90		2682.72Eitel, Michael; Schollmeyer, Dieter; Gross, Harald; Koch, Pierre
(2<i>S</i>,3<i>S</i>)-2-Azaniumyl-4-[(1<i>S</i>,4a<i>S</i>,4b<i>S</i>,6<i>S</i>,7<i>S</i>,8a<i>S</i>,10a<i>S</i>)-6,7-dihydroxy-2,4b,8,8,10a-pentamethyl-1,4,4a,4b,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-yl]-3-methoxybutanoate‒methanol‒water (1/1/1)
IUCrData, 2018, 3, x181194
1549870 CIF
HKL
Paper		C9 H14 Br4 Co N4C 1 2/c 115.7782; 7.4076; 28.567
90; 95.7271; 90		3322.2Peppel, Tim; Spannenberg, Anke
3,3'-Dimethyl-1,1'-methylenediimidazolium tetrabromidocobaltate(II)
IUCrData, 2018, 3, x181212
1549871 CIF
HKL
Paper		C18 H13 Cl2 N O2P -17.4005; 10.4272; 10.5704
86.076; 72.382; 81.325		768.3Grinev, Vyacheslav S.; Osipov, Alexander K.; Yegorova, Alevtina Yu.
(<i>Z</i>)-3-[(3,5-Dichloroanilino)methylidene]-5-(4-methylphenyl)furan-2(3<i>H</i>)-one
IUCrData, 2018, 3, x181224
1549872 CIF
HKL
Paper		C13 H13 N2 O7P -17.2618; 8.9419; 11.0001
85.545; 86.177; 75.248		687.84Dziuk, Błażej; Jezuita, Anna
2,2'-Bipyridin-1-ium hemioxalate oxalic acid monohydrate
IUCrData, 2018, 3, x181219
1549873 CIFC28 H34 Cl Ir N2P -19.7423; 11.066; 12.1673
100.717; 104.685; 96.543		1228.72Wong, Chin Min; Fekete, Marianna; Nelson-Forde, Rhianna; Gatus, Mark R. D.; Rayner, Peter J.; Whitwood, Adrian C.; Duckett, Simon B.; Messerle, Barbara A.
Harnessing asymmetric N-heterocyclic carbene ligands to optimise SABRE hyperpolarisation.
Catalysis science & technology, 2018, 8, 4925-4933
1549874 CIFC13 H13 N O3P -15.8314; 9.95; 10.2599
71.126; 76.243; 77.203		540.33Glassner, Mathias; Verbraeken, Bart; Jerca, Valentin Victor; Van Hecke, Kristof; Tsanaktsidis, John; Hoogenboom, Richard
Poly(2-oxazoline)s with pendant cubane groups
Polymer Chemistry, 2018, 9, 4840
1549875 CIFC24 H22 Cl N O6P 1 21/c 15.33701; 17.9259; 21.5579
90; 92.9404; 90		2059.74Glassner, Mathias; Verbraeken, Bart; Jerca, Valentin Victor; Van Hecke, Kristof; Tsanaktsidis, John; Hoogenboom, Richard
Poly(2-oxazoline)s with pendant cubane groups
Polymer Chemistry, 2018, 9, 4840
1549876 CIFC13 H14 Cl N O3P b c a9.1082; 10.2539; 25.5319
90; 90; 90		2384.5Glassner, Mathias; Verbraeken, Bart; Jerca, Valentin Victor; Van Hecke, Kristof; Tsanaktsidis, John; Hoogenboom, Richard
Poly(2-oxazoline)s with pendant cubane groups
Polymer Chemistry, 2018, 9, 4840
1549877 CIFC44 H37 Cl4 N6 O1.5R -3 c :H16.521; 16.521; 49.1998
90; 90; 120		11629.6Tashiro, Shohei; Umeki, Tsutomu; Kubota, Ryou; Shionoya, Mitsuhiko
Rational synthesis of benzimidazole[3]arenes by Cu<sup>II</sup>-catalyzed post-macrocyclization transformation.
Chemical science, 2018, 9, 7614-7619
1549878 CIFC44 H32 Cl6 N6C 1 c 15.7565; 25.735; 26.34
90; 91.02; 90		3901.5Tashiro, Shohei; Umeki, Tsutomu; Kubota, Ryou; Shionoya, Mitsuhiko
Rational synthesis of benzimidazole[3]arenes by Cu<sup>II</sup>-catalyzed post-macrocyclization transformation.
Chemical science, 2018, 9, 7614-7619
1549879 CIFC63 H60 N6 O12 S3P -19.9758; 14.1235; 21.6617
98.632; 94.107; 107.17		2861.15Tashiro, Shohei; Umeki, Tsutomu; Kubota, Ryou; Shionoya, Mitsuhiko
Rational synthesis of benzimidazole[3]arenes by Cu<sup>II</sup>-catalyzed post-macrocyclization transformation.
Chemical science, 2018, 9, 7614-7619
1549880 CIFC17 H16 B Cd N8 O5P 1 21/c 19.2198; 14.0236; 15.7941
90; 105.723; 90		1965.69Wen, Tian; Zheng, Yao; Xu, Chaochen; Zhang, Jian; Jaroniec, Mietek; Qiao, Shi-Zhang
A boron imidazolate framework with mechanochromic and electrocatalytic properties
Materials Horizons, 2018, 5, 1151
1549881 CIFC13 H8 Br N O SeP 1 21/n 17.6043; 13.4161; 11.8847
90; 103.676; 90		1178.1Shukla, Rahul; Claiser, Nicolas; Souhassou, Mohamed; Lecomte, Claude; Balkrishna, Shah Jaimin; Kumar, Sangit; Chopra, Deepak
Exploring the simultaneous σ-hole/π-hole bonding characteristics of a Br···π interaction in an ebselen derivative <i>via</i> experimental and theoretical electron-density analysis
IUCrJ, 2018, 5, 647-653
1549882 CIFC19 H18 N2 O2P 1 21/c 111.2477; 15.3784; 9.6298
90; 114.204; 90		1519.25Matsuura, Rei; Jankins, Tanner C.; Hill, David E.; Yang, Kin S.; Gallego, Gary M.; Yang, Shouliang; He, Mingying; Wang, Fen; Marsters, Rohan P.; McAlpine, Indrawan; Engle, Keary M.
Palladium(ii)-catalyzed γ-selective hydroarylation of alkenyl carbonyl compounds with arylboronic acids.
Chemical science, 2018, 9, 8363-8368
1549883 CIFC12 H18 N3 Na O7P 1 21/n 16.5197; 35.222; 7.231
90; 102.838; 90		1619Oldknow, Samuel; Martir, Diego Rota; Pritchard, Victoria E.; Blitz, Mark A.; Fishwick, Colin W. G.; Zysman-Colman, Eli; Hardie, Michaele J.
Structure-switching M<sub>3</sub>L<sub>2</sub> Ir(iii) coordination cages with photo-isomerising azo-aromatic linkers.
Chemical science, 2018, 9, 8150-8159
1549884 CIFC65 H63 N11 O13I 1 2/a 135.5103; 9.6091; 37.3391
90; 103.589; 90		12384.3Oldknow, Samuel; Martir, Diego Rota; Pritchard, Victoria E.; Blitz, Mark A.; Fishwick, Colin W. G.; Zysman-Colman, Eli; Hardie, Michaele J.
Structure-switching M<sub>3</sub>L<sub>2</sub> Ir(iii) coordination cages with photo-isomerising azo-aromatic linkers.
Chemical science, 2018, 9, 8150-8159
1549885 CIFC12 H16 N3 Na O6P -16.1765; 7.0883; 17.5927
88.175; 83.629; 69.716		717.98Oldknow, Samuel; Martir, Diego Rota; Pritchard, Victoria E.; Blitz, Mark A.; Fishwick, Colin W. G.; Zysman-Colman, Eli; Hardie, Michaele J.
Structure-switching M<sub>3</sub>L<sub>2</sub> Ir(iii) coordination cages with photo-isomerising azo-aromatic linkers.
Chemical science, 2018, 9, 8150-8159
1549886 CIFC60 H30 N9 O9P -19.6864; 29.786; 34.468
71.898; 88.532; 89.954		9449.1Oldknow, Samuel; Martir, Diego Rota; Pritchard, Victoria E.; Blitz, Mark A.; Fishwick, Colin W. G.; Zysman-Colman, Eli; Hardie, Michaele J.
Structure-switching M<sub>3</sub>L<sub>2</sub> Ir(iii) coordination cages with photo-isomerising azo-aromatic linkers.
Chemical science, 2018, 9, 8150-8159
1549887 CIFC75 H58 B Br Co F24 P4P 1 21/c 113.2806; 27.575; 20.326
90; 99.632; 90		7338.7Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D.
Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N).
Chemical science, 2018, 9, 8234-8241
1549888 CIFC84 H67 B Co F24 P4P -113.0252; 17.6478; 18.721
103.179; 108.177; 99.43		3850.3Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D.
Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N).
Chemical science, 2018, 9, 8234-8241
1549889 CIFC79 H60 B Co F24.5 P4 SP -115.234; 17.698; 18.812
107.508; 101.067; 114.08		4117.5Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D.
Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N).
Chemical science, 2018, 9, 8234-8241
1549890 CIFC79 H54 B Co F24 O P3P 1 21/n 114.313; 28.967; 18.3198
90; 104.992; 90		7336.9Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D.
Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N).
Chemical science, 2018, 9, 8234-8241
1549891 CIFC86 H70 B Co F24 P3P -115.392; 16.404; 17.511
72.538; 72.836; 86.072		4028.8Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D.
Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N).
Chemical science, 2018, 9, 8234-8241
1549892 CIFC80.5 H65 B Co F24 N P3P -112.6883; 18.4229; 18.5758
115.784; 99.469; 97.331		3758.4Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D.
Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N).
Chemical science, 2018, 9, 8234-8241
1549893 CIFC77.75 H61.5 B Co F24.12 N P4P 1 21/n 118.5988; 21.2082; 18.9102
90; 90.121; 90		7459.1Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D.
Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N).
Chemical science, 2018, 9, 8234-8241
1549894 CIFC75 H58 B Co F24 O P4P -113.183; 16.54; 16.808
82.81; 83.316; 84.81		3600.7Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D.
Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N).
Chemical science, 2018, 9, 8234-8241
1549895 CIFC75 H59 B Co F24 P4P 1 21/c 111.8224; 19.1322; 33.4483
90; 97.5642; 90		7499.8Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D.
Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N).
Chemical science, 2018, 9, 8234-8241
1549896 CIFC81 H64 B Co F25 O P4P -114.706; 15.1357; 19.031
71.3492; 83.8715; 80.5636		3952.6Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D.
Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N).
Chemical science, 2018, 9, 8234-8241
1549897 CIFC83 H64 B Co F24 P4P 1 21/n 116.2021; 25.658; 18.5436
90; 90.185; 90		7708.8Sung, Simon; Wang, Qingyang; Krämer, Tobias; Young, Rowan D.
Synthesis and reactivity of a PC<sub>carbene</sub>P cobalt(i) complex: the missing link in the cobalt PXP pincer series (X = B, C, N).
Chemical science, 2018, 9, 8234-8241
1549898 CIF
HKL
Paper		C22 H36 N2P 1 21/n 15.6271; 21.1764; 8.2787
90; 105.86; 90		948.95Grace, P. Selvarathy; Nirmalram, Jeyaraman Selvaraj; Nayagam, B. Ravindran Durai; Schollmeyer, Dieter
1,1'-[(2,3,5,6-Tetramethyl-1,4-phenylene)bis(methylene)]dipiperidine
IUCrData, 2018, 3, x181237
1549899 CIF
HKL
Paper		C15 H14 N4 O3P 15.859; 7.479; 16.329
93.818; 91.29; 94.252		711.7Wang, Zhaodong; Ni, Haitao
Methyl 4-{<i>N</i>'-[(1<i>E</i>)-1-(pyrazin-2-yl)ethylidene]hydrazinecarbonyl}benzoate
IUCrData, 2018, 3, x181230
1549900 CIFO2 Ta0.5 Ti0.25 Zn0.25P 42/m n m4.6987; 4.6987; 9.1296
90; 90; 90		201.56Kumada, N.; Nakanome, K.; Yanagida, S.; Takei, T.; Fujii, I.; Wada, S.; Moriyoshi, C.; Kuroiwa, Y.
Crystal structure, photocatalytic and dielectric property of ATiM2O8 (A: Mg, Zn; M: Nb, Ta)
Journal of Asian Ceramic Societies, 2018, 6, 247-253
1549901 CIFNb0.5 O2 Ti0.25 Zn0.25P b c n4.67138; 5.65916; 5.00745
90; 90; 90		132.377Kumada, N.; Nakanome, K.; Yanagida, S.; Takei, T.; Fujii, I.; Wada, S.; Moriyoshi, C.; Kuroiwa, Y.
Crystal structure, photocatalytic and dielectric property of ATiM2O8 (A: Mg, Zn; M: Nb, Ta)
Journal of Asian Ceramic Societies, 2018, 6, 247-253
1549902 CIFMg0.25 Nb0.5 O2 Ti0.25P 42/m n m4.69585; 4.69585; 3.0426
90; 90; 90		67.092Kumada, N.; Nakanome, K.; Yanagida, S.; Takei, T.; Fujii, I.; Wada, S.; Moriyoshi, C.; Kuroiwa, Y.
Crystal structure, photocatalytic and dielectric property of ATiM2O8 (A: Mg, Zn; M: Nb, Ta)
Journal of Asian Ceramic Societies, 2018, 6, 247-253
1549903 CIFMg0.25 O2 Ta0.5 Ti0.25P 42/m n m4.6876; 4.6876; 9.1385
90; 90; 90		200.806Kumada, N.; Nakanome, K.; Yanagida, S.; Takei, T.; Fujii, I.; Wada, S.; Moriyoshi, C.; Kuroiwa, Y.
Crystal structure, photocatalytic and dielectric property of ATiM2O8 (A: Mg, Zn; M: Nb, Ta)
Journal of Asian Ceramic Societies, 2018, 6, 247-253
1549904 CIFC17 H21 N O2 SP -17.4134; 8.4142; 12.1239
84.72; 88.99; 84.549		749.62Llorente, Nuria; Fernández-Pérez, Héctor; Bauzá, Antonio; Frontera, Antonio; Vidal-Ferran, Anton
Ni-Catalysed Intramolecular [4+4]-cycloadditions of bis-dienes towards eight-membered fused bicyclic systems: a combined experimental and computational study
Catalysis Science & Technology, 2018, 8, 5251
1549905 CIFC16 H22 O4P -16.2605; 9.8392; 12.7844
67.7938; 88.4599; 84.1325		725.21Llorente, Nuria; Fernández-Pérez, Héctor; Bauzá, Antonio; Frontera, Antonio; Vidal-Ferran, Anton
Ni-Catalysed Intramolecular [4+4]-cycloadditions of bis-dienes towards eight-membered fused bicyclic systems: a combined experimental and computational study
Catalysis Science & Technology, 2018, 8, 5251
1549906 CIFC22 H18 N2P 21 21 217.652; 14.111; 15.379
90; 90; 90		1661Kawada, Yuiki; Ohmura, Shunsuke; Kobayashi, Misaki; Nojo, Wataru; Kondo, Masaki; Matsuda, Yuka; Matsuoka, Junpei; Inuki, Shinsuke; Oishi, Shinya; Wang, Chao; Saito, Tatsuo; Uchiyama, Masanobu; Suzuki, Takanori; Ohno, Hiroaki
Direct synthesis of aryl-annulated [<i>c</i>]carbazoles by gold(i)-catalysed cascade reaction of azide-diynes and arenes.
Chemical science, 2018, 9, 8416-8425
1549907 CIFC26 H20 N2P -115.147; 15.449; 16.488
82.861; 80.898; 78.48		3716Kawada, Yuiki; Ohmura, Shunsuke; Kobayashi, Misaki; Nojo, Wataru; Kondo, Masaki; Matsuda, Yuka; Matsuoka, Junpei; Inuki, Shinsuke; Oishi, Shinya; Wang, Chao; Saito, Tatsuo; Uchiyama, Masanobu; Suzuki, Takanori; Ohno, Hiroaki
Direct synthesis of aryl-annulated [<i>c</i>]carbazoles by gold(i)-catalysed cascade reaction of azide-diynes and arenes.
Chemical science, 2018, 9, 8416-8425
1549908 CIFC22 H18 N2P n a 2113.252; 5.704; 42.601
90; 90; 90		3220Kawada, Yuiki; Ohmura, Shunsuke; Kobayashi, Misaki; Nojo, Wataru; Kondo, Masaki; Matsuda, Yuka; Matsuoka, Junpei; Inuki, Shinsuke; Oishi, Shinya; Wang, Chao; Saito, Tatsuo; Uchiyama, Masanobu; Suzuki, Takanori; Ohno, Hiroaki
Direct synthesis of aryl-annulated [<i>c</i>]carbazoles by gold(i)-catalysed cascade reaction of azide-diynes and arenes.
Chemical science, 2018, 9, 8416-8425
1549909 CIFC33 H50.5 Ce0.5 N3 O1.5P 1 21/c 118.8567; 20.0714; 19.2011
90; 102.741; 90		7088.3Arnold, Polly L.; Kerr, Ryan W. F.; Weetman, Catherine; Docherty, Scott R.; Rieb, Julia; Cruickshank, Faye L.; Wang, Kai; Jandl, Christian; McMullon, Max W.; Pöthig, Alexander; Kühn, Fritz E; Smith, Andrew D.
Selective and catalytic carbon dioxide and heteroallene activation mediated by cerium N-heterocyclic carbene complexes.
Chemical science, 2018, 9, 8035-8045
1549910 CIFC62 H100 Br4 Ce2 Li2 N6 O4P 1 21/n 114.083; 17.4883; 15.0209
90; 99.155; 90		3652.34Arnold, Polly L.; Kerr, Ryan W. F.; Weetman, Catherine; Docherty, Scott R.; Rieb, Julia; Cruickshank, Faye L.; Wang, Kai; Jandl, Christian; McMullon, Max W.; Pöthig, Alexander; Kühn, Fritz E; Smith, Andrew D.
Selective and catalytic carbon dioxide and heteroallene activation mediated by cerium N-heterocyclic carbene complexes.
Chemical science, 2018, 9, 8035-8045
1549911 CIFC70 H105 Ce N8 O3 S2P 1 21/c 116.491; 25.6698; 18.9736
90; 100.574; 90		7895.5Arnold, Polly L.; Kerr, Ryan W. F.; Weetman, Catherine; Docherty, Scott R.; Rieb, Julia; Cruickshank, Faye L.; Wang, Kai; Jandl, Christian; McMullon, Max W.; Pöthig, Alexander; Kühn, Fritz E; Smith, Andrew D.
Selective and catalytic carbon dioxide and heteroallene activation mediated by cerium N-heterocyclic carbene complexes.
Chemical science, 2018, 9, 8035-8045
1549912 CIFC77 H93 Ce N6 O9P -117.1931; 18.0941; 18.142
60.078; 63.808; 83.013		4353.9Arnold, Polly L.; Kerr, Ryan W. F.; Weetman, Catherine; Docherty, Scott R.; Rieb, Julia; Cruickshank, Faye L.; Wang, Kai; Jandl, Christian; McMullon, Max W.; Pöthig, Alexander; Kühn, Fritz E; Smith, Andrew D.
Selective and catalytic carbon dioxide and heteroallene activation mediated by cerium N-heterocyclic carbene complexes.
Chemical science, 2018, 9, 8035-8045
1549913 CIFC76 H99 Ce N6 O9P -115.9574; 17.7857; 17.8098
62.686; 69.389; 77.518		4194.6Arnold, Polly L.; Kerr, Ryan W. F.; Weetman, Catherine; Docherty, Scott R.; Rieb, Julia; Cruickshank, Faye L.; Wang, Kai; Jandl, Christian; McMullon, Max W.; Pöthig, Alexander; Kühn, Fritz E; Smith, Andrew D.
Selective and catalytic carbon dioxide and heteroallene activation mediated by cerium N-heterocyclic carbene complexes.
Chemical science, 2018, 9, 8035-8045
1549914 CIFC84 H105 Ce N6 O3P 1 21/c 112.6458; 24.6116; 24.4523
90; 93.8; 90		7593.6Arnold, Polly L.; Kerr, Ryan W. F.; Weetman, Catherine; Docherty, Scott R.; Rieb, Julia; Cruickshank, Faye L.; Wang, Kai; Jandl, Christian; McMullon, Max W.; Pöthig, Alexander; Kühn, Fritz E; Smith, Andrew D.
Selective and catalytic carbon dioxide and heteroallene activation mediated by cerium N-heterocyclic carbene complexes.
Chemical science, 2018, 9, 8035-8045
1549915 CIFC72 H44 Au4 Fe2 N12C 1 c 133.2202; 13.2404; 15.202
90; 113.392; 90		6137Delgado, Teresa; Meneses-Sánchez, Manuel; Piñeiro-López, Lucía; Bartual-Murgui, Carlos; Muñoz, M Carmen; Real, José Antonio
Thermo- and photo-modulation of exciplex fluorescence in a 3D spin crossover Hofmann-type coordination polymer.
Chemical science, 2018, 9, 8446-8452
1549916 CIFC72 H44 Au4 N12 Zn2C 1 c 133.4492; 13.0989; 16.2467
90; 112.538; 90		6574.8Delgado, Teresa; Meneses-Sánchez, Manuel; Piñeiro-López, Lucía; Bartual-Murgui, Carlos; Muñoz, M Carmen; Real, José Antonio
Thermo- and photo-modulation of exciplex fluorescence in a 3D spin crossover Hofmann-type coordination polymer.
Chemical science, 2018, 9, 8446-8452
1549917 CIFC72 H44 Au4 Fe2 N12C 1 c 133.557; 13.117; 16.174
90; 112.407; 90		6581.8Delgado, Teresa; Meneses-Sánchez, Manuel; Piñeiro-López, Lucía; Bartual-Murgui, Carlos; Muñoz, M Carmen; Real, José Antonio
Thermo- and photo-modulation of exciplex fluorescence in a 3D spin crossover Hofmann-type coordination polymer.
Chemical science, 2018, 9, 8446-8452
1549918 CIFC72 H44 Au4 N12 Zn2C 1 c 133.219; 12.9438; 16.3125
90; 111.934; 90		6506.3Delgado, Teresa; Meneses-Sánchez, Manuel; Piñeiro-López, Lucía; Bartual-Murgui, Carlos; Muñoz, M Carmen; Real, José Antonio
Thermo- and photo-modulation of exciplex fluorescence in a 3D spin crossover Hofmann-type coordination polymer.
Chemical science, 2018, 9, 8446-8452
1549919 CIFC23 H16 N4 O SP 21 21 217.8612; 9.8518; 27.1605
90; 90; 90		2103.5Wang, Chunfei; Cheng, Xiaoxiang; Tan, Jingyun; Ding, Zhaoyang; Wang, Wenjing; Yuan, Daqiang; Li, Gang; Zhang, Hongjie; Zhang, Xuanjun
Reductive cleavage of C[double bond, length as m-dash]C bonds as a new strategy for turn-on dual fluorescence in effective sensing of H<sub>2</sub>S.
Chemical science, 2018, 9, 8369-8374
1549920 CIFC17 H10 N3 S2P 1 21 18.7916; 5.6255; 14.7562
90; 95.407; 90		726.55Wang, Chunfei; Cheng, Xiaoxiang; Tan, Jingyun; Ding, Zhaoyang; Wang, Wenjing; Yuan, Daqiang; Li, Gang; Zhang, Hongjie; Zhang, Xuanjun
Reductive cleavage of C[double bond, length as m-dash]C bonds as a new strategy for turn-on dual fluorescence in effective sensing of H<sub>2</sub>S.
Chemical science, 2018, 9, 8369-8374
1549921 CIFC13 H17 N3 O4P -18.098; 10.0379; 10.4154
116.381; 111.697; 92.496		682.41Mallo, Neil; Foley, Eric D.; Iranmanesh, Hasti; Kennedy, Aaron D. W.; Luis, Ena T.; Ho, Junming; Harper, Jason B.; Beves, Jonathon E.
Structure-function relationships of donor-acceptor Stenhouse adduct photochromic switches.
Chemical science, 2018, 9, 8242-8252
1549922 CIFC19 H21 N3 O5P -16.695; 10.327; 13.555
107.4; 92.61; 102.79		865.8Mallo, Neil; Foley, Eric D.; Iranmanesh, Hasti; Kennedy, Aaron D. W.; Luis, Ena T.; Ho, Junming; Harper, Jason B.; Beves, Jonathon E.
Structure-function relationships of donor-acceptor Stenhouse adduct photochromic switches.
Chemical science, 2018, 9, 8242-8252
1549923 CIFC15 H19 N3 O4P 1 21/c 19.999; 17.469; 8.521
90; 98.76; 90		1471Mallo, Neil; Foley, Eric D.; Iranmanesh, Hasti; Kennedy, Aaron D. W.; Luis, Ena T.; Ho, Junming; Harper, Jason B.; Beves, Jonathon E.
Structure-function relationships of donor-acceptor Stenhouse adduct photochromic switches.
Chemical science, 2018, 9, 8242-8252
1549924 CIFC14 H23 N3 O6P 1 21/n 18.789; 10.706; 17.342
90; 99.97; 90		1607.2Mallo, Neil; Foley, Eric D.; Iranmanesh, Hasti; Kennedy, Aaron D. W.; Luis, Ena T.; Ho, Junming; Harper, Jason B.; Beves, Jonathon E.
Structure-function relationships of donor-acceptor Stenhouse adduct photochromic switches.
Chemical science, 2018, 9, 8242-8252
1549925 CIFC11 H10 N2 O4P 1 21/n 112.8188; 6.1493; 13.1714
90; 99.328; 90		1024.53Mallo, Neil; Foley, Eric D.; Iranmanesh, Hasti; Kennedy, Aaron D. W.; Luis, Ena T.; Ho, Junming; Harper, Jason B.; Beves, Jonathon E.
Structure-function relationships of donor-acceptor Stenhouse adduct photochromic switches.
Chemical science, 2018, 9, 8242-8252
1549926 CIFC24 H31 N3 O5P 1 21/c 111.8801; 9.9317; 20.246
90; 104.31; 90		2314.7Mallo, Neil; Foley, Eric D.; Iranmanesh, Hasti; Kennedy, Aaron D. W.; Luis, Ena T.; Ho, Junming; Harper, Jason B.; Beves, Jonathon E.
Structure-function relationships of donor-acceptor Stenhouse adduct photochromic switches.
Chemical science, 2018, 9, 8242-8252
1549927 CIFC20 H21 Cl3 D N3 O5P 1 21/n 16.747; 22.937; 13.927
90; 90.66; 90		2155.1Mallo, Neil; Foley, Eric D.; Iranmanesh, Hasti; Kennedy, Aaron D. W.; Luis, Ena T.; Ho, Junming; Harper, Jason B.; Beves, Jonathon E.
Structure-function relationships of donor-acceptor Stenhouse adduct photochromic switches.
Chemical science, 2018, 9, 8242-8252
1549928 CIFC19 H28 N3 O7.5P 1 21/c 111.253; 15.863; 22.909
90; 99.957; 90		4027.8Mallo, Neil; Foley, Eric D.; Iranmanesh, Hasti; Kennedy, Aaron D. W.; Luis, Ena T.; Ho, Junming; Harper, Jason B.; Beves, Jonathon E.
Structure-function relationships of donor-acceptor Stenhouse adduct photochromic switches.
Chemical science, 2018, 9, 8242-8252
1549929 CIFC15.5 H20.27 Cl N3 O4.64P -110.42; 13.2; 13.9
89.03; 85.92; 75.68		1847.8Mallo, Neil; Foley, Eric D.; Iranmanesh, Hasti; Kennedy, Aaron D. W.; Luis, Ena T.; Ho, Junming; Harper, Jason B.; Beves, Jonathon E.
Structure-function relationships of donor-acceptor Stenhouse adduct photochromic switches.
Chemical science, 2018, 9, 8242-8252
1549930 CIFC642 H612 Cl12 Co48 N72 O126 S48R -3 :H37.232; 37.232; 80.093
90; 90; 120		96152Geng, Dantong; Han, Xu; Bi, Yanfeng; Qin, Yucai; Li, Qiang; Huang, Liangliang; Zhou, Kun; Song, Lijuan; Zheng, Zhiping
Merohedral icosahedral M<sub>48</sub> (M = Co<sup>II</sup>, Ni<sup>II</sup>) cage clusters supported by thiacalix[4]arene.
Chemical science, 2018, 9, 8535-8541
1549931 CIFC642 H612 Cl12 N72 Ni48 O126 S48R -3 :H37.799; 37.799; 86.192
90; 90; 120		106649Geng, Dantong; Han, Xu; Bi, Yanfeng; Qin, Yucai; Li, Qiang; Huang, Liangliang; Zhou, Kun; Song, Lijuan; Zheng, Zhiping
Merohedral icosahedral M<sub>48</sub> (M = Co<sup>II</sup>, Ni<sup>II</sup>) cage clusters supported by thiacalix[4]arene.
Chemical science, 2018, 9, 8535-8541
1549932 CIFC18 H17 N O3P -18.596; 9.3242; 9.5215
101.132; 103.244; 96.071		719.84Li, Shuai-Shuai; Lv, Xintong; Ren, Didi; Shao, Chang-Lun; Liu, Qing; Xiao, Jian
Redox-triggered cascade dearomative cyclizations enabled by hexafluoroisopropanol.
Chemical science, 2018, 9, 8253-8259
1549933 CIFC49 H50 N6 O YP 1 2/n 122.637; 9.781; 23.089
90; 118.062; 90		4511Zhang, Dexing; Liu, Ruiting; Zhou, Xigeng
Intramolecular alkene hydroamination and degradation of amidines: divergent behavior of rare earth metal amidinate intermediates
Catalysis Science & Technology, 2018, 8, 5573
1549934 CIFC114 H108 N16 O12P 1 2/c 126.0567; 14.2086; 28.6868
90; 94.091; 90		10593.6Qu, Hang; Tang, Xiao; Wang, Xinchang; Li, Zhihao; Huang, Zheyu; Zhang, Hui; Tian, Zhongqun; Cao, Xiaoyu
Chiral molecular face-rotating sandwich structures constructed through restricting the phenyl flipping of tetraphenylethylene.
Chemical science, 2018, 9, 8814-8818
1549935 CIFC114 H108 N16 O12P c c n19.0205; 20.3813; 30.1755
90; 90; 90		11697.9Qu, Hang; Tang, Xiao; Wang, Xinchang; Li, Zhihao; Huang, Zheyu; Zhang, Hui; Tian, Zhongqun; Cao, Xiaoyu
Chiral molecular face-rotating sandwich structures constructed through restricting the phenyl flipping of tetraphenylethylene.
Chemical science, 2018, 9, 8814-8818
1549936 CIFC20 H26 Cu F18 N8 O P3C 1 2/m 122.923; 11.8528; 15.482
90; 127.476; 90		3338.3Ghavami, Zohreh S.; Anneser, Markus R.; Kaiser, Felix; Altmann, Philipp J.; Hofmann, Benjamin J.; Schlagintweit, Jonas F.; Grivani, Gholamhossein; Kühn, Fritz E
A bench stable formal Cu(iii) <i>N</i>-heterocyclic carbene accessible from simple copper(ii) acetate.
Chemical science, 2018, 9, 8307-8314
1549937 CIFC42 H59 Cu4 F24 N17 O4 P4 S4C 1 c 126.95; 11.628; 21.3978
90; 90.293; 90		6705.4Ghavami, Zohreh S.; Anneser, Markus R.; Kaiser, Felix; Altmann, Philipp J.; Hofmann, Benjamin J.; Schlagintweit, Jonas F.; Grivani, Gholamhossein; Kühn, Fritz E
A bench stable formal Cu(iii) <i>N</i>-heterocyclic carbene accessible from simple copper(ii) acetate.
Chemical science, 2018, 9, 8307-8314
1549938 CIFC22 H28 F18 N11 O P3P -110.1257; 12.8486; 14.7435
110.335; 96.001; 97.292		1761.1Ghavami, Zohreh S.; Anneser, Markus R.; Kaiser, Felix; Altmann, Philipp J.; Hofmann, Benjamin J.; Schlagintweit, Jonas F.; Grivani, Gholamhossein; Kühn, Fritz E
A bench stable formal Cu(iii) <i>N</i>-heterocyclic carbene accessible from simple copper(ii) acetate.
Chemical science, 2018, 9, 8307-8314
1549939 CIFC37 H36 Cl4 Cu3 F9 N16 O11 S3P 1 21/n 113.8276; 17.576; 22.488
90; 97.359; 90		5420.3Ghavami, Zohreh S.; Anneser, Markus R.; Kaiser, Felix; Altmann, Philipp J.; Hofmann, Benjamin J.; Schlagintweit, Jonas F.; Grivani, Gholamhossein; Kühn, Fritz E
A bench stable formal Cu(iii) <i>N</i>-heterocyclic carbene accessible from simple copper(ii) acetate.
Chemical science, 2018, 9, 8307-8314
1549940 CIFC15 H11 F O2I 1 2/a 113.2572; 5.1221; 16.7741
90; 97.5575; 90		1129.15Rozatian, Neshat; Ashworth, Ian W.; Sandford, Graham; Hodgson, David R. W.
A quantitative reactivity scale for electrophilic fluorinating reagents.
Chemical science, 2018, 9, 8692-8702
1549941 CIFC17 H15 F O2C 1 2/c 111.1604; 11.7655; 10.819
90; 114.318; 90		1294.57Rozatian, Neshat; Ashworth, Ian W.; Sandford, Graham; Hodgson, David R. W.
A quantitative reactivity scale for electrophilic fluorinating reagents.
Chemical science, 2018, 9, 8692-8702
1549942 CIFC17 H15 F O2P 1 21/c 18.5592; 12.9739; 12.3376
90; 102.407; 90		1338.05Rozatian, Neshat; Ashworth, Ian W.; Sandford, Graham; Hodgson, David R. W.
A quantitative reactivity scale for electrophilic fluorinating reagents.
Chemical science, 2018, 9, 8692-8702
1549943 CIFC15 H9 F3 O2P 1 21 14.3647; 11.5018; 12.3118
90; 94.065; 90		616.52Rozatian, Neshat; Ashworth, Ian W.; Sandford, Graham; Hodgson, David R. W.
A quantitative reactivity scale for electrophilic fluorinating reagents.
Chemical science, 2018, 9, 8692-8702
1549944 CIFC15 H9 Cl2 F O2P n m a6.0944; 30.676; 6.881
90; 90; 90		1286.4Rozatian, Neshat; Ashworth, Ian W.; Sandford, Graham; Hodgson, David R. W.
A quantitative reactivity scale for electrophilic fluorinating reagents.
Chemical science, 2018, 9, 8692-8702
1549945 CIFC17 H15 F O4C m c 2131.944; 7.0229; 6.1827
90; 90; 90		1387.02Rozatian, Neshat; Ashworth, Ian W.; Sandford, Graham; Hodgson, David R. W.
A quantitative reactivity scale for electrophilic fluorinating reagents.
Chemical science, 2018, 9, 8692-8702
1549946 CIFC15 H9 F3 O2C 1 2/c 128.403; 6.1029; 6.9953
90; 102.753; 90		1182.66Rozatian, Neshat; Ashworth, Ian W.; Sandford, Graham; Hodgson, David R. W.
A quantitative reactivity scale for electrophilic fluorinating reagents.
Chemical science, 2018, 9, 8692-8702
1549947 CIFC10 H12 N2P c a m8.99566; 21.5226; 9.8982
90; 90; 90		1916.39Zuñiga, Fco. Javier; Cruz-Cabeza, Aurora J.; Aretxabaleta, Xabier M.; de la Pinta, Noelia; Breczewski, Tomasz; Quesada-Moreno, María Mar; Avilés-Moreno, Juan Ramón; López-González, Juan Jesús; Claramunt, Rosa M.; Elguero, Jose
Conformational aspects of polymorphs and phases of 2-propyl-1<i>H</i>-benzimidazole
IUCrJ, 2018, 5
1549948 CIFC10 H12 N2P c a 219.0006; 20.7778; 9.7487
90; 90; 90		1823.13Zuñiga, Fco. Javier; Cruz-Cabeza, Aurora J.; Aretxabaleta, Xabier M.; de la Pinta, Noelia; Breczewski, Tomasz; Quesada-Moreno, María Mar; Avilés-Moreno, Juan Ramón; López-González, Juan Jesús; Claramunt, Rosa M.; Elguero, Jose
Conformational aspects of polymorphs and phases of 2-propyl-1<i>H</i>-benzimidazole
IUCrJ, 2018, 5
1549949 CIFC10 H12 N2P n a 218.6825; 42.095; 9.7523
90; 90; 90		3564.4Zuñiga, Fco. Javier; Cruz-Cabeza, Aurora J.; Aretxabaleta, Xabier M.; de la Pinta, Noelia; Breczewski, Tomasz; Quesada-Moreno, María Mar; Avilés-Moreno, Juan Ramón; López-González, Juan Jesús; Claramunt, Rosa M.; Elguero, Jose
Conformational aspects of polymorphs and phases of 2-propyl-1<i>H</i>-benzimidazole
IUCrJ, 2018, 5
1549950 CIF
HKL
Paper		C20 H19 N O2P 1 21/c 19.362; 11.6073; 15.0732
90; 98.859; 90		1618.43Biruntha, K.; Reuben Jonathan, D.; Mohamooda Sumaya, U.; Dravida Thendral, E. R. A.; Usha, G.
Crystal structure of (3<i>E</i>)-3-{(2<i>E</i>)-3-[4-(dimethylamino)phenyl]prop-2-enylidene}-3,4-dihydro-2<i>H</i>-chromen-4-one
IUCrData, 2018, 3, x181273
1549951 CIF
HKL
Paper		C17 H24 N2 O SP 1 21/n 112.0255; 8.9303; 15.8822
90; 95.813; 90		1696.84Al Garadi, Wedad; Ramli, Youssef; El Ghayati, Lhoussaine; El Hafi, Mohamed; Moussaif, Ahmed; Essassi, El Mokhtar; Mague, Joel T.
4-Phenyl-2,5,5a,6,7,8,9,9a-hexahydro-1<i>H</i>-1,5-benzodiazepine-2-thione ethanol monosolvate
IUCrData, 2018, 3, x181276
1549952 CIF
HKL
Paper		C21 H16 O4P -17.9937; 9.3819; 12.2131
72.552; 86.895; 67.288		804.06Sung, Jiha
6-Methoxy-2-(2-methoxynaphthalen-1-yl)-4<i>H</i>-chromen-4-one
IUCrData, 2018, 3, x181277
1549953 CIFC18 H15 Au Cl SbP 21 21 2110.9035; 11.9862; 12.6785
90; 90; 90		1656.97Li, Ying-Zhou; Ganguly, Rakesh; Hong, Kar Yiu; Li, Yongxin; Tessensohn, Malcolm Eugene; Webster, Richard; Leong, Weng Kee
Stibine-protected Au<sub>13</sub> nanoclusters: syntheses, properties and facile conversion to GSH-protected Au<sub>25</sub> nanocluster.
Chemical science, 2018, 9, 8723-8730
1549954 CIFC45.6 H51 Au2 Cl2 O0.9 Sb2P 1 21 112.1481; 29.298; 12.605
90; 94.0574; 90		4475.1Li, Ying-Zhou; Ganguly, Rakesh; Hong, Kar Yiu; Li, Yongxin; Tessensohn, Malcolm Eugene; Webster, Richard; Leong, Weng Kee
Stibine-protected Au<sub>13</sub> nanoclusters: syntheses, properties and facile conversion to GSH-protected Au<sub>25</sub> nanocluster.
Chemical science, 2018, 9, 8723-8730
1549955 CIFC85.25 H73.25 Au Cl6 Sb5P 1 21/c 118.6854; 14.9411; 28.657
90; 97.503; 90		7932Li, Ying-Zhou; Ganguly, Rakesh; Hong, Kar Yiu; Li, Yongxin; Tessensohn, Malcolm Eugene; Webster, Richard; Leong, Weng Kee
Stibine-protected Au<sub>13</sub> nanoclusters: syntheses, properties and facile conversion to GSH-protected Au<sub>25</sub> nanocluster.
Chemical science, 2018, 9, 8723-8730
1549956 CIFC169 H142 Au13 B Cl6 Sb8P 1 21/c 116.7528; 46.762; 22.2312
90; 96.6202; 90		17299.7Li, Ying-Zhou; Ganguly, Rakesh; Hong, Kar Yiu; Li, Yongxin; Tessensohn, Malcolm Eugene; Webster, Richard; Leong, Weng Kee
Stibine-protected Au<sub>13</sub> nanoclusters: syntheses, properties and facile conversion to GSH-protected Au<sub>25</sub> nanocluster.
Chemical science, 2018, 9, 8723-8730
1549957 CIFC77 H77 Au Cl2 Sb4P 1 2/c 124.5859; 11.8194; 26.9019
90; 116.277; 90		7009.6Li, Ying-Zhou; Ganguly, Rakesh; Hong, Kar Yiu; Li, Yongxin; Tessensohn, Malcolm Eugene; Webster, Richard; Leong, Weng Kee
Stibine-protected Au<sub>13</sub> nanoclusters: syntheses, properties and facile conversion to GSH-protected Au<sub>25</sub> nanocluster.
Chemical science, 2018, 9, 8723-8730
1549958 CIFC30 H46 F6 N8 Ni2 O4 S2C 1 2/c 123.2608; 10.7528; 17.423
90; 117.976; 90		3848.6Truong, Phan T.; Broering, Ellen P.; Dzul, Stephen P.; Chakraborty, Indranil; Stemmler, Timothy L.; Harrop, Todd C.
Simultaneous nitrosylation and N-nitrosation of a Ni-thiolate model complex of Ni-containing SOD.
Chemical science, 2018, 9, 8567-8574
1549959 CIFC63 H88 F12 N12 Ni2 O5 S4P -113.3985; 16.8518; 18.0347
112.816; 92.719; 91.167		3745.9Truong, Phan T.; Broering, Ellen P.; Dzul, Stephen P.; Chakraborty, Indranil; Stemmler, Timothy L.; Harrop, Todd C.
Simultaneous nitrosylation and N-nitrosation of a Ni-thiolate model complex of Ni-containing SOD.
Chemical science, 2018, 9, 8567-8574
1549960 CIFC54 H74 Fe2 N4 P3C 1 2/c 122.1222; 15.3352; 15.7519
90; 92.864; 90		5337.1Yao, Shenglai; Forstner, Viktoria; Menezes, Prashanth W.; Panda, Chakadola; Mebs, Stefan; Zolnhofer, Eva M.; Miehlich, Matthias E.; Szilvási, Tibor; Ashok Kumar, Nanjundan; Haumann, Michael; Meyer, Karsten; Grützmacher, Hansjörg; Driess, Matthias
From an Fe<sub>2</sub>P<sub>3</sub> complex to FeP nanoparticles as efficient electrocatalysts for water-splitting.
Chemical science, 2018, 9, 8590-8597
1549961 CIFC164 H244 Fe4 K2 N8 O14 P6C 1 2/m 118.0839; 18.8962; 13.6307
90; 115.729; 90		4196.05Yao, Shenglai; Forstner, Viktoria; Menezes, Prashanth W.; Panda, Chakadola; Mebs, Stefan; Zolnhofer, Eva M.; Miehlich, Matthias E.; Szilvási, Tibor; Ashok Kumar, Nanjundan; Haumann, Michael; Meyer, Karsten; Grützmacher, Hansjörg; Driess, Matthias
From an Fe<sub>2</sub>P<sub>3</sub> complex to FeP nanoparticles as efficient electrocatalysts for water-splitting.
Chemical science, 2018, 9, 8590-8597
1549962 CIFC34 H24 N4 O8C 1 c 124.7983; 10.6757; 12.3066
90; 101.737; 90		3189.92Schierl, Christoph; Niazov-Elkan, Angelica; Shimon, Linda J. W.; Feldman, Yishay; Rybtchinski, Boris; Guldi, Dirk M.
Singlet fission in self-assembled PDI nanocrystals.
Nanoscale, 2018, 10, 20147-20154
1549963 CIFC23 H16 Cl N3 O3P 21 21 2111.0105; 11.0264; 15.8268
90; 90; 90		1921.47Chen, Qiao; Zhu, Tingshun; Majhi, Pankaj Kumar; Mou, Chengli; Chai, Huifang; Zhang, Jingjie; Zhuo, Shitian; Chi, Yonggui Robin
Carbene-catalyzed enantioselective oxidative coupling of enals and di(hetero)arylmethanes.
Chemical science, 2018, 9, 8711-8715
1549964 CIFC23 H16 Br N3 O3P 1 21 15.7355; 16.4707; 10.5767
90; 105.481; 90		962.91Chen, Qiao; Zhu, Tingshun; Majhi, Pankaj Kumar; Mou, Chengli; Chai, Huifang; Zhang, Jingjie; Zhuo, Shitian; Chi, Yonggui Robin
Carbene-catalyzed enantioselective oxidative coupling of enals and di(hetero)arylmethanes.
Chemical science, 2018, 9, 8711-8715
1549965 CIFC21 H27.5 Au F6 N2.5 P S2P 1 21/c 111.9382; 26.6092; 16.1416
90; 93.06; 90		5120.33Williams, Morwen; Bertrand, Benoît; Hughes, David L.; Waller, Zoe Ann Ella; Schmidt, Claudia; Ott, Ingo; O'Connell, Maria Anne; Searcey, Mark; Bochmann, Manfred
Cyclometallated Au(III) dithiocarbamate complexes: synthesis, anticancer evaluation and mechanistic studies.
Metallomics, 2018
1549966 CIF
HKL
Paper		C30 H24 N4 O2 SC 1 2/c 118.6131; 18.2243; 15.8867
90; 110.757; 90		5039.2Muthuselvi, C.; Athimoolam, S.; Srinivasan, N.; Ravikumar, B.; Pandiarajan, S.; Krishnakumar, R. V.
Ethyl 6'-cyano-7'-phenyl-1',6',7',7a'-tetrahydro-3'<i>H</i>-spiro[indeno[1,2-<i>b</i>]quinoxaline-11,5'-pyrrolo[1,2-<i>c</i>]thiazole-6'-carboxylate
IUCrData, 2018, 3, x181286
1549967 CIFC22 H19 N5P 1 21/n 16.8768; 15.854; 16.6138
90; 91.265; 90		1810.87Shi, Lei; Li, Kun; Li, Ling-Ling; Chen, Shan-Yong; Li, Meng-Yang; Zhou, Qian; Wang, Nan; Yu, Xiao-Qi
Novel easily available purine-based AIEgens with colour tunability and applications in lipid droplet imaging.
Chemical science, 2018, 9, 8969-8974
1549968 CIFC23 H18 N5 OP 1 21/c 111.7851; 19.9797; 8.1892
90; 97.235; 90		1912.9Shi, Lei; Li, Kun; Li, Ling-Ling; Chen, Shan-Yong; Li, Meng-Yang; Zhou, Qian; Wang, Nan; Yu, Xiao-Qi
Novel easily available purine-based AIEgens with colour tunability and applications in lipid droplet imaging.
Chemical science, 2018, 9, 8969-8974
1549969 CIFC23 H18 N6P -18.038; 10.3402; 11.9954
73.536; 81.046; 84.939		943.44Shi, Lei; Li, Kun; Li, Ling-Ling; Chen, Shan-Yong; Li, Meng-Yang; Zhou, Qian; Wang, Nan; Yu, Xiao-Qi
Novel easily available purine-based AIEgens with colour tunability and applications in lipid droplet imaging.
Chemical science, 2018, 9, 8969-8974
1549970 CIFC23 H18 F3 N5P 1 21/c 113.8657; 8.21008; 18.9838
90; 111.052; 90		2016.85Shi, Lei; Li, Kun; Li, Ling-Ling; Chen, Shan-Yong; Li, Meng-Yang; Zhou, Qian; Wang, Nan; Yu, Xiao-Qi
Novel easily available purine-based AIEgens with colour tunability and applications in lipid droplet imaging.
Chemical science, 2018, 9, 8969-8974
1549971 CIFC38 H63 Cl2 Co N5 O8 S3P -18.8767; 14.5893; 19.0022
107.139; 97.232; 101.356		2260.7Schulte, Kelsey A.; Vignesh, Kuduva R.; Dunbar, Kim R.
Effects of coordination sphere on unusually large zero field splitting and slow magnetic relaxation in trigonally symmetric molecules.
Chemical science, 2018, 9, 9018-9026
1549972 CIFC37 H57 Co N5 O6 S3P 1 21/n 121.1512; 9.0244; 21.2686
90; 95.072; 90		4043.8Schulte, Kelsey A.; Vignesh, Kuduva R.; Dunbar, Kim R.
Effects of coordination sphere on unusually large zero field splitting and slow magnetic relaxation in trigonally symmetric molecules.
Chemical science, 2018, 9, 9018-9026
1549973 CIFC37 H57 N5 Ni O6 S3P 1 21/n 121.0944; 8.9422; 21.3506
90; 94.977; 90		4012.2Schulte, Kelsey A.; Vignesh, Kuduva R.; Dunbar, Kim R.
Effects of coordination sphere on unusually large zero field splitting and slow magnetic relaxation in trigonally symmetric molecules.
Chemical science, 2018, 9, 9018-9026
1549974 CIFC39 H66 N5 Ni O8.5 S3P -18.9571; 14.5969; 18.6587
107.64; 99.252; 103.157		2193.3Schulte, Kelsey A.; Vignesh, Kuduva R.; Dunbar, Kim R.
Effects of coordination sphere on unusually large zero field splitting and slow magnetic relaxation in trigonally symmetric molecules.
Chemical science, 2018, 9, 9018-9026
1549975 CIFC37 H57 Fe N5 O6 S3P 1 21/n 121.195; 9.0313; 21.2797
90; 94.91; 90		4058.4Schulte, Kelsey A.; Vignesh, Kuduva R.; Dunbar, Kim R.
Effects of coordination sphere on unusually large zero field splitting and slow magnetic relaxation in trigonally symmetric molecules.
Chemical science, 2018, 9, 9018-9026
1549976 CIFC37 H59 Fe N5 O7 S3C 1 2/c 126.656; 9.6645; 31.5226
90; 90.44; 90		8120.5Schulte, Kelsey A.; Vignesh, Kuduva R.; Dunbar, Kim R.
Effects of coordination sphere on unusually large zero field splitting and slow magnetic relaxation in trigonally symmetric molecules.
Chemical science, 2018, 9, 9018-9026
1549977 CIFC192 H288 Ag51.08 O0P -119.4375; 19.5121; 19.5367
100.446; 113.716; 102.272		6327.2Duan, Guang-Xiong; Tian, Lin; Wen, Jun-Bo; Li, Lan-Yun; Xie, Yun-Peng; Lu, Xing
An atomically precise all-tert-butylethynide-protected Ag<sub>51</sub> superatom nanocluster with color tunability.
Nanoscale, 2018, 10, 18915-18919
1549978 CIF
HKL
Paper		C15 H9 F O3P 1 21/c 122.3701; 6.8836; 15.7987
90; 106.058; 90		2337.88Koh, Dongsoo
2-(2-Fluorophenyl)-3-hydroxy-4<i>H</i>-chromen-4-one
IUCrData, 2018, 3, x181332
1549979 CIF
HKL
Paper		C8 H12 N2 O8C 1 2/c 116.805; 8.3008; 15.7976
90; 100.259; 90		2168.5Seidel, Rüdiger W.
Revision of the crystal structure of `bis(glycine) squaric acid'
IUCrData, 2018, 3, x181324
1549980 CIF
HKL
Paper		C18 H14 O2 SP 1 21/n 113.0062; 5.9631; 18.3801
90; 104.019; 90		1383.05Hemanathan, K.; Raja, R.; Murugesan, K. Sakthi
8,9-Dimethoxybenzo[<i>b</i>]naphtho[2,3-<i>d</i>]thiophene
IUCrData, 2018, 3, x181257
1549981 CIF
HKL
Paper		C27 H22 N4 O2P 1 21/c 18.0233; 16.877; 17.013
90; 101.021; 90		2261.2Liu, Gang; Liu, Qingsong; Zhang, Huihui; Yu, Jianhua
2-(4-Aminophenyl)-3-[3,4-bis(pyridin-2-ylmethoxy)phenyl]acrylonitrile
IUCrData, 2018, 3, x181329
1549982 CIF
HKL
Paper		C13 H16 N4 O2P 1 21/n 19.069; 13.319; 11.851
90; 112.161; 90		1325.7Lahmidi, Sanae; El Hafi, Mohamed; Moussaif, Ahmed; Benchidmi, Mohammed; Essassi, El Mokhtar; Mague, Joel T.
Ethyl 2-(5-methyl-1,2,4-triazolo[1,5-<i>a</i>]pyrimidin-7-yl)pent-4-enoate
IUCrData, 2018, 3, x181280
1549983 CIF
HKL
Paper		C17 H19 N O5P 1 21/c 18.462; 16.243; 11.477
90; 93.091; 90		1575.2Wang, Junjun; Zhu, Yin; Wang, Haiyan; Yang, Mingdi
3-Acetyl-7-(2-morpholin-4-yl-ethoxy)-chromen-2-one
IUCrData, 2018, 3, x181327
1549984 CIFC35 H32 N2 O4P -110.1174; 10.6043; 14.0472
83.956; 72.182; 87.318		1426.66Emandi, Ganapathi; Flanagan, Keith J.; Senge, Mathias O.
Fluorescent imidazole-based chemosensors for the reversible detection of cyanide and mercury ions.
Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 1450-1461
1549985 CIFC35 H34 N2 O5 SP 1 21/c 19.5779; 29.6464; 10.7257
90; 92.205; 90		3043.31Emandi, Ganapathi; Flanagan, Keith J.; Senge, Mathias O.
Fluorescent imidazole-based chemosensors for the reversible detection of cyanide and mercury ions.
Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 1450-1461
1549986 CIFC Cs3 O8 VC 1 m 19.447; 10.129; 6.1571
90; 123.42; 90		491.7Zou, Guohong; Lin, Zhien; Zeng, Hongmei; Jo, Hongil; Lim, Seong-Ji; You, Tae-Soo; Ok, Kang Min
Cs<sub>3</sub>VO(O<sub>2</sub>)<sub>2</sub>CO<sub>3</sub>: an exceptionally thermostable carbonatoperoxovanadate with an extremely large second-harmonic generation response.
Chemical science, 2018, 9, 8957-8961
1549987 CIF
HKL
Paper		C17 H18 O2P -17.841; 8.203; 11.08
79.131; 85.616; 74.077		672.8Goyal, Navneet; Donahue, James P.; Do, Camilla; Perry, Timothy; Bongay-Williams, Kyla; Foroozesh, Maryam
A dibenzofuran derivative: 2-(pentyloxy)dibenzo[<i>b</i>,<i>d</i>]furan
IUCrData, 2018, 3, x181306
1549988 CIF
HKL
Paper		C21 H15 N3 O3P 1 21/c 110.1759; 23.521; 7.4038
90; 95.674; 90		1763.4Rao, Qingpeng; Wang, Zepeng; Yang, Mingdi; Wu, Zhichao
(<i>Z</i>)-2-(4-Nitrophenyl)-3-[4-(pyridin-4-ylmethoxy)phenyl]acrylonitrile
IUCrData, 2018, 3, x181328
1549989 CIF
HKL
Paper		C11 H11 N3 O4P -110.1251; 11.1335; 15.9006
102.745; 101.1; 101.52		1659.74Marten, Jan; Seichter, Wilhelm; Weber, Edwin
3-[2-(3-Nitrophenyl)hydrazin-1-ylidene]pentane-2,4-dione
IUCrData, 2018, 3, x181344
1549990 CIFO7 Sm3 TaP n m a7.6514; 10.8663; 7.5886
90; 90; 90		630.93Hinatsu, Y.; Doi, Y.
Phase transitions of Sm3NbO7, (Sm1-xLnx)3NbO7 (Ln=Nd,Eu) and Sm3TaO7 with fluorite-related structure : structure at 1473 K
Journal of the Ceramic Society of Japan, 2018, 126, 743-749
1549991 CIFO7 Sm3 TaC 2 2 2110.7818; 7.6197; 7.6556
90; 90; 90		628.94Hinatsu, Y.; Doi, Y.
Phase transitions of Sm3NbO7, (Sm1-xLnx)3NbO7 (Ln=Nd,Eu) and Sm3TaO7 with fluorite-related structure : structure at 1073 K
Journal of the Ceramic Society of Japan, 2018, 126, 743-749
1549992 CIFEu0.6 Nb O7 Sm2.4C 2 2 2110.7488; 7.6036; 7.6521
90; 90; 90		625.4Hinatsu, Y.; Doi, Y.
Phase transitions of Sm3NbO7, (Sm1-xLnx)3NbO7 (Ln=Nd,Eu) and Sm3TaO7 with fluorite-related structure : structure at 973 K
Journal of the Ceramic Society of Japan, 2018, 126, 743-749
1549993 CIFEu0.6 Nb O7 Sm2.4P n m a7.6451; 10.8612; 7.5613
90; 90; 90		627.85Hinatsu, Y.; Doi, Y.
Phase transitions of Sm3NbO7, (Sm1-xLnx)3NbO7 (Ln=Nd,Eu) and Sm3TaO7 with fluorite-related structure : structure at 1473 K
Journal of the Ceramic Society of Japan, 2018, 126, 743-749
1549994 CIFBa0.333 Co O2.98 Pr0.667P n m a5.443765; 7.693164; 5.452008
90; 90; 90		228.329Zhang, W.; Shiraiwa, M.; Wang, N.; Ma, T.; Fujii, K.; Niwa, E.; Yashima, M.
Pr/Ba cation-disordered perovskite Pr2/3Ba1/3CoO3-d as a new bifunctional electrocatalyst for oxygen reduction and oxygen evolution reactions
Journal of the Ceramic Society of Japan, 2018, 126, 814-819
1549995 CIFC58 H46 OP 1 21/c 111.9262; 37.245; 9.5161
90; 102.531; 90		4126.3Hsu, Li-Yun; Maity, Subhendu; Matsunaga, Yuki; Hsu, Ying-Feng; Liu, Yi-Hung; Peng, Shie-Ming; Shinmyozu, Teruo; Yang, Jye-Shane
Photomechanochromic <i>vs.</i> mechanochromic fluorescence of a unichromophoric bimodal molecular solid: multicolour fluorescence patterning.
Chemical science, 2018, 9, 8990-9001
1549996 CIFC58 H46 OP 1 21/c 111.7855; 9.0557; 38.491
90; 97.711; 90		4070.8Hsu, Li-Yun; Maity, Subhendu; Matsunaga, Yuki; Hsu, Ying-Feng; Liu, Yi-Hung; Peng, Shie-Ming; Shinmyozu, Teruo; Yang, Jye-Shane
Photomechanochromic <i>vs.</i> mechanochromic fluorescence of a unichromophoric bimodal molecular solid: multicolour fluorescence patterning.
Chemical science, 2018, 9, 8990-9001
1549997 CIFC58 H46 OP 1 21/c 111.8126; 9.1189; 38.869
90; 98.321; 90		4142.8Hsu, Li-Yun; Maity, Subhendu; Matsunaga, Yuki; Hsu, Ying-Feng; Liu, Yi-Hung; Peng, Shie-Ming; Shinmyozu, Teruo; Yang, Jye-Shane
Photomechanochromic <i>vs.</i> mechanochromic fluorescence of a unichromophoric bimodal molecular solid: multicolour fluorescence patterning.
Chemical science, 2018, 9, 8990-9001
1549998 CIFC16 H104 Mn Mo12 N16 O74 P8P 1 21/n 115.8641; 15.937; 17.1695
90; 92.645; 90		4336.3Su, Zhong-Min; Xie, Shuai-Lei; Liu, Jiang; Dong, Long-Zhang; Li, Shun-Li; Lan, Ya-Qian
Hetero-metallic Active Sites Coupled with Strong Reductive Polyoxometalate for Selectively Photocatalytic CO2-to-CH4 Conversion in Water
Chemical Science, 2018
1549999 CIFK16 Mn40 Mo96 Na8 O560 P68I 41/a c d27.4698; 27.4698; 39.881
90; 90; 90		30094Su, Zhong-Min; Xie, Shuai-Lei; Liu, Jiang; Dong, Long-Zhang; Li, Shun-Li; Lan, Ya-Qian
Hetero-metallic Active Sites Coupled with Strong Reductive Polyoxometalate for Selectively Photocatalytic CO2-to-CH4 Conversion in Water
Chemical Science, 2018
1550000 CIFCo10 Mn30 Mo96 Na24 O576 P68I 41/a c d26.9679; 26.9679; 41.154
90; 90; 90		29930Su, Zhong-Min; Xie, Shuai-Lei; Liu, Jiang; Dong, Long-Zhang; Li, Shun-Li; Lan, Ya-Qian
Hetero-metallic Active Sites Coupled with Strong Reductive Polyoxometalate for Selectively Photocatalytic CO2-to-CH4 Conversion in Water
Chemical Science, 2018
1550001 CIFC57 Al F45 O3P -113.5287; 14.9354; 15.4422
87.648; 65.253; 71.914		2679.32Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens
Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid.
Chemical science, 2018, 9, 8178-8183
1550002 CIFC61 H8 Al F46 O4 TlP -112.8874; 13.362; 19.1533
81.244; 86.346; 65.335		2962.37Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens
Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid.
Chemical science, 2018, 9, 8178-8183
1550003 CIFC77 H17 Al Cl2 F46 O3P -111.872; 13.5786; 22.6501
83.441; 84.275; 85.147		3599.41Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens
Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid.
Chemical science, 2018, 9, 8178-8183
1550004 CIFC67 H10 Al F46 Fe O3P 111.6429; 11.6834; 12.0655
97.981; 101.382; 98.8		1565.64Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens
Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid.
Chemical science, 2018, 9, 8178-8183
1550005 CIFC68 H16 Al F45 O4P -112.9745; 14.9114; 32.7214
84.388; 88.756; 88.372		6296.5Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens
Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid.
Chemical science, 2018, 9, 8178-8183
1550006 CIFC68 H18 Al F45 O4P -112.473; 12.4862; 24.3363
92.264; 102.069; 109.518		3468.7Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens
Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid.
Chemical science, 2018, 9, 8178-8183
1550007 CIFC65 H20 Al F46 Li O5P 1 21/n 113.5375; 24.2062; 20.9262
90; 104.02; 90		6653.1Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens
Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid.
Chemical science, 2018, 9, 8178-8183
1550008 CIFC73 H32 Al Cs F46 O7P -113.4499; 13.5054; 44.2327
98.198; 92.575; 90.287		7944Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens
Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid.
Chemical science, 2018, 9, 8178-8183
1550009 CIFC66 H11 Al F45 N O3P -113.2289; 14.1466; 17.4224
86.299; 85.794; 67.503		3001.9Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens
Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid.
Chemical science, 2018, 9, 8178-8183
1550010 CIFC63 H15 Al F45 O4 PP 1 21/c 124.8884; 23.4948; 22.4273
90; 105.82; 90		12617.6Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens
Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid.
Chemical science, 2018, 9, 8178-8183
1550011 CIFC76 H15 Al Cl F45 O3P -113.8546; 14.2421; 20.1247
94.513; 96.029; 119.026		3414.42Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens
Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid.
Chemical science, 2018, 9, 8178-8183
1550012 CIFC73 H36 Al F46 N O3P -113.3297; 14.3059; 22.5568
71.867; 75.445; 63.622		3629.8Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens
Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid.
Chemical science, 2018, 9, 8178-8183
1550013 CIFC63 H13 Ag Al F46 N O4P 1 21/c 111.7732; 24.2075; 21.9598
90; 90.568; 90		6258.2Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens
Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid.
Chemical science, 2018, 9, 8178-8183
1550014 CIFC62 H5 Al F45 N O3P -122.4236; 24.0454; 29.527
91.684; 111.56; 98.389		14588.4Kögel, Julius F; Timoshkin, Alexey Y.; Schröder, Artem; Lork, Enno; Beckmann, Jens
Al(OCArF3)<sub>3</sub> - a thermally stable Lewis superacid.
Chemical science, 2018, 9, 8178-8183
1550016 CIFAl O4 PP 1 2/a 18.7802; 4.9087; 10.9191
90; 90.33; 90		470.599Kanzaki, M.
Temperature-induced phase transition of AlPO4-moganite studies by in-situ Raman spectroscopy : alpha phase model optimized by DFT
Journal of Mineralogical and Petrological Sciences, 2018, 113, 126-134
1550017 CIFAl O4 PP m a a9.0682; 4.8904; 10.9793
90; 90; 90		486.9Kanzaki, M.
Temperature-induced phase transition of AlPO4-moganite studies by in-situ Raman spectroscopy : beta phase model optimized by DFT
Journal of Mineralogical and Petrological Sciences, 2018, 113, 126-134
1550018 CIFC23 H24 Cl F Ir NP -19.2681; 10.4733; 10.8722
82.9875; 85.2833; 74.7986		1009.4Chen, Xiao-Yang; Sorensen, Erik J.
Ir(iii)-catalyzed <i>ortho</i> C-H alkylations of (hetero)aromatic aldehydes using alkyl boron reagents.
Chemical science, 2018, 9, 8951-8956
1550019 CIFC38 H23 N3 O26 S8P 1 n 111.0583; 10.7138; 21.6433
90; 91.862; 90		2562.87Jeamet, Emeric; Septavaux, Jean; Héloin, Alexandre; Donnier-Maréchal, Marion; Dumartin, Melissa; OURRI, Benjamin; Mandal, Pradeep Kumar; Huc, Ivan; Bignon, Emmanuelle; Dumont, Elise; Morell, Christophe; Francoia, Jean-Patrick; PERRET, Florent; Vial, Laurent; Leclaire, Julien
Wetting the lock and key enthalpically favours polyelectrolytes binding
Chemical Science, 2018
1550020 CIFC25 H19 N O2 SP 1 21/c 113.4762; 15.1134; 10.0992
90; 107.105; 90		1965.93Mao, Zhu; Yang, Zhan; Fan, Zhenguo; Ubba, Eethamukkala; Li, Wenlang; Li, Yang; Zhao, Juan; Yang, Zhiyong; Aldred, Matthew Phillip; Chi, Zhenguo
Methylation-effect in Prolonging the Pure Organic Room Temperature Phosphorescence Lifetime
Chemical Science, 2018
1550021 CIFC27 H23 N O2 SC 1 2/c 121.0963; 12.9096; 15.8774
90; 101.148; 90		4242.5Mao, Zhu; Yang, Zhan; Fan, Zhenguo; Ubba, Eethamukkala; Li, Wenlang; Li, Yang; Zhao, Juan; Yang, Zhiyong; Aldred, Matthew Phillip; Chi, Zhenguo
Methylation-effect in Prolonging the Pure Organic Room Temperature Phosphorescence Lifetime
Chemical Science, 2018
1550022 CIFC6 H6 N2 O2P 1 21/n 15.2532; 5.321; 10.9671
90; 101.974; 90		299.89Sieuw, Louis; Jouhara, Alia; Quarez, Eric; Auger, Chloe; Gohy, Jean-François; Poizot, Philippe; Vlad, Alexandru
H-bond Stabilized Quinone Electrode Material for Li-Organic Batteries: the Strength of Weak Bonds
Chemical Science, 2018
1550023 CIFC55 H78 Cl2 F6 Ir N8 PP 1 21/c 115.8369; 16.9326; 21.2999
90; 97.044; 90		5668.7Lam, Tsz Lung; Ka Chung, Tong; Yang, Chen; Kwong, Wai-Lun; Guan, Xiangguo; Li, Ming-De; Lo, Vanessa Kar-Yan; Chan, Sharon Lai-Fung; Phillips, David Lee; Lok, Chun-Nam; Che, Chi-Ming
Luminescent ruffled iridium(III) porphyrin complexes containing N-heterocyclic carbene ligands: structures, spectroscopies and potent antitumor activities under dark and light irradiation conditions
Chemical Science, 2018
1550024 CIFC54.25 H24 F20.75 Ir N8 O0.75 S0.25P 1 21/c 124.7628; 23.6873; 39.6486
90; 95.9405; 90		23131.5Lam, Tsz Lung; Ka Chung, Tong; Yang, Chen; Kwong, Wai-Lun; Guan, Xiangguo; Li, Ming-De; Lo, Vanessa Kar-Yan; Chan, Sharon Lai-Fung; Phillips, David Lee; Lok, Chun-Nam; Che, Chi-Ming
Luminescent ruffled iridium(III) porphyrin complexes containing N-heterocyclic carbene ligands: structures, spectroscopies and potent antitumor activities under dark and light irradiation conditions
Chemical Science, 2018
1550025 CIFC54 H64 F6 Ir N8 PC 1 2/c 117.9784; 15.124; 19.0318
90; 108.004; 90		4921.5Lam, Tsz Lung; Ka Chung, Tong; Yang, Chen; Kwong, Wai-Lun; Guan, Xiangguo; Li, Ming-De; Lo, Vanessa Kar-Yan; Chan, Sharon Lai-Fung; Phillips, David Lee; Lok, Chun-Nam; Che, Chi-Ming
Luminescent ruffled iridium(III) porphyrin complexes containing N-heterocyclic carbene ligands: structures, spectroscopies and potent antitumor activities under dark and light irradiation conditions
Chemical Science, 2018
1550026 CIFC58.12 H52.25 Cl0.25 F6 Ir N8 PP -112.7322; 16.8417; 26.2843
77.893; 84.194; 78.728		5393.9Lam, Tsz Lung; Ka Chung, Tong; Yang, Chen; Kwong, Wai-Lun; Guan, Xiangguo; Li, Ming-De; Lo, Vanessa Kar-Yan; Chan, Sharon Lai-Fung; Phillips, David Lee; Lok, Chun-Nam; Che, Chi-Ming
Luminescent ruffled iridium(III) porphyrin complexes containing N-heterocyclic carbene ligands: structures, spectroscopies and potent antitumor activities under dark and light irradiation conditions
Chemical Science, 2018
1550027 CIF
HKL
Paper		C21.5 H20.5 Br N6.5 O0.5 SP -19.9957; 14.5325; 15.8353
81.671; 81.344; 80.469		2225.6El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Yousif, Emad; Hegazy, Amany S.; Kariuki, Benson M.
5-[(4-Bromophenyl)diazenyl]-2-{2-[1-(1<i>H</i>-indol-3-yl)ethylidene]hydrazinyl}-4-methylthiazole dimethylformamide hemisolvate
IUCrData, 2018, 3, x181378
1550028 CIF
HKL
Paper		C17 H17 N5 O SP -19.0292; 9.864; 10.8754
111.021; 105.103; 96.945		847.86El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Alotaibi, Mohammad Hayal; Yousif, Emad; Hegazy, Amany S.; Kariuki, Benson M.
5-Methyl-1-(4-methylphenyl)-N′-[1-(thiophen-2-yl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
IUCrData, 2018, 3
1550029 CIFC14 H22 N2 OP n a 2123.0581; 16.6608; 15.1185
90; 90; 90		5808Peveler, William J.; Packman, Hollie; Alexander, Shirin; Chauhan, Raamanand R.; Hayes, Lilian M.; Macdonald, Thomas J.; Cockcroft, Jeremy K.; Rogers, Sarah; Aarts, Dirk G. A. L.; Carmalt, Claire J.; Parkin, Ivan P.; Bear, Joseph C.
A new family of urea-based low molecular-weight organogelators for environmental remediation: the influence of structure.
Soft matter, 2018, 14, 8821-8827
1550030 CIFC14 H22 N2 OP 1 21/c 112.9354; 11.92; 27.3126
90; 93.311; 90		4204.3Peveler, William J.; Packman, Hollie; Alexander, Shirin; Chauhan, Raamanand R.; Hayes, Lilian M.; Macdonald, Thomas J.; Cockcroft, Jeremy K.; Rogers, Sarah; Aarts, Dirk G. A. L.; Carmalt, Claire J.; Parkin, Ivan P.; Bear, Joseph C.
A new family of urea-based low molecular-weight organogelators for environmental remediation: the influence of structure.
Soft matter, 2018, 14, 8821-8827
1550031 CIFC17 H28 N2 OP 21 21 218.8209; 19.6496; 20.2318
90; 90; 90		3506.72Peveler, William J.; Packman, Hollie; Alexander, Shirin; Chauhan, Raamanand R.; Hayes, Lilian M.; Macdonald, Thomas J.; Cockcroft, Jeremy K.; Rogers, Sarah; Aarts, Dirk G. A. L.; Carmalt, Claire J.; Parkin, Ivan P.; Bear, Joseph C.
A new family of urea-based low molecular-weight organogelators for environmental remediation: the influence of structure.
Soft matter, 2018, 14, 8821-8827
1550033 CIFC37 H46 B Cl2 Cu F4 N8P 1 21/c 120.808; 31.071; 12.2164
90; 90.694; 90		7897.6Zelenay, Benjamin; Besora, Maria; Monasterio, Zaira; Ventura-Espinosa, David; White, Andrew J. P.; Maseras, Feliu; Díez-González, Silvia
Copper-mediated reduction of azides under seemingly oxidising conditions: catalytic and computational studies
Catalysis Science & Technology, 2018, 8, 5763
1550034 CIFC33.5 H41 Cl Cu F3 N4 O3 SP 1 21/n 112.3905; 19.0233; 14.481
90; 102.996; 90		3325.86Zelenay, Benjamin; Besora, Maria; Monasterio, Zaira; Ventura-Espinosa, David; White, Andrew J. P.; Maseras, Feliu; Díez-González, Silvia
Copper-mediated reduction of azides under seemingly oxidising conditions: catalytic and computational studies
Catalysis Science & Technology, 2018, 8, 5763
1550035 CIFC37 H44 Cu F3 N4 O3 SP -19.1002; 10.9858; 19.3481
89.693; 79.192; 82.793		1884.64Zelenay, Benjamin; Besora, Maria; Monasterio, Zaira; Ventura-Espinosa, David; White, Andrew J. P.; Maseras, Feliu; Díez-González, Silvia
Copper-mediated reduction of azides under seemingly oxidising conditions: catalytic and computational studies
Catalysis Science & Technology, 2018, 8, 5763
1550038 CIFC12 H14 F N O3P 21 21 218.9101; 9.4553; 14.4099
90; 90; 90		1214Guan, Yu-Qing; Han, Zhengyu; Li, Xiuxiu; You, Cai; Tan, Xuefeng; Lv, Hui; Zhang, Xumu
A cheap metal for a challenging task: nickel-catalyzed highly diastereo- and enantioselective hydrogenation of tetrasubstituted fluorinated enamides
Chemical Science, 2018
1550040 CIFC138 H148 Br8 Cl4 N12 Zn2P -117.6822; 17.7483; 25.194
78.121; 77.607; 60.899		6699.7Sánchez-Roa, David; Santiago, Tomás G; Fernández-Millán, Maria; Cuenca, Tomás; Palma, Pilar; Cámpora, Juan; Mosquera, Marta E. G.
Interaction of an imidazolium-2-amidinate (NHC-CDI) zwitterion with zinc dichloride in dichloromethane: role as ligands and C-Cl activation promoters.
Chemical communications (Cambridge, England), 2018, 54, 12586-12589
1550041 CIFC33 H42 Cl10 N4C 1 2/c 116.0787; 21.553; 24.176
90; 94.498; 90		8352.2Sánchez-Roa, David; Santiago, Tomás G; Fernández-Millán, Maria; Cuenca, Tomás; Palma, Pilar; Cámpora, Juan; Mosquera, Marta E. G.
Interaction of an imidazolium-2-amidinate (NHC-CDI) zwitterion with zinc dichloride in dichloromethane: role as ligands and C-Cl activation promoters.
Chemical communications (Cambridge, England), 2018, 54, 12586-12589
1550042 CIFC64 H80 Cl12 N8 Zn2P b c a21.712; 13.037; 54.215
90; 90; 90		15346Sánchez-Roa, David; Santiago, Tomás G; Fernández-Millán, Maria; Cuenca, Tomás; Palma, Pilar; Cámpora, Juan; Mosquera, Marta E. G.
Interaction of an imidazolium-2-amidinate (NHC-CDI) zwitterion with zinc dichloride in dichloromethane: role as ligands and C-Cl activation promoters.
Chemical communications (Cambridge, England), 2018, 54, 12586-12589
1550043 CIFC74 H102 Cl28 N8P -112.838; 15.476; 27.491
98.93; 92.92; 110.32		5027Sánchez-Roa, David; Santiago, Tomás G; Fernández-Millán, Maria; Cuenca, Tomás; Palma, Pilar; Cámpora, Juan; Mosquera, Marta E. G.
Interaction of an imidazolium-2-amidinate (NHC-CDI) zwitterion with zinc dichloride in dichloromethane: role as ligands and C-Cl activation promoters.
Chemical communications (Cambridge, England), 2018, 54, 12586-12589
1550044 CIFC22 H26 I Ir N4P -18.5611; 10.9802; 13.2254
109.051; 102.4; 90.413		1143.69Semwal, Shrivats; Kumar, Abhishek; Choudhury, Joyanta
Iridium‒NHC-based catalyst for ambient pressure storage and low temperature release of H2via the CO2/HCO2H couple
Catalysis Science & Technology, 2018, 8, 6137
1550047 CIFC64 H70 B Dy F20P 1 21/n 115.2173; 22.8792; 16.8807
90; 90.605; 90		5876.9Randall McClain, K.; Gould, Colin A.; Chakarawet, Khetpakorn; Teat, Simon J.; Groshens, Thomas J.; Long, Jeffrey R.; Harvey, Benjamin G.
High-temperature magnetic blocking and magneto-structural correlations in a series of dysprosium(iii) metallocenium single-molecule magnets.
Chemical science, 2018, 9, 8492-8503
1550048 CIFC62 H66 B Dy F20P 1 21/n 114.9801; 23.0586; 16.7069
90; 90.789; 90		5770.4Randall McClain, K.; Gould, Colin A.; Chakarawet, Khetpakorn; Teat, Simon J.; Groshens, Thomas J.; Long, Jeffrey R.; Harvey, Benjamin G.
High-temperature magnetic blocking and magneto-structural correlations in a series of dysprosium(iii) metallocenium single-molecule magnets.
Chemical science, 2018, 9, 8492-8503
1550049 CIFC58 H58 B Dy F20P 1 21 116.5863; 14.4989; 22.708
90; 90.0586; 90		5460.9Randall McClain, K.; Gould, Colin A.; Chakarawet, Khetpakorn; Teat, Simon J.; Groshens, Thomas J.; Long, Jeffrey R.; Harvey, Benjamin G.
High-temperature magnetic blocking and magneto-structural correlations in a series of dysprosium(iii) metallocenium single-molecule magnets.
Chemical science, 2018, 9, 8492-8503
1550050 CIFC60 H62 B Dy F20P 1 21/c 114.5; 16.63; 46.59
90; 90.027; 90		11234Randall McClain, K.; Gould, Colin A.; Chakarawet, Khetpakorn; Teat, Simon J.; Groshens, Thomas J.; Long, Jeffrey R.; Harvey, Benjamin G.
High-temperature magnetic blocking and magneto-structural correlations in a series of dysprosium(iii) metallocenium single-molecule magnets.
Chemical science, 2018, 9, 8492-8503
1550055 CIFC36 H58 N4 O2 ZnP 1 21/n 117.3189; 12.4391; 17.5819
90; 104.339; 90		3669.7McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D.
Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide
Polymer Chemistry, 2018, 9, 5339
1550056 CIFC22 H30 N4 O2 ZnP -4 21 c24.0631; 24.0631; 7.4652
90; 90; 90		4322.6McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D.
Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide
Polymer Chemistry, 2018, 9, 5339
1550057 CIFC25.5 H30 Cl4 Mg N4 O2C 1 2/c 139.731; 11.9213; 23.8229
90; 99.266; 90		11136.4McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D.
Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide
Polymer Chemistry, 2018, 9, 5339
1550058 CIFC23.5 H30 N4 O2 ZnP 1 21 112.093; 14.8544; 13.2064
90; 105.887; 90		2281.7McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D.
Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide
Polymer Chemistry, 2018, 9, 5339
1550059 CIFC38 H62 Mg N4 O2I 1 2/a 117.113; 15.0517; 29.9562
90; 90.872; 90		7715.22McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D.
Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide
Polymer Chemistry, 2018, 9, 5339
1550060 CIFC36 H58 Mg N4 O2P 1 21/c 119.8993; 14.4435; 25.6572
90; 92.143; 90		7369.12McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D.
Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide
Polymer Chemistry, 2018, 9, 5339
1550061 CIFC54 H84 N4 O2 ZnP 1 21/n 113.4614; 11.975; 31.039
90; 90.965; 90		5002.8McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D.
Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide
Polymer Chemistry, 2018, 9, 5339
1550062 CIFC47 H52 Cl8 N8 O4 Zn2P -111.3788; 11.6856; 21.1747
105.712; 94.301; 104.647		2590.97McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D.
Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide
Polymer Chemistry, 2018, 9, 5339
1550063 CIFC38 H62 N4 O2 ZnI 1 2/a 117.0865; 15.0333; 30.0246
90; 91.193; 90		7710.6McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D.
Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide
Polymer Chemistry, 2018, 9, 5339
1550064 CIFC40 H52 Mg2 N8 O4P 1 21/n 19.4092; 13.8925; 14.8093
90; 95.647; 90		1926.4McKeown, Paul; McCormick, Strachan N.; Mahon, Mary F.; Jones, Matthew D.
Highly active Mg(ii) and Zn(ii) complexes for the ring opening polymerisation of lactide
Polymer Chemistry, 2018, 9, 5339
1550065 CIFC72 H92 N6 Si2P -110.4966; 12.3975; 13.2265
104.289; 99.208; 101.826		1591.78Le Roy, Jennifer J.; Cremers, Jonathan; Thomlinson, Isabel A.; Slota, Michael; Myers, William K.; Horton, Peter H.; Coles, Simon J.; Anderson, Harry L.; Bogani, Lapo
Tailored homo- and hetero- lanthanide porphyrin dimers: a synthetic strategy for integrating multiple spintronic functionalities into a single molecule.
Chemical science, 2018, 9, 8474-8481
1550066 CIFC156 H212 Co2 Gd2 N8 O18 P6 Si2P -110.3106; 14.6582; 27.9536
75.075; 86.248; 70.983		3858.64Le Roy, Jennifer J.; Cremers, Jonathan; Thomlinson, Isabel A.; Slota, Michael; Myers, William K.; Horton, Peter H.; Coles, Simon J.; Anderson, Harry L.; Bogani, Lapo
Tailored homo- and hetero- lanthanide porphyrin dimers: a synthetic strategy for integrating multiple spintronic functionalities into a single molecule.
Chemical science, 2018, 9, 8474-8481
1550067 CIFC70 H94 N4 Si2P -110.741; 11.0043; 15.1711
69.405; 70.878; 76.429		1571.4Le Roy, Jennifer J.; Cremers, Jonathan; Thomlinson, Isabel A.; Slota, Michael; Myers, William K.; Horton, Peter H.; Coles, Simon J.; Anderson, Harry L.; Bogani, Lapo
Tailored homo- and hetero- lanthanide porphyrin dimers: a synthetic strategy for integrating multiple spintronic functionalities into a single molecule.
Chemical science, 2018, 9, 8474-8481
1550068 CIFC87 H127 Co Gd N4 O9 P3 Si2C 1 c 116.25392; 38.80173; 16.36512
90; 119.106; 90		9017.85Le Roy, Jennifer J.; Cremers, Jonathan; Thomlinson, Isabel A.; Slota, Michael; Myers, William K.; Horton, Peter H.; Coles, Simon J.; Anderson, Harry L.; Bogani, Lapo
Tailored homo- and hetero- lanthanide porphyrin dimers: a synthetic strategy for integrating multiple spintronic functionalities into a single molecule.
Chemical science, 2018, 9, 8474-8481
1550069 CIFC87 H127 Co N4 O9 P3 Si2 YP 1 21/c 118.266; 14.9061; 33.9132
90; 104.455; 90		8941.4Le Roy, Jennifer J.; Cremers, Jonathan; Thomlinson, Isabel A.; Slota, Michael; Myers, William K.; Horton, Peter H.; Coles, Simon J.; Anderson, Harry L.; Bogani, Lapo
Tailored homo- and hetero- lanthanide porphyrin dimers: a synthetic strategy for integrating multiple spintronic functionalities into a single molecule.
Chemical science, 2018, 9, 8474-8481
1550070 CIFC74 H108 N4 O4 Si2 ZnP 1 21/c 18.05199; 13.9466; 31.93
90; 90.63; 90		3585.45Le Roy, Jennifer J.; Cremers, Jonathan; Thomlinson, Isabel A.; Slota, Michael; Myers, William K.; Horton, Peter H.; Coles, Simon J.; Anderson, Harry L.; Bogani, Lapo
Tailored homo- and hetero- lanthanide porphyrin dimers: a synthetic strategy for integrating multiple spintronic functionalities into a single molecule.
Chemical science, 2018, 9, 8474-8481
1550071 CIFC78 H107 Co Dy N4 O9 P3 SiP 1 21/c 119.34446; 39.8242; 20.5371
90; 90.4603; 90		15820.8Le Roy, Jennifer J.; Cremers, Jonathan; Thomlinson, Isabel A.; Slota, Michael; Myers, William K.; Horton, Peter H.; Coles, Simon J.; Anderson, Harry L.; Bogani, Lapo
Tailored homo- and hetero- lanthanide porphyrin dimers: a synthetic strategy for integrating multiple spintronic functionalities into a single molecule.
Chemical science, 2018, 9, 8474-8481
1550072 CIFC77.5 H96 Cl N7 Si2 ZnP -113.171; 14.3764; 19.9456
90.736; 91.97; 108.933		3569.14Le Roy, Jennifer J.; Cremers, Jonathan; Thomlinson, Isabel A.; Slota, Michael; Myers, William K.; Horton, Peter H.; Coles, Simon J.; Anderson, Harry L.; Bogani, Lapo
Tailored homo- and hetero- lanthanide porphyrin dimers: a synthetic strategy for integrating multiple spintronic functionalities into a single molecule.
Chemical science, 2018, 9, 8474-8481
1550073 CIFC156 H212 Co2 N8 O18 P6 Si2 Tb2P -110.3082; 14.6723; 27.9524
75.061; 86.208; 71.139		3864.76Le Roy, Jennifer J.; Cremers, Jonathan; Thomlinson, Isabel A.; Slota, Michael; Myers, William K.; Horton, Peter H.; Coles, Simon J.; Anderson, Harry L.; Bogani, Lapo
Tailored homo- and hetero- lanthanide porphyrin dimers: a synthetic strategy for integrating multiple spintronic functionalities into a single molecule.
Chemical science, 2018, 9, 8474-8481
1550074 CIFC156 H212 Co2 Dy2 N8 O18 P6 Si2P -110.2534; 14.6267; 27.8407
75.0624; 86.2571; 71.1737		3817.71Le Roy, Jennifer J.; Cremers, Jonathan; Thomlinson, Isabel A.; Slota, Michael; Myers, William K.; Horton, Peter H.; Coles, Simon J.; Anderson, Harry L.; Bogani, Lapo
Tailored homo- and hetero- lanthanide porphyrin dimers: a synthetic strategy for integrating multiple spintronic functionalities into a single molecule.
Chemical science, 2018, 9, 8474-8481
1550075 CIFC87 H127 Co Dy N4 O9 P3 Si2P -116.1487; 19.0993; 30.5159
98.382; 92.063; 97.559		9215.9Le Roy, Jennifer J.; Cremers, Jonathan; Thomlinson, Isabel A.; Slota, Michael; Myers, William K.; Horton, Peter H.; Coles, Simon J.; Anderson, Harry L.; Bogani, Lapo
Tailored homo- and hetero- lanthanide porphyrin dimers: a synthetic strategy for integrating multiple spintronic functionalities into a single molecule.
Chemical science, 2018, 9, 8474-8481
1550076 CIFC88.5 H130 Cl3 Co N4 O9 P3 Si2 TbP 1 21/c 131.5498; 16.095; 19.4714
90; 107.306; 90		9439.85Le Roy, Jennifer J.; Cremers, Jonathan; Thomlinson, Isabel A.; Slota, Michael; Myers, William K.; Horton, Peter H.; Coles, Simon J.; Anderson, Harry L.; Bogani, Lapo
Tailored homo- and hetero- lanthanide porphyrin dimers: a synthetic strategy for integrating multiple spintronic functionalities into a single molecule.
Chemical science, 2018, 9, 8474-8481
1550077 CIFC89 H125 Co Dy N6 O9 P3 Si2P -116.1981; 23.3852; 25.473
73.821; 89.254; 86.965		9253.9Le Roy, Jennifer J.; Cremers, Jonathan; Thomlinson, Isabel A.; Slota, Michael; Myers, William K.; Horton, Peter H.; Coles, Simon J.; Anderson, Harry L.; Bogani, Lapo
Tailored homo- and hetero- lanthanide porphyrin dimers: a synthetic strategy for integrating multiple spintronic functionalities into a single molecule.
Chemical science, 2018, 9, 8474-8481
1550078 CIF
HKL
Paper		C24 H23 N3 O2P -18.6962; 8.7349; 14.559
106.468; 92.949; 111.771		969.6Jouha, Jabrane; Loubidi, Mohamed; El Hafi, Mohamed; Tber, Zahira; Essassi, El Mokhtar; Mague, Joel T.
Ethyl 4-(3,4,6-trimethyl-1-phenyl-1<i>H</i>-pyrazolo[3,4-<i>b</i>]pyridin-5-yl)benzoate
IUCrData, 2018, 3, x181449
1550079 CIF
HKL
Paper		C11 H23 N10 O15 SmP 1 21/c 110.0164; 22.7494; 15.0848
90; 138.151; 90		2293.3Gioia, Michael; Crundwell, Guy; Westcott, Barry L.
Tetraaqua[2,6-diacetylpyridine bis(semicarbazone)]samarium(III) trinitrate
IUCrData, 2018, 3, x181454
1550080 CIF
HKL
Paper		C18 H19 N O7P -14.9417; 7.6157; 23.4472
94.49; 92.997; 98.136		869.06Bouzian, Younos; Hlimi, Fouzia; kheira Sebbar, Nada; El Hafi, Mohamed; Hni, Brahim; Essassi, El Mokhtar; Mague, Joel T.
Ethyl 2-{[2-(2-ethoxy-2-oxoethoxy)quinolin-4-yl]carbonyloxy}acetate
IUCrData, 2018, 3, x181438
1550081 CIF
HKL
Paper		C8 H20 Cl6 N2 SnC 1 2/m 116.3784; 7.3134; 7.1566
90; 91.205; 90		857.04Gotoh, Kazuma; Ishida, Hiroyuki
Bis(pyrrolidinium) hexachloridostannate: a redetermination
IUCrData, 2018, 3
1550082 CIF
HKL
Paper		C19 H28 Cl N3 O5P 438.5308; 8.5308; 31.893
90; 90; 90		2321Rasheeda, Kedila; Samshuddin, Seranthimata; Swathi, Phadke N.; Alva, Vijaya D. P.; Mague, Joel T.; Ramli, Youssef
Diethyl 4-(4-chloro-2-propyl-1<i>H</i>-imidazol-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate monohydrate
IUCrData, 2018, 3, x181470
1550083 CIFC23 H22 O3P 1 21/c 113.7826; 9.2243; 15.0346
90; 111.733; 90		1775.56Bismillah, Aisha N.; Sturala, Jiri; Chapin, Brette M.; Yufit, Dmitry S.; Hodgkinson, Paul; McGonigal, Paul R.
Shape-selective crystallisation of fluxional carbon cages.
Chemical science, 2018, 9, 8631-8636
1550084 CIFC23 H22 O3P 1 21/c 113.8567; 9.2431; 15.1049
90; 111.846; 90		1795.69Bismillah, Aisha N.; Sturala, Jiri; Chapin, Brette M.; Yufit, Dmitry S.; Hodgkinson, Paul; McGonigal, Paul R.
Shape-selective crystallisation of fluxional carbon cages.
Chemical science, 2018, 9, 8631-8636
1550085 CIFC23 H22 O3P 1 21/c 113.9193; 9.2488; 15.1658
90; 111.938; 90		1811.02Bismillah, Aisha N.; Sturala, Jiri; Chapin, Brette M.; Yufit, Dmitry S.; Hodgkinson, Paul; McGonigal, Paul R.
Shape-selective crystallisation of fluxional carbon cages.
Chemical science, 2018, 9, 8631-8636
1550086 CIFC23 H22 O3P 1 21/c 113.5882; 9.2068; 14.8687
90; 111.294; 90		1733.14Bismillah, Aisha N.; Sturala, Jiri; Chapin, Brette M.; Yufit, Dmitry S.; Hodgkinson, Paul; McGonigal, Paul R.
Shape-selective crystallisation of fluxional carbon cages.
Chemical science, 2018, 9, 8631-8636
1550087 CIFC21 H16 F2 OP 1 21/n 19.824; 6.304; 25.0331
90; 90.602; 90		1550.23Bismillah, Aisha N.; Sturala, Jiri; Chapin, Brette M.; Yufit, Dmitry S.; Hodgkinson, Paul; McGonigal, Paul R.
Shape-selective crystallisation of fluxional carbon cages.
Chemical science, 2018, 9, 8631-8636
1550088 CIFC22 H19 F O2P 1 21/c 118.848; 7.4991; 12.2152
90; 107.691; 90		1644.89Bismillah, Aisha N.; Sturala, Jiri; Chapin, Brette M.; Yufit, Dmitry S.; Hodgkinson, Paul; McGonigal, Paul R.
Shape-selective crystallisation of fluxional carbon cages.
Chemical science, 2018, 9, 8631-8636
1550089 CIFC21 H16 F2 OP 1 21/n 19.7695; 6.177; 24.65
90; 90.36; 90		1487.5Bismillah, Aisha N.; Sturala, Jiri; Chapin, Brette M.; Yufit, Dmitry S.; Hodgkinson, Paul; McGonigal, Paul R.
Shape-selective crystallisation of fluxional carbon cages.
Chemical science, 2018, 9, 8631-8636
1550090 CIFC21 H17 F OP 1 21/n 19.7901; 6.2016; 24.0401
90; 92.931; 90		1457.67Bismillah, Aisha N.; Sturala, Jiri; Chapin, Brette M.; Yufit, Dmitry S.; Hodgkinson, Paul; McGonigal, Paul R.
Shape-selective crystallisation of fluxional carbon cages.
Chemical science, 2018, 9, 8631-8636
1550091 CIFC21 H16 F2 OP 1 21/n 19.8084; 6.2441; 24.8702
90; 90.457; 90		1523.12Bismillah, Aisha N.; Sturala, Jiri; Chapin, Brette M.; Yufit, Dmitry S.; Hodgkinson, Paul; McGonigal, Paul R.
Shape-selective crystallisation of fluxional carbon cages.
Chemical science, 2018, 9, 8631-8636
1550092 CIFC15 H11 F OP 21 21 219.9209; 9.9803; 11.1024
90; 90; 90		1099.29Bismillah, Aisha N.; Sturala, Jiri; Chapin, Brette M.; Yufit, Dmitry S.; Hodgkinson, Paul; McGonigal, Paul R.
Shape-selective crystallisation of fluxional carbon cages.
Chemical science, 2018, 9, 8631-8636
1550093 CIFC22 H19 F O2P 1 21/c 116.0612; 7.15; 14.5266
90; 98.455; 90		1650.1Bismillah, Aisha N.; Sturala, Jiri; Chapin, Brette M.; Yufit, Dmitry S.; Hodgkinson, Paul; McGonigal, Paul R.
Shape-selective crystallisation of fluxional carbon cages.
Chemical science, 2018, 9, 8631-8636
1550094 CIFC21 H16 F2 OP 1 21/n 19.8199; 6.2643; 24.9393
90; 90.51; 90		1534.08Bismillah, Aisha N.; Sturala, Jiri; Chapin, Brette M.; Yufit, Dmitry S.; Hodgkinson, Paul; McGonigal, Paul R.
Shape-selective crystallisation of fluxional carbon cages.
Chemical science, 2018, 9, 8631-8636
1550099 CIFC31 H34 N2 O5P 1 21/c 111.0695; 17.736; 13.5179
90; 97.3794; 90		2631.97Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550100 CIFC31 H34 N2 O6P 1 21/c 111.235; 17.6516; 13.4798
90; 96.269; 90		2657.27Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550101 CIFC31 H34 N2 O7P 1 21/c 111.3258; 17.8349; 13.4077
90; 95.8; 90		2694.4Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550102 CIFC31 H34 N2 O7P 1 21/c 110.843; 17.862; 13.913
90; 91.715; 90		2693.4Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550103 CIFC31 H34 N2 O7P 1 21 111.4733; 17.6286; 13.653
90; 93.29; 90		2756.88Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550104 CIFC31 H34 N2 O5.9P 1 21/c 111.197; 17.627; 13.199
90; 96.347; 90		2589.1Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550105 CIFC31 H34.42 N2 O6.42P 1 21/c 111.282; 17.856; 13.46
90; 96.06; 90		2696.4Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550106 CIFC62 H67.84 N4 O11.72P 1 21 111.346; 17.508; 13.4
90; 98.15; 90		2635Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550107 CIFC31 H34 N2 O6.51P 1 21/c 111.253; 17.66; 13.247
90; 95.787; 90		2619.1Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550108 CIFC31 H34.55 N2 O6.14P 1 21/c 111.176; 17.608; 13.305
90; 95.426; 90		2606.5Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550109 CIFC31 H34 N2 O6.47P 1 21/c 111.487; 17.514; 13.31
90; 95.95; 90		2663Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550110 CIFC31 H34 N2 O7P 1 21/c 111.195; 17.69; 13.449
90; 94.4; 90		2656Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550111 CIFC31 H33 N2 O7P 1 21/c 111.475; 17.669; 13.248
90; 94.87; 90		2676Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550112 CIFC31 H34.12 N2 O6.33P 1 21/c 111.296; 17.807; 13.459
90; 95.99; 90		2692.5Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550113 CIFC31 H34 N2 O6.17P 1 21/c 111.199; 17.71; 13.4
90; 94.85; 90		2648Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550114 CIFC31 H34 N2 O6.27P 1 21/c 111.369; 17.66; 13.539
90; 95.632; 90		2705.2Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550115 CIFC31 H34 N2 O6.46P 1 21/c 111.102; 17.701; 13.437
90; 94.667; 90		2632Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550116 CIFC31 H34 N2 O6.4P 1 21/c 111.41; 17.772; 13.55
90; 95.891; 90		2733.1Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550117 CIFC31 H34 N2 O6.81P 1 21/c 111.405; 17.746; 13.511
90; 95.49; 90		2721.99Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550118 CIFC62 H68.91 N4 O13.03P 1 21 111.246; 17.607; 13.523
90; 94.19; 90		2671Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550119 CIFC31 H34 N2 O7P 1 21/c 111.319; 17.672; 13.391
90; 93.9; 90		2672.4Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550120 CIFC31.1 H33.33 N2 O6.35P 1 21/c 111.153; 17.701; 13.336
90; 95.232; 90		2621.8Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550121 CIFC31 H34 N2 O6.69P 1 21/c 111.404; 17.591; 13.269
90; 95.526; 90		2649Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550122 CIFC62 H67.8 N4 O12.63P 1 21 111.237; 17.571; 13.374
90; 94.584; 90		2632.2Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550123 CIFC31 H34 N2 O6.49P 1 21/c 111.279; 17.633; 13.377
90; 94.51; 90		2652Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550124 CIFC31 H34 N2 O8P 1 21/c 111.074; 17.895; 14
90; 92.859; 90		2770.9Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550129 CIF
HKL
Paper		C12 H8 Br2 N2 OP 1 21/n 13.8938; 5.8223; 25.8645
90; 92.044; 90		586Goswami, Shailesh K.; Hanton, Lyall R.; McAdam, C. John; Moratti, Stephen C.; Simpson, Jim
(<i>Z</i>)-1,2-Bis(3-bromophenyl)diazene 1-oxide
IUCrData, 2018, 3, x181486
1550130 CIF
HKL
Paper		C13 H10 Cl N OP -19.7335; 10.6473; 24.7554
87.443; 84.272; 62.978		2274.1Javed, Saleem; Faizi, Md. Serajul Haque; Nazia, Siddiqui; Iskenderov, Turganbay
2-Amino-5-chlorobenzophenone
IUCrData, 2018, 3, x181444
1550139 CIFC29 H25 N O2 PtC 1 2/c 146.3286; 5.1027; 20.9343
90; 114.049; 90		4519.3Mayder, Don M.; Thompson, Kyle A.; Christopherson, Cheyenne J.; Paisley, Nathan R.; Hudson, Zachary M.
An efficient room-temperature synthesis of highly phosphorescent styrenic Pt(ii) complexes and their polymerization by ATRP
Polymer Chemistry, 2018, 9, 5418
1550140 CIFC25 H21 F2 N O2 PtP n a 2127.0937; 11.3331; 6.7354
90; 90; 90		2068.14Mayder, Don M.; Thompson, Kyle A.; Christopherson, Cheyenne J.; Paisley, Nathan R.; Hudson, Zachary M.
An efficient room-temperature synthesis of highly phosphorescent styrenic Pt(ii) complexes and their polymerization by ATRP
Polymer Chemistry, 2018, 9, 5418
1550141 CIFC25 H23 N O2 PtP n a 2126.595; 11.416; 6.7344
90; 90; 90		2044.6Mayder, Don M.; Thompson, Kyle A.; Christopherson, Cheyenne J.; Paisley, Nathan R.; Hudson, Zachary M.
An efficient room-temperature synthesis of highly phosphorescent styrenic Pt(ii) complexes and their polymerization by ATRP
Polymer Chemistry, 2018, 9, 5418
1550142 CIFC26 H25 N O3 PtP 1 21/c 113.1943; 14.617; 23.1255
90; 92.449; 90		4455.9Mayder, Don M.; Thompson, Kyle A.; Christopherson, Cheyenne J.; Paisley, Nathan R.; Hudson, Zachary M.
An efficient room-temperature synthesis of highly phosphorescent styrenic Pt(ii) complexes and their polymerization by ATRP
Polymer Chemistry, 2018, 9, 5418
1550143 CIFC24 H22 N2 O4 PdP -18.3132; 10.841; 12.801
110.224; 92.769; 105.358		1031.34Ding, Lin; Cheng, Hailong; Li, Yanqing; Tanaka, Ryo; Shiono, Takeshi; Cai, Zhengguo
Efficient ethylene copolymerization with polar monomers using palladium anilinonaphthoquinone catalysts
Polymer Chemistry, 2018, 9, 5476
1550144 CIFC28 H30 N2 O2 PdC 1 2/c 115.029; 21.2571; 15.4985
90; 94.786; 90		4934.1Ding, Lin; Cheng, Hailong; Li, Yanqing; Tanaka, Ryo; Shiono, Takeshi; Cai, Zhengguo
Efficient ethylene copolymerization with polar monomers using palladium anilinonaphthoquinone catalysts
Polymer Chemistry, 2018, 9, 5476
1550145 CIFC49 H40 N2 O2 PdP -110.4912; 13.4734; 14.7253
94.369; 109.58; 90.382		1954.24Ding, Lin; Cheng, Hailong; Li, Yanqing; Tanaka, Ryo; Shiono, Takeshi; Cai, Zhengguo
Efficient ethylene copolymerization with polar monomers using palladium anilinonaphthoquinone catalysts
Polymer Chemistry, 2018, 9, 5476
1550146 CIF
Paper		C16 H14 O3P -16.0671; 7.5611; 13.8523
92.078; 93.838; 90.994		633.49Pawledzio, Sylwia; Makal, Anna; Trzybiński, Damian; Woźniak, Krzysztof
Crystal structure, interaction energies and experimental electron density of the popular drug ketoprophen
IUCrJ, 2018, 5
1550147 CIFC16 H14 O3P 21 21 216.113; 7.3809; 55.524
90; 90; 90		2505.2Pawledzio, Sylwia; Makal, Anna; Trzybiński, Damian; Woźniak, Krzysztof
Crystal structure, interaction energies and experimental electron density of the popular drug ketoprophen
IUCrJ, 2018, 5
1550148 CIFC16 H14 O3P 21 21 216.113; 7.3809; 55.524
90; 90; 90		2505.2Pawledzio, Sylwia; Makal, Anna; Trzybiński, Damian; Woźniak, Krzysztof
Crystal structure, interaction energies and experimental electron density of the popular drug ketoprophen
IUCrJ, 2018, 5
1550169 CIF
HKL
Paper		C10 H28 Cl6 N6 TeF d d d7.3899; 22.447; 28.512
90; 90; 90		4729.6Giltzau, Niels Ole; Köckerling, Martin
Bis(tetramethylguanidinium) hexachloridotellurate(IV)
IUCrData, 2018, 3, x181488
1550170 CIFC85 H89.5 B Cu2 F24.5 Zn5C 1 c 123.729; 22.495; 36.442
90; 90.573; 90		19451Banh, Hung; Hornung, Julius; Kratz, Thilo; Gemel, Christian; Pöthig, Alexander; Gam, Franck; Kahlal, Samia; Saillard, Jean-Yves; Fischer, Roland A.
Embryonic brass: pseudo two electron Cu/Zn clusters.
Chemical science, 2018, 9, 8906-8913
1550171 CIFC50 H75 Cu3 Zn4P 1 n 116.1793; 37.93; 17.4798
90; 105.636; 90		10330Banh, Hung; Hornung, Julius; Kratz, Thilo; Gemel, Christian; Pöthig, Alexander; Gam, Franck; Kahlal, Samia; Saillard, Jean-Yves; Fischer, Roland A.
Embryonic brass: pseudo two electron Cu/Zn clusters.
Chemical science, 2018, 9, 8906-8913
1550172 CIFO7 Re Yb3C 2 2 2110.4422; 7.4149; 7.4123
90; 90; 90		573.92Inabayashi, M.; Doi, Y.; Wakeshima, M.; Hinatsu, Y.
Magnetic properties of rare earth rhenium oxides Ln3ReO7 (Ln = Y, Er-Lu) with fluorite-related structure
Journal of the Ceramic Society of Japan, 2018, 126, 920-924
1550173 CIFO7 Re Yb3F m -3 m5.195; 5.195; 5.195
90; 90; 90		140.203Inabayashi, M.; Doi, Y.; Wakeshima, M.; Hinatsu, Y.
Magnetic properties of rare earth rhenium oxides Ln3ReO7 (Ln = Y, Er-Lu) with fluorite-related structure
Journal of the Ceramic Society of Japan, 2018, 126, 920-924
1550183 CIFC78 H67 In2 N7 O16C 1 2/c 123.254; 22.981; 17.777
90; 98.488; 90		9396Maka, Vijay Kumar; Mukhopadhyay, Arindam; Savitha, Govardhan; Moorthy, Jarugu Narasimha
Fluorescent 2D metal-organic framework nanosheets (MONs): design, synthesis and sensing of explosive nitroaromatic compounds (NACs).
Nanoscale, 2018, 10, 22389-22399
1550197 CIFC154 H154 Ag30 F24 N4 O28 S20P 1 21/n 119.8067; 21.3657; 24.6098
90; 94.909; 90		10376.3Zang, Shuang-Quan; Xi, Xiao-Juan; Yang, Jin-Sen; Wang, Jia-Yin; Dong, Xi-Yan
New stable isomorphous Ag34 and Ag33Au nanoclusters with open shell electronic structure
Nanoscale, 2018
1550198 CIFC162 H168 Ag34 F27 N6 O24 S20R -3 c30.37; 30.37; 39.4849
90; 90; 120		31539.2Zang, Shuang-Quan; Xi, Xiao-Juan; Yang, Jin-Sen; Wang, Jia-Yin; Dong, Xi-Yan
New stable isomorphous Ag34 and Ag33Au nanoclusters with open shell electronic structure
Nanoscale, 2018
1550199 CIFC162 H168 Ag33 Au F27 N6 O24 S20R -3 c30.3706; 30.3706; 39.4126
90; 90; 120		31482.7Zang, Shuang-Quan; Xi, Xiao-Juan; Yang, Jin-Sen; Wang, Jia-Yin; Dong, Xi-Yan
New stable isomorphous Ag34 and Ag33Au nanoclusters with open shell electronic structure
Nanoscale, 2018
1550200 CIF
HKL
Paper		C7 H9 I N2 SC 1 2/c 119.6249; 7.2198; 14.9117
90; 108.592; 90		2002.5Shotonwa, Ibukun O.; Boeré, René T.
1-Methyl-4-thiocarbamoylpyridin-1-ium iodide
IUCrData, 2018, 3
1550205 CIFC22 H38 N4 O2P b c a8.9115; 16.2345; 32.4328
90; 90; 90		4692.17Dawn, Arnab; Mirzamani, Marzieh; Jones, Christopher D.; Yufit, Dmitry S.; Qian, Shuo; Steed, Jonathan W.; Kumari, Harshita
Investigating the effect of supramolecular gel phase crystallization on gel nucleation.
Soft matter, 2018, 14, 9489-9497
1550216 CIF
HKL
Paper		C19 H37 Cl2 Co Li N2 O3P 1 21/n 110.0535; 12.3705; 19.236
90; 104.476; 90		2316.4Vinocour, Felipe A.; Soto-Navarro, Andrea; Pineda, Leslie W.
μ2-Chlorido-chlorido(μ2-4-{[2-(diethylamino)ethyl]imino}pent-2-en-2-olato)bis(tetrahydrofuran-κO)cobalt(II)lithium
IUCrData, 2018, 3
1550217 CIF
HKL
Paper		C16 H14 O2P 1 21 110.1497; 5.1276; 11.6896
90; 99.541; 90		599.95Detert, Heiner; Schollmeyer, Dieter
The <i>rel-R</i>,<i>R</i>-enantiomer of 7-[7-hydroxybicyclo[4.2.0]octa-1(6),2,4-trien-7-yl]bicyclo[4.2.0]octa-1(6),2,4-trien-7-ol
IUCrData, 2018, 3, x181550
1550236 CIFC22 H23 NP -19.7438; 9.9224; 10.984
64.086; 78.354; 63.503		854.8Abdellah, Ibrahim; Poater, Albert; Lohier, Jean-François; Gaumont, Annie-Claude
Au(i)-Catalyzed hydroarylation of alkenes with N,N-dialkylanilines: a dual gold catalysis concept
Catalysis Science & Technology, 2018, 8, 6486
1550237 CIFC24 H27 NP -18.3046; 10.7954; 12.0469
109.64; 100.96; 104.352		940.16Abdellah, Ibrahim; Poater, Albert; Lohier, Jean-François; Gaumont, Annie-Claude
Au(i)-Catalyzed hydroarylation of alkenes with N,N-dialkylanilines: a dual gold catalysis concept
Catalysis Science & Technology, 2018, 8, 6486
1550250 CIFC252 H264 O48P 1 21/n 119.45; 33.881; 34.509
90; 103.592; 90		22104Naulet, Guillaume; Sturm, Ludmilla; Robert, Antoine; Dechambenoit, Pierre; Röhricht, Fynn; Herges, Rainer; Bock, Harald; Durola, Fabien
Cyclic tris-[5]helicenes with single and triple twisted Möbius topologies and Möbius aromaticity.
Chemical science, 2018, 9, 8930-8936
1550251 CIFC104.5 H86.5 Cl7.5 O24P -115.6031; 23.6859; 26.9809
84.266; 75.642; 75.481		9343.9Naulet, Guillaume; Sturm, Ludmilla; Robert, Antoine; Dechambenoit, Pierre; Röhricht, Fynn; Herges, Rainer; Bock, Harald; Durola, Fabien
Cyclic tris-[5]helicenes with single and triple twisted Möbius topologies and Möbius aromaticity.
Chemical science, 2018, 9, 8930-8936
1550273 CIF
HKL
Paper		C16 H14 OP 21 21 217.485; 9.173; 16.995
90; 90; 90		1166.9Umaña, Christian A.; Pineda, Leslie W.; Cabezas, Jorge A.
Homopropargyl alcohol 1,1-diphenylbut-3-yn-1-ol
IUCrData, 2018, 3, x181619
1550274 CIF
HKL		C19 H18 O7P 1 21/c 112.1143; 9.8134; 14.2602
90; 95.116; 90		1688.53Abou, Akoun; Akonan, Ludovic; Koblavi-Mansilla, Frédérica; N'gouan, Aka Joseph; Kambo, Konan René
3-Hydroxy-3-methylisochroman-1-one‒2-(carboxymethyl)benzoic acid (1/1)
IUCrData, 2018, 3, x181653
1550275 CIF
HKL
Paper		C20 H16 O SP 1 21/n 19.424; 16.0262; 20.8913
90; 99.042; 90		3116Umaña, Christian A.; Pineda, Leslie W.; Cabezas, Jorge A.
1,1-Diphenyl-4-(thiophen-2-yl)but-3-yn-1-ol
IUCrData, 2018, 3, x181616
1550276 CIF
HKL
Paper		C2 H10 N4 O8 S4P -15.1371; 9.5237; 12.9884
106.521; 96.067; 95.618		600.32Zouihri, Hafid; El Korchi, Khadija; Yamni, Khalid; Tijani, Najib
Dithiobis(formamidinium) bis(hydrogen sulfate)
IUCrData, 2018, 3, x181540
1550277 CIF
HKL
Paper		C17 H16 O2P 1 21/c 17.9772; 22.8528; 7.3075
90; 92.791; 90		1330.59Umaña, Christian A.; Pineda, Leslie W.; Cabezas, Jorge A.
Homopropargyl alcohol 5,5-diphenylpent-2-yne-1,5-diol
IUCrData, 2018, 3, x181618
1550278 CIF
HKL
Paper		C6 H7 N5 OP -16.5921; 8.3935; 13.185
92.023; 98.309; 99.741		710.1Lahmidi, Sanae; El Hafi, Mohamed; kheira Sebbar, Nada; Abad, Nadeem; Essassi, El Mokhtar; Mague, Joel T.
2-Amino-5-methyl-1,2,4-triazolo[1,5-<i>a</i>]pyrimidin-7(4<i>H</i>)-one
IUCrData, 2018, 3, x181500
1550294 CIF
HKL
Paper		C19 H22 O2P 1 21/c 110.865; 14.3936; 9.8008
90; 111.68; 90		1424.3Kotha, Sambasivarao; Gunta, Rama; Cheekatla, Subba Rao; Mhatre, Darshan S.
Spiro[cyclopentane-1,11'-hexacyclo[7.6.0.0^1,6^.0^6,13^.0^8,12^.0^10,14^]pentadecane]-7',15'-dione
IUCrData, 2018, 3, x181590
1550295 CIF
HKL
Paper		Ca2 Cl2 Cu O2I 4/m m m3.868; 3.868; 15.0321
90; 90; 90		224.9Baptiste, Benoît; Azuma, Masaki; Yu, Runze; Giura, Paola; d'Astuto, Matteo
Ca2CuO2Cl2, a redetermination from single-crystal X-ray diffraction data
IUCrData, 2018, 3
1550311 CIF
HKL
Paper		C17 H16 N2 O2P 1 21/n 18.1914; 9.5151; 17.781
90; 94.88; 90		1380.9Abad, Nadeem; Ramli, Youssef; Lahmidi, Sanae; El Hafi, Mohamed; Essassi, El Mokhtar; Mague, Joel T.
1-(3-Hydroxypropyl)-3-phenylquinoxalin-2(1<i>H</i>)-one
IUCrData, 2018, 3, x181633
1550312 CIF
HKL
Paper		C19 H17 N3 SP -17.6672; 9.9098; 11.4101
82.548; 78.176; 76.607		822.39Loubidi, Mohamed; Jouha, Jabrane; Tber, Zahira; El Hafi, Mohamed; Essassi, El Mokhtar; Mague, Joel T.
3,4,6-Trimethyl-1-phenyl-5-(thiophen-3-yl)-1<i>H</i>-pyrazolo[3,4-<i>b</i>]pyridine
IUCrData, 2018, 3, x181593
1550313 CIF
HKL
Paper		C13 H12 Cl N3 O2P 21 21 216.4405; 7.266; 28.081
90; 90; 90		1314.1Stondus, Jigmat; Anthal, Sumati; Jayashree, A.; Narayana, B.; Sarojini, B. K.; Kant, Rajni
Polymorph of (<i>E</i>)-<i>N</i>'-(4-chlorobenzylidene)isonicotinohydrazide monohydrate
IUCrData, 2018, 3, x181634
1550314 CIF
HKL
Paper		C10 H12 O3P 21 21 215.4774; 11.1557; 14.561
90; 90; 90		889.74Abdou, Moaz M.; Matziari, Magdalini; O'Neill, Paul M.; Amigues, Eric; Zhou, Ruixue; Wang, Ruiyao; Ali, Basem F.
Methyl 3-(4-hydroxyphenyl)propionate
IUCrData, 2018, 3, x181662
1550315 CIFC276 H200 Ag44 F30 P4 S30P -120.901; 21.475; 22.535
95.04; 114.57; 117.69		7633Dell'Elce, Simone; Liscio, Fabiola; Kovtun, Alessandro; Allegri, Stefano; Roscioni, Otello M.; Albonetti, Cristiano; De Luca, Giovanna; Amenitsch, Heinz W.; Demitri, Nicola; Giorgini, Loris; Morandi, Vittorio; Stellacci, Francesco; Liscio, Andrea; Palermo, Vincenzo
3D to 2D reorganization of silver-thiol nanostructures, triggered by solvent vapor annealing.
Nanoscale, 2018, 10, 23018-23026
1550316 CIFC276 H200 Ag44 F30 P4 S30P -120.4051; 20.8665; 21.9791
114.956; 93.756; 116.423		7219.1Dell'Elce, Simone; Liscio, Fabiola; Kovtun, Alessandro; Allegri, Stefano; Roscioni, Otello M.; Albonetti, Cristiano; De Luca, Giovanna; Amenitsch, Heinz W.; Demitri, Nicola; Giorgini, Loris; Morandi, Vittorio; Stellacci, Francesco; Liscio, Andrea; Palermo, Vincenzo
3D to 2D reorganization of silver-thiol nanostructures, triggered by solvent vapor annealing.
Nanoscale, 2018, 10, 23018-23026
1550317 CIFBi H O5 SC 1 2/m 16.447; 7.2778; 8.6251
90; 106.711; 90		387.598Yamamoto, Y.; Withanage, W.I.U.; Takei, T.; Yanagida, S.; Kumada, N.; Yamane, H.
Hydrothermal reaction of NaBiO3*nH2O with transition-metal (Co, Ni, Cu) salts
Journal of the Ceramic Society of Japan, 2018, 126, 1005-1012
1550332 CIFC4.32 H2.64 Ca O5I -4 2 d13.61515; 13.61515; 7.67903
90; 90; 90		1423.48Rui-Biao Lin; Libo Li; Hao-Long Zhou; Hui Wu; Chaohui He; Shun Li; Rajamani Krishna; Jinping Li; Wei Zhou; Banglin Chen
Molecular sieving of ethylene from ethane using a rigid metal-organic framework
Nature Materials, 2018, 17, 1128-1133
1550333 CIFC4.4 H2.8 Ca O5I -4 2 d13.6335; 13.6335; 7.6869
90; 90; 90		1428.8Rui-Biao Lin; Libo Li; Hao-Long Zhou; Hui Wu; Chaohui He; Shun Li; Rajamani Krishna; Jinping Li; Wei Zhou; Banglin Chen
Molecular sieving of ethylene from ethane using a rigid metal-organic framework
Nature Materials, 2018, 17, 1128-1133
1550334 CIFC4 H2 Ca O5I -4 2 d13.6557; 13.6557; 7.7174
90; 90; 90		1439.13Rui-Biao Lin; Libo Li; Hao-Long Zhou; Hui Wu; Chaohui He; Shun Li; Rajamani Krishna; Jinping Li; Wei Zhou; Banglin Chen
Molecular sieving of ethylene from ethane using a rigid metal-organic framework
Nature Materials, 2018, 17, 1128-1133
1550335 CIFC4 Ca O6I -4 2 d13.575; 13.575; 7.687
90; 90; 90		1416.6Rui-Biao Lin; Libo Li; Hao-Long Zhou; Hui Wu; Chaohui He; Shun Li; Rajamani Krishna; Jinping Li; Wei Zhou; Banglin Chen
Molecular sieving of ethylene from ethane using a rigid metal-organic framework
Nature Materials, 2018, 17, 1128-1133
1550336 CIF
HKL
Paper		C9 H11 N O3P 14.8011; 6.5522; 7.5052
93.618; 107.044; 95.658		223.575Baillargeon, Pierre; Rahem, Tarik; Amigo, Carl; Fortin, Daniel; Dory, Yves L.
Polar crystal of vanillylformamide through replacement of the alkene by an isosteric formamide group
IUCrData, 2018, 3, x181630
1550356 CIF
HKL
Paper		C11 H11 N O2P b c m8.3019; 16.628; 6.7622
90; 90; 90		933.5Furuya, Tetsundo; Yagi, Shiomi; Yamazaki, Shu; Haraguchi, Tomoyuki; Akitsu, Takashiro; Mahesha, Ninganayaka; Sagar, Belakavadi K.; Yathirajan, Hemmige S.
Methyl 1-methyl-1<i>H</i>-indole-3-carboxylate
IUCrData, 2018, 3, x181728
1550362 CIF
HKL
Paper		C188 H140 Cl12 N16 O8 Zn3P 1 21/n 120.216; 21.275; 20.821
90; 115.414; 90		8088Makino, Masatomo; Matsubayashi, Kazuhiko; Kodama-Oda, Yukiko; Imawaka, Naoto; Mizuno, Nobuhiro; Kumasaka, Takashi; Yoshino, Katsumi
Construction of a supramolecule comprising [2,3,9,10,16,17,23,24-octakis(2,6-dimethylphenoxy)phthalocyaninato]zinc(II) and (5,10,15,20-tetraphenylporphyrinato)zinc(II)
IUCrData, 2018, 3, x181741
1550363 CIF
HKL
Paper		C10 H13 N O4P 1 21/c 112.996; 9.2813; 8.665
90; 105.503; 90		1007.1Suresh, S.; Pandi, P.; Akilan, R.; Kumar, R. Mohan; Chakkaravarthi, G.
4-Methylanilinium 2-carboxyacetate
IUCrData, 2018, 3, x181714
1550364 CIF
HKL		C11 H8 Cl2 N2 O3P 1 21/c 17.8233; 7.4705; 20.1932
90; 94.866; 90		1175.92Stondus, Jigmat; Anthal, Sumati; Karanth, S.; Narayana, B.; Sarojini, B. K.; Kant, Rajni
2,4-Dichloro-<i>N</i>-(2,5-dioxopyrrolidin-1-yl)benzamide
IUCrData, 2018, 3, x181740
1550365 CIF
HKL
Paper		C10 H10 N2 OP 21 21 217.5676; 10.7802; 11.4092
90; 90; 90		930.77Dioukhane, Khadim; Aouine, Younas; Faraj, Hassane; Alami, Anouar; Essassi, El Mokhtar; Zouihri, Hafid
4-Methyl-1<i>H</i>-1,5-benzodiazepin-2(3<i>H</i>)-one
IUCrData, 2018, 3, x181718
1550374 CIF
HKL
Paper		C22 H28 Cl18 N2 Nb6 O2 S2P 1 21/c 18.711; 24.171; 11.0653
90; 102.598; 90		2273.75Sperlich, Eric; Köckerling, Martin
(C~7~H~6~NS)~2~[Nb~6~Cl~18~]·2C~4~H~8~O: first niobium cluster with an <i>N</i>,<i>S</i>-heterocyclic cation
IUCrData, 2018, 3, x181760
1550385 CIF
HKL
Paper		C5 H10 N2 O3 SP 1 21/n 110.1891; 7.4627; 11.4884
90; 111.635; 90		812.02Hmissa, Taha; Mathivathanan, Logesh; Thompson, Alexander P.; Mirjafari, Arsalan
1-Methyl-1<i>H</i>-imidazol-3-ium methanesulfonate
IUCrData, 2018, 3, x181781
1550386 CIF
Paper		C10 H12 O4P 1 21/n 17.818; 17.017; 8.189
90; 117.459; 90		966.7Xiong, Huiping; Mao, Shilong; Lv, Qianzhou; Zhang, Ning
Crystal structure of the ethyl 2,4-dihydroxy-6-methylbenzoate from <i>Illicium difengpi</i> K.I.B et K.I.M.
IUCrData, 2018, 3, x181776
1550387 CIF
HKL
Paper		C24 H22 N2 O P2P -18.4464; 10.4163; 13.488
71.55; 76.477; 71.75		1057.04Höhne, Martha; Aluri, Bhaskar R.; Spannenberg, Anke; Müller, Bernd H.; Peulecke, Normen; Rosenthal, Uwe
1-Diphenylphosphanyl-2-(diphenylphosphoryl)hydrazine
IUCrData, 2018, 3, x181784
1550511 CIFAl1.89 Ca0.05 Hf0.01 O11 Sc0.06 Si0.13 Ti3.6 Y0.02 Zr1.04P n m a14.0951; 5.8123; 10.0848
90; 90; 90		826.2Griffin, W.L.; Gain, S.E.M.; Bindi, L.; Toledo, V.; Camara, F.; Saunders, M.; O'Reilly, S.Y.
Carmeltazite, ZrAl2Ti4O12, a new mineral trapped in corundum from volcanic rocks of Mt Carmel, Northern Israel
Minerals, 2018, 8, 601-611
1550780 CIFBi0.49 Mg3 Sb1.5 Te0.01P -3 m 14.58315; 4.58315; 7.2728
90; 90; 120		132.3Kanno, Tsutomu; Tamaki, Hiromasa; Sato, Hiroki K.; Kang, Stephen Dongmin; Ohno, Saneyuki; Imasato, Kazuki; Kuo, Jimmy Jiahong; Snyder, G. Jeffrey; Miyazaki, Yuzuru
Enhancement of average thermoelectric figure of merit by increasing the grain-size of Mg3.2Sb1.5Bi0.49Te0.01
Applied Physics Letters, 2018, 112, 033903
1551114 CIFC10 H14 Cu O4P 1 21/n 110.277; 4.643; 11.285
90; 92.48; 90		537.97Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551115 CIFC10 H14 Cu O4P 1 21/n 110.225; 4.708; 11.187
90; 93.01; 90		537.79Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551116 CIFC10 H14 Cu O4P 1 21/n 110.231; 4.7; 11.191
90; 92.95; 90		537.41Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551117 CIFC10 H14 Cu O4P 1 21/n 110.257; 4.678; 11.221
90; 92.81; 90		537.76Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551118 CIFC10 H14 Cu O4P 1 21/n 110.259; 4.673; 11.23
90; 92.77; 90		537.74Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551119 CIFC10 H14 Cu O4P 1 21/n 110.238; 4.691; 11.211
90; 92.85; 90		537.76Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551120 CIFC10 H14 Cu O4P 1 21/n 110.25; 4.683; 11.213
90; 92.77; 90		537.6Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551121 CIFC10 H14 Cu O4P 1 21/n 110.268; 4.674; 11.227
90; 92.56; 90		538.28Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551122 CIFC10 H14 Cu O4P 1 21/n 110.264; 4.664; 11.249
90; 92.6; 90		537.95Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551123 CIFC10 H14 Cu O4P 1 21/n 110.271; 4.654; 11.269
90; 92.46; 90		538.18Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551124 CIFC10 H14 Cu O4P 1 21/n 110.278; 4.629; 11.318
90; 92.33; 90		538.03Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551125 CIFC10 H14 Cu O4P 1 21/n 110.283; 4.618; 11.334
90; 92.26; 90		537.8Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551126 CIFC10 H14 Cu O4P 1 21/n 110.292; 4.605; 11.36
90; 92.17; 90		538.02Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551127 CIFC10 H14 Cu O4P 1 21/n 110.301; 4.594; 11.38
90; 92.07; 90		538.18Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551128 CIFC10 H14 Cu O4P 1 21/n 110.301; 4.58; 11.413
90; 91.95; 90		538.14Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551129 CIFC10 H14 Cu O4P 1 21/n 110.305; 4.573; 11.428
90; 91.94; 90		538.23Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551130 CIFC10 H14 Cu O4P 1 21/n 110.321; 4.563; 11.444
90; 91.68; 90		538.72Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551131 CIFC10 H14 Cu O4P 1 21/n 110.326; 4.558; 11.451
90; 91.63; 90		538.73Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551132 CIFC10 H14 Cu O4P 1 21/n 110.261; 4.668; 11.242
90; 92.72; 90		537.87Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551133 CIFC10 H14 Cu O4P 1 21/n 110.266; 4.659; 11.26
90; 92.63; 90		537.99Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551134 CIFC10 H14 Cu O4P 1 21/n 110.268; 4.654; 11.268
90; 92.61; 90		537.91Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551135 CIFC10 H14 Cu O4P 1 21/n 110.27; 4.65; 11.282
90; 92.55; 90		538.24Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551136 CIFC10 H14 Cu O4P 1 21/n 110.276; 4.64; 11.298
90; 92.49; 90		538.19Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551137 CIFC10 H14 Cu O4P 1 21/n 110.279; 4.633; 11.311
90; 92.43; 90		538.17Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551138 CIFC10 H14 Cu O4P 1 21/n 110.287; 4.615; 11.348
90; 92.26; 90		538.32Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551139 CIFC10 H14 Cu O4P 1 21/n 110.29; 4.611; 11.357
90; 92.22; 90		538.45Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551140 CIFC10 H14 Cu O4P 1 21/n 110.293; 4.603; 11.372
90; 92.14; 90		538.41Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551141 CIFC10 H14 Cu O4P 1 21/n 110.296; 4.599; 11.38
90; 92.1; 90		538.5Anna Worthy; Arnaud Grosjean; Michael C. Pfrunder; Yanan Xu; Cheng Yan; Grant Edwards; Jack K. Clegg; John C. McMurtrie
Atomic resolution of structural changes in elastic crystals of copper(II) acetylacetonate
Nature Chemistry, 2018, 10, 65-69
1551294 CIFGe O3 SrP m -3 m3.7921; 3.7921; 3.7921
90; 90; 90		54.53Nakatsuka, A.; Yoshiasa, A.; Fujiwara, K.; Ohtaka, O.
Variable-temperature single-crystal X-ray diffraction study of SrGeO3 high-pressure perovskite phase Note: T = 100 K
Journal of Mineralogical and Petrological Sciences, 2018, 113, 280-285
1551295 CIFGe O3 SrP m -3 m3.7922; 3.7922; 3.7922
90; 90; 90		54.535Nakatsuka, A.; Yoshiasa, A.; Fujiwara, K.; Ohtaka, O.
Variable-temperature single-crystal X-ray diffraction study of SrGeO3 high-pressure perovskite phase Note: T = 123 K
Journal of Mineralogical and Petrological Sciences, 2018, 113, 280-285
1551296 CIFGe O3 SrP m -3 m3.793; 3.793; 3.793
90; 90; 90		54.569Nakatsuka, A.; Yoshiasa, A.; Fujiwara, K.; Ohtaka, O.
Variable-temperature single-crystal X-ray diffraction study of SrGeO3 high-pressure perovskite phase Note: T = 173 K
Journal of Mineralogical and Petrological Sciences, 2018, 113, 280-285
1551297 CIFGe O3 SrP m -3 m3.7946; 3.7946; 3.7946
90; 90; 90		54.638Nakatsuka, A.; Yoshiasa, A.; Fujiwara, K.; Ohtaka, O.
Variable-temperature single-crystal X-ray diffraction study of SrGeO3 high-pressure perovskite phase Note: T = 223 K
Journal of Mineralogical and Petrological Sciences, 2018, 113, 280-285
1551298 CIFGe O3 SrP m -3 m3.7964; 3.7964; 3.7964
90; 90; 90		54.716Nakatsuka, A.; Yoshiasa, A.; Fujiwara, K.; Ohtaka, O.
Variable-temperature single-crystal X-ray diffraction study of SrGeO3 high-pressure perovskite phase Note: T = 273 K
Journal of Mineralogical and Petrological Sciences, 2018, 113, 280-285
1551299 CIFGe O3 SrP m -3 m3.7974; 3.7974; 3.7974
90; 90; 90		54.759Nakatsuka, A.; Yoshiasa, A.; Fujiwara, K.; Ohtaka, O.
Variable-temperature single-crystal X-ray diffraction study of SrGeO3 high-pressure perovskite phase Note: T = 298 K
Journal of Mineralogical and Petrological Sciences, 2018, 113, 280-285
1551300 CIFGe O3 SrP m -3 m3.7988; 3.7988; 3.7988
90; 90; 90		54.82Nakatsuka, A.; Yoshiasa, A.; Fujiwara, K.; Ohtaka, O.
Variable-temperature single-crystal X-ray diffraction study of SrGeO3 high-pressure perovskite phase Note: T = 323 K
Journal of Mineralogical and Petrological Sciences, 2018, 113, 280-285
1551337 CIFC260 H304 N32 O83 P16P -122.058; 36.936; 39.49
91.137; 101.582; 105.808		30232Krzysztof Ziach; Celine Chollet; Vincent Parissi; Panchami Prabhakaran; Mathieu Marchivie; Valentina Corvaglia; Partha Pratim Bose; Katta Laxmi-Reddy; Frederic Godde; Jean-Marie Schmitter; Stephane Chaignepain; Philippe Pourquier; Ivan Huc
Single helically folded aromatic oligoamides that mimic the charge surface of double-stranded B-DNA
Nature Chemistry, 2018, 10, 511-518
1551338 CIFC259 H311 Cl3 N32 O83 P16 SiC 1 2/c 142.984; 52.9718; 33.962
90; 126.304; 90		62319Krzysztof Ziach; Celine Chollet; Vincent Parissi; Panchami Prabhakaran; Mathieu Marchivie; Valentina Corvaglia; Partha Pratim Bose; Katta Laxmi-Reddy; Frederic Godde; Jean-Marie Schmitter; Stephane Chaignepain; Philippe Pourquier; Ivan Huc
Single helically folded aromatic oligoamides that mimic the charge surface of double-stranded B-DNA
Nature Chemistry, 2018, 10, 511-518
1551339 CIFC508 H592 N64 O163 P32P -126.415; 28.192; 42.64
85.65; 75.41; 75.48		29745Krzysztof Ziach; Celine Chollet; Vincent Parissi; Panchami Prabhakaran; Mathieu Marchivie; Valentina Corvaglia; Partha Pratim Bose; Katta Laxmi-Reddy; Frederic Godde; Jean-Marie Schmitter; Stephane Chaignepain; Philippe Pourquier; Ivan Huc
Single helically folded aromatic oligoamides that mimic the charge surface of double-stranded B-DNA
Nature Chemistry, 2018, 10, 511-518
1551340 CIFC140 H168 N16 O39 P8P -117.006; 20.157; 24.463
75.85; 69.66; 85.93		7623Krzysztof Ziach; Celine Chollet; Vincent Parissi; Panchami Prabhakaran; Mathieu Marchivie; Valentina Corvaglia; Partha Pratim Bose; Katta Laxmi-Reddy; Frederic Godde; Jean-Marie Schmitter; Stephane Chaignepain; Philippe Pourquier; Ivan Huc
Single helically folded aromatic oligoamides that mimic the charge surface of double-stranded B-DNA
Nature Chemistry, 2018, 10, 511-518
1551341 CIFC127 H128 Cl0 N20 O24P 1 21/c 117.041; 52.198; 14.911
90; 106.91; 90		12690Soumen De; Bo Chi; Thierry Granier; Ting Qi; Victor Maurizot; Ivan Huc
Designing cooperatively folded abiotic uni- and multimolecular helix bundles
Nature Chemistry, 2018, 10, 51-57
1551342 CIFC238 H226 N40 O44P 1 21/n 127.392; 35.87; 28.337
90; 90.14; 90		27842Soumen De; Bo Chi; Thierry Granier; Ting Qi; Victor Maurizot; Ivan Huc
Designing cooperatively folded abiotic uni- and multimolecular helix bundles
Nature Chemistry, 2018, 10, 51-57
1551343 CIFC488 H460 Cl12 N80 O88P 329.331; 29.331; 59.183
90; 90; 120		44094Soumen De; Bo Chi; Thierry Granier; Ting Qi; Victor Maurizot; Ivan Huc
Designing cooperatively folded abiotic uni- and multimolecular helix bundles
Nature Chemistry, 2018, 10, 51-57
1551344 CIFC256 H246 N44 O46P -119.1113; 28.614; 35.75
71.488; 81.839; 75.011		17869Soumen De; Bo Chi; Thierry Granier; Ting Qi; Victor Maurizot; Ivan Huc
Designing cooperatively folded abiotic uni- and multimolecular helix bundles
Nature Chemistry, 2018, 10, 51-57
1551345 CIFC312 H313 Cl24 N44 O50P 118.008; 18.419; 30.513
78.68; 88.33; 65.83		9039Soumen De; Bo Chi; Thierry Granier; Ting Qi; Victor Maurizot; Ivan Huc
Designing cooperatively folded abiotic uni- and multimolecular helix bundles
Nature Chemistry, 2018, 10, 51-57
1551346 CIFC112 H104 N18 O21P 125.286; 26.901; 27.418
108.71; 107.77; 109.81		14718Soumen De; Bo Chi; Thierry Granier; Ting Qi; Victor Maurizot; Ivan Huc
Designing cooperatively folded abiotic uni- and multimolecular helix bundles
Nature Chemistry, 2018, 10, 51-57
1551362 CIFC12 H10 N2 O2 SP -17.4654; 8.3783; 17.0551
97.595; 100.424; 90.636		1039.27Xiaoyan Wang; Linjiang Chen; Samantha Y. Chong; Marc A. Little; Yongzhen Wu; Wei-Hong Zhu; Rob Clowes; Yong Yan; Martijn A. Zwijnenburg; Reiner Sebastian Sprick; Andrew I. Cooper
Sulfone-containing covalent organic frameworks for photocatalytic hydrogen evolution from water
Nature Chemistry, 2018, 10, 1180-1189
1551363 CIFC18 H12 N2 O4 S2P 1 21/c 15.8666; 10.0313; 13.5015
90; 97.082; 90		788.5Xiaoyan Wang; Linjiang Chen; Samantha Y. Chong; Marc A. Little; Yongzhen Wu; Wei-Hong Zhu; Rob Clowes; Yong Yan; Martijn A. Zwijnenburg; Reiner Sebastian Sprick; Andrew I. Cooper
Sulfone-containing covalent organic frameworks for photocatalytic hydrogen evolution from water
Nature Chemistry, 2018, 10, 1180-1189
1551369 CIFC144.25 H160 Br0.8 N36.25 O69.5 S2P -119.8457; 23.3538; 27.1601
106.247; 106.538; 101.356		11049.9Joseph M. Rogers; Sunbum Kwon; Simon J. Dawson; Pradeep K. Mandal; Hiroaki Suga; Ivan Huc
Ribosomal synthesis and folding of peptide-helical aromatic foldamer hybrids
Nature Chemistry, 2018, 10, 405-412
1551398 CIFC17 H18 N2 O3P 1 21 110.5311; 6.7935; 10.9017
90; 112.687; 90		719.593David L. Niquille; Douglas A. Hansen; Takahiro Mori; David Fercher; Hajo Kries; Donald Hilvert
Nonribosomal biosynthesis of backbone-modified peptides
Nature Chemistry, 2018, 10, 282-287
1551399 CIFC14 H16 N2 O2P 21 21 217.1977; 9.65236; 18.11426
90; 90; 90		1258.48David L. Niquille; Douglas A. Hansen; Takahiro Mori; David Fercher; Hajo Kries; Donald Hilvert
Nonribosomal biosynthesis of backbone-modified peptides
Nature Chemistry, 2018, 10, 282-287
1551403 CIFC29 H29 F6 N5 O8 S2 ZnP 1 21/c 113.9006; 16.113; 17.2618
90; 93.095; 90		3860.7Meghan B. Ward; Andreas Scheitler; Meng Yu; Laura Senft; Annika S. Zillmann; John D. Gorden; Dean D. Schwartz; Ivana Ivanovic-Burmazovic; Christian R. Goldsmith
Superoxide dismutase activity enabled by a redox-active ligand rather than metal
Nature Chemistry, 2018, 10, 1207-1212
1551404 CIF
HKL		C31 H34 F6 N6 O9 S2 ZnP c a 2116.6985; 12.4092; 17.7201
90; 90; 90		3671.9Meghan B. Ward; Andreas Scheitler; Meng Yu; Laura Senft; Annika S. Zillmann; John D. Gorden; Dean D. Schwartz; Ivana Ivanovic-Burmazovic; Christian R. Goldsmith
Superoxide dismutase activity enabled by a redox-active ligand rather than metal
Nature Chemistry, 2018, 10, 1207-1212
1551405 CIF
HKL		C28 H33 N5 O3P -110.2291; 11.3937; 12.5182
93.769; 113.627; 103.02		1282.25Meghan B. Ward; Andreas Scheitler; Meng Yu; Laura Senft; Annika S. Zillmann; John D. Gorden; Dean D. Schwartz; Ivana Ivanovic-Burmazovic; Christian R. Goldsmith
Superoxide dismutase activity enabled by a redox-active ligand rather than metal
Nature Chemistry, 2018, 10, 1207-1212
1551413 CIFC21 H15 N3 O3 PdP 1 n 115.0023; 6.9693; 17.7197
90; 112.945; 90		1706.1Van T. Tran; John A. Gurak Jr; Kin S. Yang; Keary M. Engle
Activation of diverse carbon-heteroatom and carbon-carbon bonds via palladium(ii)-catalysed beta-X elimination
Nature Chemistry, 2018, 10, 1126-1133
1551414 CIFC46 H38 N6 O10 Pd2P -110.5489; 10.6184; 19.274
76.628; 84.772; 81.899		2075.6Van T. Tran; John A. Gurak Jr; Kin S. Yang; Keary M. Engle
Activation of diverse carbon-heteroatom and carbon-carbon bonds via palladium(ii)-catalysed beta-X elimination
Nature Chemistry, 2018, 10, 1126-1133
1551447 CIF
HKL		C20 H10 Br4C 1 2/c 121.255; 5.7151; 18.8051
90; 124.093; 90		1891.7Niko Pavlicek; Przemyslaw Gawel; Daniel R. Kohn; Zsolt Majzik; Yaoyao Xiong; Gerhard Meyer; Harry L. Anderson; Leo Gross
Polyyne formation via skeletal rearrangement induced by atomic manipulation
Nature Chemistry, 2018, 10, 853-858
1551448 CIF
HKL		C24 H10 Br4P 1 2/c 112.0069; 3.9729; 22.0798
90; 100.208; 90		1036.58Niko Pavlicek; Przemyslaw Gawel; Daniel R. Kohn; Zsolt Majzik; Yaoyao Xiong; Gerhard Meyer; Harry L. Anderson; Leo Gross
Polyyne formation via skeletal rearrangement induced by atomic manipulation
Nature Chemistry, 2018, 10, 853-858
1551449 CIF
HKL		C28 H10 Br4P 1 21/n 110.6051; 4.9313; 23.4977
90; 98.092; 90		1216.62Niko Pavlicek; Przemyslaw Gawel; Daniel R. Kohn; Zsolt Majzik; Yaoyao Xiong; Gerhard Meyer; Harry L. Anderson; Leo Gross
Polyyne formation via skeletal rearrangement induced by atomic manipulation
Nature Chemistry, 2018, 10, 853-858
1551498 CIFC8 H16 Cl2 Cr N4I m m m6.90351; 6.97713; 10.82548
90; 90; 90		521.428Kasper S. Pedersen; Panagiota Perlepe; Michael L. Aubrey; Daniel N. Woodruff; Sebastian E. Reyes-Lillo; Anders Reinholdt; Laura Voigt; Zheshen Li; Kasper Borup; Mathieu Rouzieres; Dumitru Samohvalov; Fabrice Wilhelm; Andrei Rogalev; Jeffrey B. Neaton; Jeffrey R. Long; Rodolphe Clerac
Formation of the layered conductive magnet CrCl2(pyrazine)2 through redox-active coordination chemistry
Nature Chemistry, 2018, 10, 1056-1061
1551499 CIFC20 H20.5 Cl3 Cr N4 O4.25P 1 21/n 113.4559; 15.142; 23.1601
90; 93.2; 90		4711.5Kasper S. Pedersen; Panagiota Perlepe; Michael L. Aubrey; Daniel N. Woodruff; Sebastian E. Reyes-Lillo; Anders Reinholdt; Laura Voigt; Zheshen Li; Kasper Borup; Mathieu Rouzieres; Dumitru Samohvalov; Fabrice Wilhelm; Andrei Rogalev; Jeffrey B. Neaton; Jeffrey R. Long; Rodolphe Clerac
Formation of the layered conductive magnet CrCl2(pyrazine)2 through redox-active coordination chemistry
Nature Chemistry, 2018, 10, 1056-1061
1551500 CIFC384 H306 F30 Fe6 N36 O24 P5R -3 :H47.726; 47.726; 39.415
90; 90; 120		77750Liang Zhang; Alexander J. Stephens; Alina L. Nussbaumer; Jean-Francois Lemonnier; Pia Jurcek; Inigo J. Vitorica-Yrezabal; David A. Leigh
Stereoselective synthesis of a composite knot with nine crossings
Nature Chemistry, 2018, 10, 1083-1088
1551547 CIFC58 H70 B2 Cl Fe O5 S5P 1 21/n 110.4961; 14.26; 19.166
90; 94.512; 90		2859.8YOSHIDA, Kosuke; MITSUHASHI, Ryoji; MIKURIYA, Masahiro; SAKIYAMA, Hiroshi
Crystal Structure of a Mononuclear Iron(III) Complex, Chloridopentakis(dimethylsulfoxide-κ<i>O</i>)iron(III) Bis(tetraphenylborate)
X-ray Structure Analysis Online, 2018, 34, 1
1551548 CIFC37 H32 Cl Mn2 N3 O7P -110.9807; 12.329; 14.492
80.004; 74.181; 64.614		1701.7SUEMITSU, Yuki; YONEDA, Ko; YAMADA, Yasunori; KOIKAWA, Masayuki
Crystal Structure and Magnetic Properties of an Asymmetrical Dinuclear Mn(III) Complex with <i>N</i>-(2-Oxymethylphenyl)salicylideneimine
X-ray Structure Analysis Online, 2018, 34, 29
1551549 CIFC12 H9 F O S2P 1 21 15.4232; 14.1405; 7.5318
90; 94.198; 90		576.04NAGARAJU, S.; SRIDHAR, M. A.; SREENATHA, N. R.; PRADEEPA KUMARA, C. S.; SADASHIVA, M. P.
Crystal Structure of (4-Fluorophenyl)(2-(methylthio)thiophen-3-yl)methanone
X-ray Structure Analysis Online, 2018, 34, 13
1551550 CIFC28 H40 N4 O16 Pd Ru4P -19.8123; 11.961; 17.645
90.007; 90.634; 108.285		1966.2MIKURIYA, Masahiro; KAWAUCHI, Shun; YOSHIOKA, Daisuke; MITSUHASHI, Ryoji; HANDA, Makoto
Crystal Structure of Mixed-metal Complex of Paddle-wheel-type Dinuclear Ruthenium(II,III) Carboxylate and Tetracyanidopalladate(II)
X-ray Structure Analysis Online, 2018, 34, 37
1551551 CIFC31 H32 Cl3 Cu2 N5 O6P 1 21/c 19.088; 13.296; 29.2
90; 95.131; 90		3514MIKURIYA, Masahiro; SATO, Yuya; YOSHIOKA, Daisuke
μ-Phenolato-μ-acetato-bridged Dinuclear Copper(II) Complex with Dinucleating Schiff-base Ligand Having Three Phenolate Groups
X-ray Structure Analysis Online, 2018, 34, 45
1551552 CIFC16 H16 N2 O3C 1 2/c 119.168; 13.233; 13.141
90; 121.662; 90		2837.1KUBO, Kanji; MATSUMOTO, Taisuke; TAKECHI, Haruko
Crystal Structure of 7-(Diethylamino)-3-(2-oxazolyl)coumarin
X-ray Structure Analysis Online, 2018, 34, 3
1551553 CIFC62 H100 B N8 Na Ni4 O14P -110.841; 19.161; 20.415
116.929; 92.97; 101.485		3655.9MOCHIZUKI, Katsura
Pentanuclear Complex Formed between Dinuclear Nickel(II) Complexes and Sodium Ion
X-ray Structure Analysis Online, 2018, 34, 25
1551554 CIFC16 H14 N2 O5P 1 21/c 15.8658; 17.1661; 15.1938
90; 103.182; 90		1489.6KANSIZ, Sevgi; ÇAKMAK, Sükriye; DEGE, Necmi; MERAL, Güngör; KÜTÜK, Halil
Crystal Structure of 3-Acetoxy-2-methyl-<i>N</i>-(4-nitrophenyl)benzamide
X-ray Structure Analysis Online, 2018, 34, 17
1551555 CIFC18 H18 Cu N4 O2P 1 21/c 19.2964; 10.4722; 8.8271
90; 112.028; 90		796.62MITSUHASHI, Ryoji; MIYAZAKI, Yusuke; HOSOYA, Satoshi; MIKURIYA, Masahiro
Synthesis and Crystal Structure of Bis[2-(2-imidazolinyl)phenolato]copper(II)
X-ray Structure Analysis Online, 2018, 34, 11
1551556 CIFC23 H15 N O3P n 21 a6.9988; 11.4808; 21.7608
90; 90; 90		1748.5RAINA, Ankit; SALIAN, Vinutha V.; NARAYANA, B.; SAROJINI, B. K.; KANT, Rajni
Crystal Structure of (2<i>E</i>)-1-(Anthracen-9-yl)-3-(3-nitrophenyl)prop-2-en-1-one
X-ray Structure Analysis Online, 2018, 34, 5
1551557 CIFC25 H23 Cl3 N4 O2C 1 2/c 127.741; 9.89; 17.904
90; 103.47; 90		4777REDZICKA, Aleksandra; SZCZUKOWSKI, Lukasz; KOCHEL, Andrzej
Crystal Structure of 4,6-Dimethyl-5-(3-chlorophenyl)-2-{[4-(3,4-dichlorophenyl)-1-piperazinyl]methyl}-pyrrolo[3,4-<i>c</i>]pyrrole-1,3(<i>2H,5H</i>)-dione
X-ray Structure Analysis Online, 2018, 34, 55
1551558 CIFC26 H19 Cl2 F6 Fe N5 PC 1 2/c 116.3586; 12.6022; 13.0231
90; 103.676; 90		2608.7KANEKO, Satoshi; MITSUHASHI, Ryoji; MIKURIYA, Masahiro; SAKIYAMA, Hiroshi
Crystal Structure of a Mononuclear Iron(III) Complex, Dichloridobis(1,10-phenanthroline-κ<sup>2</sup><i>N,N</i>′)iron(III) Hexafluoridophosphate‒acetonitrile
X-ray Structure Analysis Online, 2018, 34, 49
1551559 CIFC40 H28 F10 Mg0.5 N2 OC 1 2/c 123.94; 12.007; 23.882
90; 90.795; 90		6864SAWADA, Takuya; AKASHI, Haruo
Synthesis and Crystal Structure of Bis-tetrahydrofuranate-{(5,10,15,20-(tetrakispentafluorophenyl)porphyrinato)magnesium(II)}
X-ray Structure Analysis Online, 2018, 34, 9
1551560 CIFC11 H9 N3 OP 1 21/n 14.541; 19.523; 10.844
90; 97.8; 90		952.5SUGIYAMA, Haruki
Molecular Planarity and Crystal Structures of <i>N</i>-Salicylideneaminopyrazine Derivatives
X-ray Structure Analysis Online, 2018, 34, 57
1551561 CIFC11 H7 Br2 N3 OP 21 21 213.9508; 10.8449; 27.627
90; 90; 90		1183.7SUGIYAMA, Haruki
Molecular Planarity and Crystal Structures of <i>N</i>-Salicylideneaminopyrazine Derivatives
X-ray Structure Analysis Online, 2018, 34, 57
1551562 CIFC21 H20 Cl2 Co N5 O4P -17.085; 12.1656; 13.2186
87.106; 87.83; 77.714		1111.41TOYAMA, Mari
Crystal Structure of <i>cis</i>-Bis(2,2′-bipyridyl)dichlorocobalt(III) Nitrate Methanol Solvate
X-ray Structure Analysis Online, 2018, 34, 41
1551563 CIFC13 H7 F6 NP 1 21/c 116.678; 17.492; 8.286
90; 97.5; 90		2396.6GUILLON, Jean; DASSONVILLE-KLIMPT, Alexandra; MOREAU, Stéphane; LAUMAILLE, Pierre; MARCHIVIE, Mathieu; SONNET, Pascal
Crystal Structure of 2,8-Bis(trifluoromethyl)-4-vinylquinoline
X-ray Structure Analysis Online, 2018, 34, 15
1551564 CIFC34 H31 Cl3 Cu2 N4 O6C 1 2/c 126.016; 15.634; 18.36
90; 109.073; 90		7058MIKURIYA, Masahiro; SATO, Yuya; YOSHIOKA, Daisuke
μ-Phenolato-μ-benzoato-bridged Dinuclear Copper(II) Cluster with a Ferromagnetic Coupling
X-ray Structure Analysis Online, 2018, 34, 51
1551565 CIFC19 H21 Cl N12 O Zn2P 1 21/c 19.2278; 26.069; 10.0068
90; 93.261; 90		2403.3MIKURIYA, Masahiro; SHIBUTANI, Ai; YAMADA, Hitomi; YOSHIOKA, Daisuke
μ-Phenolato-μ-azido-bridged Dinuclear Zinc(II) Complex with a Schiff-base Having Imidazolyl Groups
X-ray Structure Analysis Online, 2018, 34, 33
1551566 CIFC12 H34 Mo3 N4 O9 S2P 1 21/n 116.558; 8.9725; 17.193
90; 90.192; 90		2554.3MIKURIYA, Masahiro; KUSUNOKI, Koji; KOTERA, Takanori; YOSHIOKA, Daisuke; TAKEMURA, Shota; OGASAWARA, Kazuyoshi
Synthesis, Crystal Structure, and Relativistic DV-Xα Calculation of a μ-Oxido-μ-molybdato(VI)-bridged Dinuclear Oxidomolybdenum(V) Complex with 2-(3-Aminopropyl)aminoethanethiol
X-ray Structure Analysis Online, 2018, 34, 19
1551567 CIFC28 H26 N8 O4C 1 2/c 113.669; 17.763; 11.013
90; 108.857; 90		2530.5KADIR, Maisara Abdul; YUSOF, M. Sukeri M.; SUMBY, C. J.
Crystal Structure of 1,2-Bis[<i>N,N</i>′-6-(3-pyridylmethylamido)pyridyl-2-carboxyamido]ethane
X-ray Structure Analysis Online, 2018, 34, 31
1551568 CIFC42 H64 O6P -15.4; 9.659; 37.485
92.51; 90.915; 91.484		1952.3KUBO, Kanji; KURIBAYASHI, Daiki; ISOBE, Masahiro; MATSUMOTO, Taisuke; MORI, Akira
Crystal Structure of 5-[4-(Dodecyloxy)benzoyloxy]-2-(hexadecanoyloxy)tropone
X-ray Structure Analysis Online, 2018, 34, 27
1551569 CIFC14 H12 O2 SP 1 21/c 18.253; 13.153; 14.157
90; 125.579; 90		1249.9SREENATHA, N. R.; LAKSHMINARAYANA, B. N.; GANESHA, D. P.; VIJAYSHANKAR, S.; NAGARAJU, S.
Crystal Structure and Hirshfeld Surfaces of (<i>E</i>)-1-(2-Hydroxyphenyl)-3-(5-methylthiophen-2-yl)prop-2-en-1-one
X-ray Structure Analysis Online, 2018, 34, 23
1551570 CIFC38 H28 Cu F18 Mo3 N4 O15P -112.1206; 14.9911; 16.8782
106.871; 98.131; 109.68		2664.2HANDA, Makoto; KAMADA, Hiroshi; YOSHIOKA, Daisuke; HIROMITSU, Ichiro; KASUGA, Kuninobu; MIKURIYA, Masahiro
Crystal Structure of a Supramolecular Complex Built up from Molybdenum(II) Trifluoroacetate and Copper(II) Schiff-Base Components, [{CuL<sup>t-Bu</sup>}<sub>2</sub>{Mo<sub>2</sub>(O<sub>2</sub>CCF<sub>3</sub>)<sub>4</sub>}<sub>3</sub>(H<sub>2</sub>O)<sub>2</sub>]<sub>n</sub>, H<sub>2</sub>L<sup>t-Bu</sup> = 2,3-bis((5-<i>tert</i>-butyl-2-hydroxybenzylidene)amino)-2,3-butenedinitrile
X-ray Structure Analysis Online, 2018, 34, 59
1551571 CIFC12 H28 Cl N S4P 21 21 214.84742; 10.3753; 36.4017
90; 90; 90		1830.77TOYAMA, Mari; ISONO, Takumi; ICHIYAMA, Atsushi; CHAYAMA, Kenji
Crystal Structure of 9-Aza-3,6,12,15-tetrathiaheptadecane Hydrochloride
X-ray Structure Analysis Online, 2018, 34, 7
1551834 CIFC35 H32 Cl6 N2 O2 Os SP 21 21 217.95564; 16.3879; 26.8668
90; 90; 90		3502.79James P. C. Coverdale; Isolda Romero-Canelon; Carlos Sanchez-Cano; Guy J. Clarkson; Abraha Habtemariam; Martin Wills; Peter J. Sadler
Asymmetric transfer hydrogenation by synthetic catalysts in cancer cells
Nature Chemistry, 2018, 10, 347-354
1551835 CIFC35 H32 Cl6 N2 O2 Os SP 21 21 217.95923; 16.394; 26.878
90; 90; 90		3507.14James P. C. Coverdale; Isolda Romero-Canelon; Carlos Sanchez-Cano; Guy J. Clarkson; Abraha Habtemariam; Martin Wills; Peter J. Sadler
Asymmetric transfer hydrogenation by synthetic catalysts in cancer cells
Nature Chemistry, 2018, 10, 347-354
1551887 CIFC72 H74 Br4 N4 O11C 1 2/c 131.466; 18.3593; 29.875
90; 126.405; 90		13890.4Kelong Zhu; Giorgio Baggi; Stephen J. Loeb
Ring-through-ring molecular shuttling in a saturated [3]rotaxane
Nature Chemistry, 2018, 10, 625-630
1551888 CIFC248 H248 B2 F8 N4 O16P -113.1755; 18.6165; 21.6086
86.0293; 84.4233; 85.0168		5245.3Kelong Zhu; Giorgio Baggi; Stephen J. Loeb
Ring-through-ring molecular shuttling in a saturated [3]rotaxane
Nature Chemistry, 2018, 10, 625-630
1551903 CIFC14 H8 Cl2 Fe N4C 1 2/c 18.368; 8.3711; 21.6926
90; 93.54; 90		1516.65J. Lopez-Cabrelles; S. Manas-Valero; I. J. Vitorica-Yrezabal; P. J. Bereciartua; J. A. Rodriguez-Velamazan; J. C. Waerenborgh; B. J. C. Vieira; D. Davidovikj; P. G. Steeneken; H. S. J. van der Zant; G. Minguez Espallargas; E. Coronado
Isoreticular two-dimensional magnetic coordination polymers prepared through pre-synthetic ligand functionalization
Nature Chemistry, 2018, 10, 1001-1007
1551904 CIFC14 H10 Fe N4C 1 2/c 18.3356; 8.3352; 18.758
90; 96.965; 90		1293.7J. Lopez-Cabrelles; S. Manas-Valero; I. J. Vitorica-Yrezabal; P. J. Bereciartua; J. A. Rodriguez-Velamazan; J. C. Waerenborgh; B. J. C. Vieira; D. Davidovikj; P. G. Steeneken; H. S. J. van der Zant; G. Minguez Espallargas; E. Coronado
Isoreticular two-dimensional magnetic coordination polymers prepared through pre-synthetic ligand functionalization
Nature Chemistry, 2018, 10, 1001-1007
1551905 CIFC16 H12 Fe N4C 1 2/c 18.2809; 8.2718; 21.798
90; 92.418; 90		1491.8J. Lopez-Cabrelles; S. Manas-Valero; I. J. Vitorica-Yrezabal; P. J. Bereciartua; J. A. Rodriguez-Velamazan; J. C. Waerenborgh; B. J. C. Vieira; D. Davidovikj; P. G. Steeneken; H. S. J. van der Zant; G. Minguez Espallargas; E. Coronado
Isoreticular two-dimensional magnetic coordination polymers prepared through pre-synthetic ligand functionalization
Nature Chemistry, 2018, 10, 1001-1007
1551906 CIFC14 H8 Br2 Fe N4C 1 2 18.2958; 8.2991; 22.299
90; 92.44; 90		1533.8J. Lopez-Cabrelles; S. Manas-Valero; I. J. Vitorica-Yrezabal; P. J. Bereciartua; J. A. Rodriguez-Velamazan; J. C. Waerenborgh; B. J. C. Vieira; D. Davidovikj; P. G. Steeneken; H. S. J. van der Zant; G. Minguez Espallargas; E. Coronado
Isoreticular two-dimensional magnetic coordination polymers prepared through pre-synthetic ligand functionalization
Nature Chemistry, 2018, 10, 1001-1007
1551907 CIFC14 H8 Fe N6C 1 2/c 18.2188; 8.217; 21.481
90; 97.66; 90		1437.7J. Lopez-Cabrelles; S. Manas-Valero; I. J. Vitorica-Yrezabal; P. J. Bereciartua; J. A. Rodriguez-Velamazan; J. C. Waerenborgh; B. J. C. Vieira; D. Davidovikj; P. G. Steeneken; H. S. J. van der Zant; G. Minguez Espallargas; E. Coronado
Isoreticular two-dimensional magnetic coordination polymers prepared through pre-synthetic ligand functionalization
Nature Chemistry, 2018, 10, 1001-1007
1551909 CIFC10 H11.33 Cu O6.67P -3 m 118.5676; 18.5676; 6.8056
90; 90; 120		2031.9Lauren N. McHugh; Matthew J. McPherson; Laura J. McCormick; Samuel A. Morris; Paul S. Wheatley; Simon J. Teat; David McKay; Daniel M. Dawson; Charlotte E. F. Sansome; Sharon E. Ashbrook; Corinne A. Stone; Martin W. Smith; Russell E. Morris
Hydrolytic stability in hemilabile metal-organic frameworks
Nature Chemistry, 2018, 10, 1096-1102
1551910 CIFC10 H8 Cu O5P 3 1 m33.028; 33.028; 5.2047
90; 90; 120		4916.9Lauren N. McHugh; Matthew J. McPherson; Laura J. McCormick; Samuel A. Morris; Paul S. Wheatley; Simon J. Teat; David McKay; Daniel M. Dawson; Charlotte E. F. Sansome; Sharon E. Ashbrook; Corinne A. Stone; Martin W. Smith; Russell E. Morris
Hydrolytic stability in hemilabile metal-organic frameworks
Nature Chemistry, 2018, 10, 1096-1102
1551911 CIFC28 H33 F3 Ir N OP b c a15.215; 11.5219; 29.439
90; 90; 90		5160.8Kwangmin Shin; Yoonsu Park; Mu-Hyun Baik; Sukbok Chang
Iridium-catalysed arylation of C-H bonds enabled by oxidatively induced reductive elimination
Nature Chemistry, 2018, 10, 218-224
1551924 CIFC15 H10 F3 N O3 WP 1 21/c 120.0122; 9.8352; 7.4416
90; 90.639; 90		1464.59Tianfei Liu; Meiyuan Guo; Andreas Orthaber; Reiner Lomoth; Marcus Lundberg; Sascha Ott; Leif Hammarstrom
Accelerating proton-coupled electron transfer of metal hydrides in catalyst model reactions
Nature Chemistry, 2018, 10, 881-887
1551925 CIFC15 H13 N O3 WP 1 21/n 111.8215; 6.2202; 19.1297
90; 92.475; 90		1405.33Tianfei Liu; Meiyuan Guo; Andreas Orthaber; Reiner Lomoth; Marcus Lundberg; Sascha Ott; Leif Hammarstrom
Accelerating proton-coupled electron transfer of metal hydrides in catalyst model reactions
Nature Chemistry, 2018, 10, 881-887
1551926 CIFC15 H13 N O4 WP -18.2435; 8.3778; 11.8392
103.606; 98.72; 108.776		729.09Tianfei Liu; Meiyuan Guo; Andreas Orthaber; Reiner Lomoth; Marcus Lundberg; Sascha Ott; Leif Hammarstrom
Accelerating proton-coupled electron transfer of metal hydrides in catalyst model reactions
Nature Chemistry, 2018, 10, 881-887
1552025 CIFC86 H123 K N2 O10 UP 21 319.8738; 19.8738; 19.8738
90; 90; 90		7849.5Dominik P. Halter; Frank W. Heinemann; Laurent Maron; Karsten Meyer
The role of uranium-arene bonding in H2O reduction catalysis
Nature Chemistry, 2018, 10, 259-267
1552026 CIFC67 H86 N3 O3 UP 1 21/n 115.4665; 18.133; 19.847
90; 92.049; 90		5562.6Dominik P. Halter; Frank W. Heinemann; Laurent Maron; Karsten Meyer
The role of uranium-arene bonding in H2O reduction catalysis
Nature Chemistry, 2018, 10, 259-267
1552027 CIFC79 H107 O8 UC 1 2/c 141.761; 15.8422; 24.5005
90; 124.439; 90		13368.2Dominik P. Halter; Frank W. Heinemann; Laurent Maron; Karsten Meyer
The role of uranium-arene bonding in H2O reduction catalysis
Nature Chemistry, 2018, 10, 259-267
1552028 CIFC70 H105 N3 O7 Si UP 1 21/n 111.36; 25.522; 22.856
90; 97.314; 90		6573Dominik P. Halter; Frank W. Heinemann; Laurent Maron; Karsten Meyer
The role of uranium-arene bonding in H2O reduction catalysis
Nature Chemistry, 2018, 10, 259-267
1552781 CIFC40 H20 Co6 O16 P2P 1 21/c 110.0109; 20.861; 20.4255
90; 92.176; 90		4262.5Racioppi, S.; Della Pergola, R.; Colombo, V.; Sironi, A.; Macchi, P.
Electron Density Analysis of Metal Clusters with Semi-Interstitial Main Group Atoms. Chemical Bonding in [Co<sub>6</sub>X(CO)<sub>16</sub>]<sup>-</sup> Species.
The journal of physical chemistry. A, 2018, 122, 5004-5015
1552782 CIFC40 H20 Co6 O16 P2P 1 21/c 110.01803; 20.87369; 20.43821
90; 92.1609; 90		4270.86Racioppi, S.; Della Pergola, R.; Colombo, V.; Sironi, A.; Macchi, P.
Electron Density Analysis of Metal Clusters with Semi-Interstitial Main Group Atoms. Chemical Bonding in [Co<sub>6</sub>X(CO)<sub>16</sub>]<sup>-</sup> Species.
The journal of physical chemistry. A, 2018, 122, 5004-5015
1552783 CIFC54 H54 O6P 1 21 111.5859; 20.1144; 18.9328
90; 95.818; 90		4389.44Kosaka, Tomoyo; Iwai, Satono; Inoue, Yoshihisa; Moriuchi, Toshiyuki; Mori, Tadashi
Solvent and Temperature Effects on Dynamics and Chiroptical Properties of Propeller Chirality and Toroidal Interaction of Hexaarylbenzenes.
The journal of physical chemistry. A, 2018, 122, 7455-7463
1552784 CIFC18 H50 Cl12 Cu6 N6 OP 21 21 2113.3441; 14.6101; 20.1415
90; 90; 90		3926.8Latouche, Camille; Gautier, Romain; Génois, Romain; Massuyeau, Florian
Structural and Spectroscopic Investigations of Two [Cu<sub>4</sub>X<sub>6</sub>]<sup>2-</sup> (X = Cl<sup>-</sup>, Br<sup>-</sup>) Clusters: A Joint Theoretical and Experimental Work.
The journal of physical chemistry. A, 2018, 122, 4628-4634
1552785 CIFC4 H12 N10 O8P 1 21/n 16.7338; 6.9787; 13.2786
90; 94.6091; 90		621.99Tidey, Jeremiah P.; Zhurov, Vladimir V.; Gianopoulos, Christopher G.; Hermann, Tobias S.; Pinkerton, A. Alan
QTAIM Assessment of the Intra- and Intermolecular Bonding in a Bis(nitramido-oxadiazolate) Energetic Ionic Salt at 20 K.
The journal of physical chemistry. A, 2018, 122, 9676-9687
1552786 CIFC68 Cl16P -110.0815; 10.1807; 13.4349
70.5601; 68.6395; 79.8573		1208.6Chancellor, Christopher J.; Bowles, Faye L.; Franco, Jimmy U.; Pham, David M.; Rivera, Melissa; Sarina, Evan A.; Ghiassi, Kamran B.; Balch, Alan L.; Olmstead, Marilyn M.
Single-Crystal X-ray Diffraction Studies of Solvated Crystals of C<sub>60</sub> Reveal the Intermolecular Interactions between the Component Molecules.
The journal of physical chemistry. A, 2018, 122, 9626-9636
1552787 CIFC68 Cl16P -110.093; 10.189; 13.214
102.27; 111.08; 100.52		1187.9Chancellor, Christopher J.; Bowles, Faye L.; Franco, Jimmy U.; Pham, David M.; Rivera, Melissa; Sarina, Evan A.; Ghiassi, Kamran B.; Balch, Alan L.; Olmstead, Marilyn M.
Single-Crystal X-ray Diffraction Studies of Solvated Crystals of C<sub>60</sub> Reveal the Intermolecular Interactions between the Component Molecules.
The journal of physical chemistry. A, 2018, 122, 9626-9636
1552788 CIFC66 H5 ClP -110.1582; 19.167; 19.192
110.978; 102.503; 102.42		3226.1Chancellor, Christopher J.; Bowles, Faye L.; Franco, Jimmy U.; Pham, David M.; Rivera, Melissa; Sarina, Evan A.; Ghiassi, Kamran B.; Balch, Alan L.; Olmstead, Marilyn M.
Single-Crystal X-ray Diffraction Studies of Solvated Crystals of C<sub>60</sub> Reveal the Intermolecular Interactions between the Component Molecules.
The journal of physical chemistry. A, 2018, 122, 9626-9636
1552789 CIFC65 H12C 1 c 19.974; 31.629; 10.014
90; 90.149; 90		3159.1Chancellor, Christopher J.; Bowles, Faye L.; Franco, Jimmy U.; Pham, David M.; Rivera, Melissa; Sarina, Evan A.; Ghiassi, Kamran B.; Balch, Alan L.; Olmstead, Marilyn M.
Single-Crystal X-ray Diffraction Studies of Solvated Crystals of C<sub>60</sub> Reveal the Intermolecular Interactions between the Component Molecules.
The journal of physical chemistry. A, 2018, 122, 9626-9636
1552790 CIFC78 H18P 1 21/n 113.5271; 9.9838; 16.017
90; 109.108; 90		2043.9Chancellor, Christopher J.; Bowles, Faye L.; Franco, Jimmy U.; Pham, David M.; Rivera, Melissa; Sarina, Evan A.; Ghiassi, Kamran B.; Balch, Alan L.; Olmstead, Marilyn M.
Single-Crystal X-ray Diffraction Studies of Solvated Crystals of C<sub>60</sub> Reveal the Intermolecular Interactions between the Component Molecules.
The journal of physical chemistry. A, 2018, 122, 9626-9636
1552791 CIFC64 H10 OC 1 c 19.948; 31.536; 9.988
90; 90.035; 90		3133.4Chancellor, Christopher J.; Bowles, Faye L.; Franco, Jimmy U.; Pham, David M.; Rivera, Melissa; Sarina, Evan A.; Ghiassi, Kamran B.; Balch, Alan L.; Olmstead, Marilyn M.
Single-Crystal X-ray Diffraction Studies of Solvated Crystals of C<sub>60</sub> Reveal the Intermolecular Interactions between the Component Molecules.
The journal of physical chemistry. A, 2018, 122, 9626-9636
1552792 CIFC64 Cl8C 1 2/m 116.0981; 11.4891; 10.2043
90; 102.026; 90		1845.9Chancellor, Christopher J.; Bowles, Faye L.; Franco, Jimmy U.; Pham, David M.; Rivera, Melissa; Sarina, Evan A.; Ghiassi, Kamran B.; Balch, Alan L.; Olmstead, Marilyn M.
Single-Crystal X-ray Diffraction Studies of Solvated Crystals of C<sub>60</sub> Reveal the Intermolecular Interactions between the Component Molecules.
The journal of physical chemistry. A, 2018, 122, 9626-9636
1552793 CIFC67 H8 Cl2C 1 2/c 120.8431; 17.181; 9.9614
90; 107.503; 90		3402.1Chancellor, Christopher J.; Bowles, Faye L.; Franco, Jimmy U.; Pham, David M.; Rivera, Melissa; Sarina, Evan A.; Ghiassi, Kamran B.; Balch, Alan L.; Olmstead, Marilyn M.
Single-Crystal X-ray Diffraction Studies of Solvated Crystals of C<sub>60</sub> Reveal the Intermolecular Interactions between the Component Molecules.
The journal of physical chemistry. A, 2018, 122, 9626-9636
1552794 CIFC17 H32 N2 O5P 1 21 19.8681; 17.5; 12.2922
90; 102.706; 90		2070.8Pal, Rumpa; Reddy, M. B. Madhusudana; Dinesh, B.; Venkatesha, Manjunath A.; Grabowsky, Simon; Jelsch, Christian; Guru Row, Tayur N.
Syn vs Anti Carboxylic Acids in Hybrid Peptides: Experimental and Theoretical Charge Density and Chemical Bonding Analysis.
The journal of physical chemistry. A, 2018, 122, 3665-3679
1552795 CIFC32 H62 N4 O8P 1 21 110.3122; 10.9803; 16.8121
90; 106.622; 90		1824.1Pal, Rumpa; Reddy, M. B. Madhusudana; Dinesh, B.; Venkatesha, Manjunath A.; Grabowsky, Simon; Jelsch, Christian; Guru Row, Tayur N.
Syn vs Anti Carboxylic Acids in Hybrid Peptides: Experimental and Theoretical Charge Density and Chemical Bonding Analysis.
The journal of physical chemistry. A, 2018, 122, 3665-3679
1552796 CIFC19 H36 N2 O5P 21 21 215.2149; 15.0953; 27.017
90; 90; 90		2126.8Pal, Rumpa; Reddy, M. B. Madhusudana; Dinesh, B.; Venkatesha, Manjunath A.; Grabowsky, Simon; Jelsch, Christian; Guru Row, Tayur N.
Syn vs Anti Carboxylic Acids in Hybrid Peptides: Experimental and Theoretical Charge Density and Chemical Bonding Analysis.
The journal of physical chemistry. A, 2018, 122, 3665-3679
1552797 CIFC25 H47 N3 O6P 1 21 110.2236; 12.3246; 12.3403
90; 109.388; 90		1466.7Pal, Rumpa; Reddy, M. B. Madhusudana; Dinesh, B.; Venkatesha, Manjunath A.; Grabowsky, Simon; Jelsch, Christian; Guru Row, Tayur N.
Syn vs Anti Carboxylic Acids in Hybrid Peptides: Experimental and Theoretical Charge Density and Chemical Bonding Analysis.
The journal of physical chemistry. A, 2018, 122, 3665-3679
1552798 CIFC23 H43 N3 O6P 21 21 219.4237; 15.9868; 17.3878
90; 90; 90		2619.56Pal, Rumpa; Reddy, M. B. Madhusudana; Dinesh, B.; Venkatesha, Manjunath A.; Grabowsky, Simon; Jelsch, Christian; Guru Row, Tayur N.
Syn vs Anti Carboxylic Acids in Hybrid Peptides: Experimental and Theoretical Charge Density and Chemical Bonding Analysis.
The journal of physical chemistry. A, 2018, 122, 3665-3679
1552799 CIFC8 H5 N3P -13.8354; 9.2168; 9.8872
104.868; 96.052; 96.718		332.14Tu, Ting-Husn; Chen, Yi-Ting; Shen, Jiun-Yi; Lin, Ta-Chun; Chou, Pi-Tai
Excited-State Proton Transfer in 3-Cyano-7-azaindole: From Aqueous Solution to Ice.
The journal of physical chemistry. A, 2018, 122, 2479-2484
1552800 CIFC17 H15 B2 N O4P 1 21/c 112.6209; 10.7943; 12.6367
90; 113.005; 90		1584.63Jarzembska, Katarzyna N.; Kamiński, Radosław; Durka, Krzysztof; Woźniak, Krzysztof
Ground-State Charge-Density Distribution in a Crystal of the Luminescent ortho-Phenylenediboronic Acid Complex with 8-Hydroxyquinoline.
The journal of physical chemistry. A, 2018, 122, 4508-4520
1552801 CIFC16 H16 N4 OP 1 21/c 112.8697; 9.3437; 12.2616
90; 112.405; 90		1363.16Meisner, Quinton J.; Accardo, Joseph V.; Hu, Guoxiang; Clark, Ronald J.; Jiang, De-En; Zhu, Lei
Fluorescence of Hydroxyphenyl-Substituted "Click" Triazoles.
The journal of physical chemistry. A, 2018, 122, 2956-2973
1552802 CIFC14 H11 N3 O2P 1 21/c 111.6708; 11.9674; 8.2434
90; 90.678; 90		1151.27Meisner, Quinton J.; Accardo, Joseph V.; Hu, Guoxiang; Clark, Ronald J.; Jiang, De-En; Zhu, Lei
Fluorescence of Hydroxyphenyl-Substituted "Click" Triazoles.
The journal of physical chemistry. A, 2018, 122, 2956-2973
1552803 CIFC16 H16 N4 OP -113.2955; 13.5219; 16.0082
88.6723; 77.3876; 86.5291		2803.2Meisner, Quinton J.; Accardo, Joseph V.; Hu, Guoxiang; Clark, Ronald J.; Jiang, De-En; Zhu, Lei
Fluorescence of Hydroxyphenyl-Substituted "Click" Triazoles.
The journal of physical chemistry. A, 2018, 122, 2956-2973
1552814 CIFC31 H50 Br2 O S2P -15.5012; 7.6825; 38.85
88.875; 89.662; 72.188		1562.91Chen, Jianhua; Liao, Qiaogan; Wang, Gang; Yan, Zhenglong; Wang, Hang; Wang, Yulun; Zhang, Xianhe; Tang, Yumin; Facchetti, Antonio; Marks, Tobin J.; Guo, Xugang
Enhancing Polymer Photovoltaic Performance via Optimized Intramolecular Ester-Based Noncovalent Sulfur···Oxygen Interactions
Macromolecules, 2018, 51, 3874
1552815 CIFC19 H24 Br2 O3 S2P -18.322; 9.7826; 14.7863
92.707; 102.005; 114.698		1057.47Chen, Jianhua; Liao, Qiaogan; Wang, Gang; Yan, Zhenglong; Wang, Hang; Wang, Yulun; Zhang, Xianhe; Tang, Yumin; Facchetti, Antonio; Marks, Tobin J.; Guo, Xugang
Enhancing Polymer Photovoltaic Performance via Optimized Intramolecular Ester-Based Noncovalent Sulfur···Oxygen Interactions
Macromolecules, 2018, 51, 3874
1552816 CIFC72 H76 F12 N4 O4 S6 Zn2P 1 21/n 114.1209; 17.852; 15.2027
90; 107.823; 90		3648.5Zhang, Yao-Yao; Yang, Guan-Wen; Wu, Guang-Peng
A Bifunctional β-Diiminate Zinc Catalyst with CO2/Epoxides Copolymerization and RAFT Polymerization Capacities for Versatile Block Copolymers Construction
Macromolecules, 2018, 51, 3640
1552817 CIFC32 H33 Cl3 N2 O6 PdP -112.1018; 12.1188; 12.3413
79.358; 68.593; 84.171		1654.96Xiao, Zefan; Zheng, Handou; Du, Cheng; Zhong, Liu; Liao, Heng; Gao, Jie; Gao, Haiyang; Wu, Qing
Enhancement on Alternating Copolymerization of Carbon Monoxide and Styrene by Dibenzobarrelene-Based α-Diimine Palladium Catalysts
Macromolecules, 2018, 51, 9110
1552818 CIFC36 H37 Cl3 N2 O6 PdP 1 21/n 112.3985; 20.1081; 13.8378
90; 92.7312; 90		3445.99Xiao, Zefan; Zheng, Handou; Du, Cheng; Zhong, Liu; Liao, Heng; Gao, Jie; Gao, Haiyang; Wu, Qing
Enhancement on Alternating Copolymerization of Carbon Monoxide and Styrene by Dibenzobarrelene-Based α-Diimine Palladium Catalysts
Macromolecules, 2018, 51, 9110
1552819 CIFC33 H31 Cl N2 O4 PdP 1 21/c 111.3673; 12.5081; 20.9652
90; 103.048; 90		2903.94Xiao, Zefan; Zheng, Handou; Du, Cheng; Zhong, Liu; Liao, Heng; Gao, Jie; Gao, Haiyang; Wu, Qing
Enhancement on Alternating Copolymerization of Carbon Monoxide and Styrene by Dibenzobarrelene-Based α-Diimine Palladium Catalysts
Macromolecules, 2018, 51, 9110
1552820 CIFC33 H31 Cl5 N2 O2 PdP 1 21/c 19.908; 22.0742; 15.5558
90; 99.976; 90		3350.8Xiao, Zefan; Zheng, Handou; Du, Cheng; Zhong, Liu; Liao, Heng; Gao, Jie; Gao, Haiyang; Wu, Qing
Enhancement on Alternating Copolymerization of Carbon Monoxide and Styrene by Dibenzobarrelene-Based α-Diimine Palladium Catalysts
Macromolecules, 2018, 51, 9110
1552821 CIFC76.5 H87 Cl3 N8P 1 21/c 112.787; 23.4658; 23.0659
90; 96.736; 90		6873.3Gallagher, Nolan M.; Zhukhovitskiy, Aleksandr V.; Nguyen, Hung V.-T.; Johnson, Jeremiah A.
Main-Chain Zwitterionic Supramolecular Polymers Derived fromN-Heterocyclic Carbene‒Carbodiimide (NHC‒CDI) Adducts
Macromolecules, 2018, 51, 3006
1552822 CIFC178 H264 Cl8 O26 Y4I -4 c 225.8909; 25.8909; 59.13
90; 90; 90		39637Chen, Changjuan; Bai, Zhiyong; Cui, Yaqin; Cong, Yong; Pan, Xiaobo; Wu, Jincai
ppm-Level Thermally Switchable Yttrium Phenoxide Catalysts for Moisture-Insensitive and Controllably Immortal Polymerization of rac-Lactide
Macromolecules, 2018, 51, 6800
1552823 CIFC93 H126 O9 Y2R -3 c :H23.2; 23.2; 36.173
90; 90; 120		16861Chen, Changjuan; Bai, Zhiyong; Cui, Yaqin; Cong, Yong; Pan, Xiaobo; Wu, Jincai
ppm-Level Thermally Switchable Yttrium Phenoxide Catalysts for Moisture-Insensitive and Controllably Immortal Polymerization of rac-Lactide
Macromolecules, 2018, 51, 6800
1552824 CIFC22 H43 Lu N2 Si3P -110.4643; 11.3341; 12.5841
86.455; 89.203; 89.375		1489.44Yan, Chao; Xu, Tie-Qi; Lu, Xiao-Bing
From Stereochemically Tunable Homopolymers to Stereomultiblock Copolymers: Lewis Base Regulates Stereochemistry in the Coordination Polymerization of 2-Vinylpyridine
Macromolecules, 2018, 51, 2240
1552825 CIFC62 H38 Cl4 N2 O4C 1 2 135.279; 12.2498; 12.5944
90; 94.96; 90		5422.4Wang, Zhen; Yan, Sen; Cui, Huang-Chen; Cheng, Guang; Ma, Hui; Zhang, Qing-Mei; Zhang, Qing-Pu; Liu, Jun-Min; Tan, Bien; Zhang, Chun
Porous Organic Polymer from Aggregation-Induced Emission Macrocycle for White-Light Emission
Macromolecules, 2018, 51, 7863
1552826 CIFC15 H18 I N3 O2P 1 21/n 17.084; 12.892; 18.3
90; 96.39; 90		1661Kim, Kyung-su; Cho, Hye Jin; Lee, Jookyeong; Ha, Seonggyun; Song, Sun Gu; Kim, Seunghun; Yun, Wan Soo; Kim, Seong Kyu; Huh, Joonsuk; Song, Changsik
Dynamic Covalent Hydrazone Supramolecular Polymers toward Multiresponsive Self-Assembled Nanowire System
Macromolecules, 2018, 51, 8278
1552827 CIFC47 H57 Mg N3 O2 Si2P 1 21/c 115.801; 13.9759; 19.829
90; 97.419; 90		4342.2Hu, Jianwen; Kan, Chao; Wang, Haobing; Ma, Haiyan
Highly Active Chiral Oxazolinyl Aminophenolate Magnesium Initiators for Isoselective Ring-Opening Polymerization of rac-Lactide: Dinuclearity Induced Enantiomorphic Site Control
Macromolecules, 2018, 51, 5304
1552828 CIFC51 H57 Mg N3 O2 Si2P 21 21 2111.371; 19.871; 20.675
90; 90; 90		4672Hu, Jianwen; Kan, Chao; Wang, Haobing; Ma, Haiyan
Highly Active Chiral Oxazolinyl Aminophenolate Magnesium Initiators for Isoselective Ring-Opening Polymerization of rac-Lactide: Dinuclearity Induced Enantiomorphic Site Control
Macromolecules, 2018, 51, 5304
1552829 CIFC53.5 H61 Mg N3 O2 Si2C 1 2 122.132; 11.214; 19.876
90; 98.636; 90		4877Hu, Jianwen; Kan, Chao; Wang, Haobing; Ma, Haiyan
Highly Active Chiral Oxazolinyl Aminophenolate Magnesium Initiators for Isoselective Ring-Opening Polymerization of rac-Lactide: Dinuclearity Induced Enantiomorphic Site Control
Macromolecules, 2018, 51, 5304
1552830 CIFC53.5 H61 Mg N3 O2 Si2C 1 2 122.162; 11.233; 19.873
90; 98.551; 90		4892.3Hu, Jianwen; Kan, Chao; Wang, Haobing; Ma, Haiyan
Highly Active Chiral Oxazolinyl Aminophenolate Magnesium Initiators for Isoselective Ring-Opening Polymerization of rac-Lactide: Dinuclearity Induced Enantiomorphic Site Control
Macromolecules, 2018, 51, 5304
1552831 CIFC97 H140.42 N11 O20P -114.961; 16.55; 21.063
101.77; 92.13; 103.45		4946Xia, Danyu; Wang, Liyun; Lv, Xiaoqing; Chao, Jianbin; Wei, Xuehong; Wang, Pi
Dual-Responsive [2]Pseudorotaxane On the basis of a pH-Sensitive Pillar[5]arene and Its Application in the Fabrication of Metallosupramolecular Polypseudorotaxane
Macromolecules, 2018, 51, 2716
1552832 CIFC40 H52 O2 S4P 1 21/n 114.877; 12.227; 21.508
90; 105.131; 90		3777McDearmon, Brenden; Lim, Eunhee; Lee, In-Hwan; Kozycz, Lisa M.; O’Hara, Kathryn; Robledo, P. Isaac; Venkatesan, Naveen R.; Chabinyc, Michael L.; Hawker, Craig J.
Effects of Side-Chain Topology on Aggregation of Conjugated Polymers
Macromolecules, 2018, 51, 2580
1552833 CIFC20 H26 O2 S2P 1 21/c 17.5527; 9.651; 13.308
90; 101.931; 90		949.1McDearmon, Brenden; Lim, Eunhee; Lee, In-Hwan; Kozycz, Lisa M.; O’Hara, Kathryn; Robledo, P. Isaac; Venkatesan, Naveen R.; Chabinyc, Michael L.; Hawker, Craig J.
Effects of Side-Chain Topology on Aggregation of Conjugated Polymers
Macromolecules, 2018, 51, 2580
1552834 CIFC42 H39 PP -19.879; 12.3423; 15.4553
104.703; 101.12; 112.177		1597.8Rawe, Benjamin W.; Priegert, Andrew M.; Wang, Shuai; Schiller, Carl; Gerke, Sonja; Gates, Derek P.
An Addition‒Isomerization Mechanism for the Anionic Polymerization of MesP═CPh2 and m-XylP═CPh2
Macromolecules, 2018, 51, 2621
1552835 CIFC41 H37 PP 1 21/n 112.623; 15.369; 16.556
90; 102.684; 90		3134Rawe, Benjamin W.; Priegert, Andrew M.; Wang, Shuai; Schiller, Carl; Gerke, Sonja; Gates, Derek P.
An Addition‒Isomerization Mechanism for the Anionic Polymerization of MesP═CPh2 and m-XylP═CPh2
Macromolecules, 2018, 51, 2621
1552836 CIFC16 H12 Br2P -18.3044; 9.337; 9.3521
73.731; 85.809; 80.334		686Gao, Qingqing; Qiu, Zijie; Elsegood, Mark R. J.; Chen, Ming; Wang, Jianguo; Kwok, Ryan T. K.; Lam, Jacky W. Y.; Tang, Ben Zhong
Regio- and Stereoselective Polymerization of Diynes with Inorganic Comonomer: A Facile Strategy to Conjugated Poly(p-arylene dihalodiene)s with Processability and Postfunctionalizability
Macromolecules, 2018, 51, 3497
1552837 CIFC26 H17 NP 1 21/n 110.3766; 19.563; 8.672
90; 89.869; 90		1760.4Al Mousawi, Assi; Schmitt, Michael; Dumur, Frederic; Ouyang, Jiangkun; Favereau, Ludovic; Dorcet, Vincent; Vanthuyne, Nicolas; Garra, Patxi; Toufaily, Joumana; Hamieh, Tayssir; Graff, Bernadette; Fouassier, Jean Pierre; Gigmes, Didier; Crassous, Jeanne; Lalevée, Jacques
Visible Light Chiral Photoinitiator for Radical Polymerization and Synthesis of Polymeric Films with Strong Chiroptical Activity
Macromolecules, 2018, 51, 5628
1552838 CIFC63 H55 Cl N2 Pd S4P c a 2124.121; 9.6946; 25.198
90; 90; 90		5892.4Na, Yinna; Dai, Shengyu; Chen, Changle
Direct Synthesis of Polar-Functionalized Linear Low-Density Polyethylene (LLDPE) and Low-Density Polyethylene (LDPE)
Macromolecules, 2018, 51, 4040
1552839 CIFC30 H33 Cl2 O6 P Pd S2P 1 21/c 115.7379; 13.937; 14.7041
90; 91.146; 90		3224.5Na, Yinna; Dai, Shengyu; Chen, Changle
Direct Synthesis of Polar-Functionalized Linear Low-Density Polyethylene (LLDPE) and Low-Density Polyethylene (LDPE)
Macromolecules, 2018, 51, 4040
1552840 CIFC9 H6 O2 S2P b c a9.738; 7.241; 24.578
90; 90; 90		1733.1Chen, Jianhua; Wang, Lei; Yang, Jie; Yang, Kun; Uddin, Mohammad Afsar; Tang, Yumin; Zhou, Xin; Liao, Qiaogan; Yu, Jianwei; Liu, Bin; Woo, Han Young; Guo, Xugang
Backbone Conformation Tuning of Carboxylate-Functionalized Wide Band Gap Polymers for Efficient Non-Fullerene Organic Solar Cells
Macromolecules, 2018, 52, 341
1552841 CIFC16 H12 O4 S3C 1 2 114.089; 6.7932; 10.3076
90; 124.152; 90		816.4Chen, Jianhua; Wang, Lei; Yang, Jie; Yang, Kun; Uddin, Mohammad Afsar; Tang, Yumin; Zhou, Xin; Liao, Qiaogan; Yu, Jianwei; Liu, Bin; Woo, Han Young; Guo, Xugang
Backbone Conformation Tuning of Carboxylate-Functionalized Wide Band Gap Polymers for Efficient Non-Fullerene Organic Solar Cells
Macromolecules, 2018, 52, 341
1552842 CIFC9 H6 O2 S2P -16.052; 7.23; 10.735
72.62; 86.1; 69.463		419.4Chen, Jianhua; Wang, Lei; Yang, Jie; Yang, Kun; Uddin, Mohammad Afsar; Tang, Yumin; Zhou, Xin; Liao, Qiaogan; Yu, Jianwei; Liu, Bin; Woo, Han Young; Guo, Xugang
Backbone Conformation Tuning of Carboxylate-Functionalized Wide Band Gap Polymers for Efficient Non-Fullerene Organic Solar Cells
Macromolecules, 2018, 52, 341
1552843 CIFC25 H38 O5P 1 21 15.9874; 16.1056; 23.4443
90; 90.04; 90		2260.7Simões, Ricardo G; Bernardes, Carlos E. S.; Joseph, Abhinav; M Piedade, M Fátima; Kraus, Werner; Emmerling, Franziska; Diogo, Hermíno P; Minas da Piedade, Manuel E.
Polymorphism in Simvastatin: Twinning, Disorder, and Enantiotropic Phase Transitions.
Molecular pharmaceutics, 2018, 15, 5349-5360
1552844 CIFC25 H38 O5P 1 21 16.0018; 16.139; 23.448
90; 90.032; 90		2271.2Simões, Ricardo G; Bernardes, Carlos E. S.; Joseph, Abhinav; M Piedade, M Fátima; Kraus, Werner; Emmerling, Franziska; Diogo, Hermíno P; Minas da Piedade, Manuel E.
Polymorphism in Simvastatin: Twinning, Disorder, and Enantiotropic Phase Transitions.
Molecular pharmaceutics, 2018, 15, 5349-5360
1552845 CIFC25 H38 O5P 21 21 216.0524; 16.3826; 23.4238
90; 90; 90		2322.56Simões, Ricardo G; Bernardes, Carlos E. S.; Joseph, Abhinav; M Piedade, M Fátima; Kraus, Werner; Emmerling, Franziska; Diogo, Hermíno P; Minas da Piedade, Manuel E.
Polymorphism in Simvastatin: Twinning, Disorder, and Enantiotropic Phase Transitions.
Molecular pharmaceutics, 2018, 15, 5349-5360
1552846 CIFC25 H38 O5P 21 21 216.0587; 16.4386; 23.3475
90; 90; 90		2325.3Simões, Ricardo G; Bernardes, Carlos E. S.; Joseph, Abhinav; M Piedade, M Fátima; Kraus, Werner; Emmerling, Franziska; Diogo, Hermíno P; Minas da Piedade, Manuel E.
Polymorphism in Simvastatin: Twinning, Disorder, and Enantiotropic Phase Transitions.
Molecular pharmaceutics, 2018, 15, 5349-5360
1552847 CIFC25 H38 O5P 21 21 216.1145; 17.2901; 22.4334
90; 90; 90		2371.67Simões, Ricardo G; Bernardes, Carlos E. S.; Joseph, Abhinav; M Piedade, M Fátima; Kraus, Werner; Emmerling, Franziska; Diogo, Hermíno P; Minas da Piedade, Manuel E.
Polymorphism in Simvastatin: Twinning, Disorder, and Enantiotropic Phase Transitions.
Molecular pharmaceutics, 2018, 15, 5349-5360
1552848 CIFC26 H25 Cl N2 O3P 1 21/n 17.52; 38.53; 8.44
90; 107.82; 90		2328.13Das, Partha P.; Mugnaioli, Enrico; Nicolopoulos, Stavros; Tossi, Camilla; Gemmi, Mauro; Galanis, Athanasios; Borodi, Gheorghe; Pop, Mihaela M.
Crystal Structures of Two Important Pharmaceuticals Solved by 3D Precession Electron Diffraction Tomography
Organic Process Research & Development, 2018, 22, 1365
1552849 CIFC16 H21 N O2P 21 21 214.99; 11.92; 22.95
90; 90; 90		1365.08Das, Partha P.; Mugnaioli, Enrico; Nicolopoulos, Stavros; Tossi, Camilla; Gemmi, Mauro; Galanis, Athanasios; Borodi, Gheorghe; Pop, Mihaela M.
Crystal Structures of Two Important Pharmaceuticals Solved by 3D Precession Electron Diffraction Tomography
Organic Process Research & Development, 2018, 22, 1365
1552850 CIFC16 H21 N O2P 21 21 215.045; 12.4178; 23.187
90; 90; 90		1452.6Das, Partha P.; Mugnaioli, Enrico; Nicolopoulos, Stavros; Tossi, Camilla; Gemmi, Mauro; Galanis, Athanasios; Borodi, Gheorghe; Pop, Mihaela M.
Crystal Structures of Two Important Pharmaceuticals Solved by 3D Precession Electron Diffraction Tomography
Organic Process Research & Development, 2018, 22, 1365
1552851 CIFC26 H25 Cl N2 O3P 1 21/n 17.627; 38.007; 8.5629
90; 108.118; 90		2359.1Das, Partha P.; Mugnaioli, Enrico; Nicolopoulos, Stavros; Tossi, Camilla; Gemmi, Mauro; Galanis, Athanasios; Borodi, Gheorghe; Pop, Mihaela M.
Crystal Structures of Two Important Pharmaceuticals Solved by 3D Precession Electron Diffraction Tomography
Organic Process Research & Development, 2018, 22, 1365
1552852 CIFC20 H17 F2 N O3P 1 21 110.0671; 10.4134; 16.284
90; 97.398; 90		1692.89Smith, Aaron C.; Kung, Daniel W.; Shavnya, Andre; Brandt, Thomas A.; Dent, Philip D.; Genung, Nathan E.; Cabral, Shawn; Panteleev, Jane; Herr, Michael; Yip, Ka Ning; Aspnes, Gary E.; Conn, Edward L.; Dowling, Matthew S.; Edmonds, David J.; Edmonds, Ian D.; Fernando, Dilinie P.; Herrinton, Paul M.; Keene, Nandell F.; Lavergne, Sophie Y.; Li, Qifang; Polivkova, Jana; Rose, Colin R.; Thuma, Benjamin A.; Vetelino, Michael G.; Wang, Guoqiang; Weaver, John D.; Widlicka, Daniel W.; Price Wiglesworth, Kristin E.; Xiao, Jun; Zahn, Todd; Zhang, Yingxin
Evolution of the Synthesis of AMPK Activators for the Treatment of Diabetic Nephropathy: From Three Preclinical Candidates to the Investigational New Drug PF-06409577
Organic Process Research & Development, 2018, 22, 681
1552853 CIFC10 H10 N2 O3 SP -15.9578; 9.7092; 10.302
106.092; 104.979; 94.998		544.97Luo, Zhongfeng; Liu, Tingting; Guo, Weijie; Wang, Zijia; Huang, Jingjun; Zhu, Yulin; Zeng, Zhuo
N-Acyl-5,5-dimethylhydantoin, a New Mild Acyl-Transfer Reagent in Pd Catalysis: Highly Efficient Synthesis of Functionalized Ketones
Organic Process Research & Development, 2018, 22, 1188
1552859 CIF
HKL
Paper		C36 H38 Cl4 Cu2 N6 O2P 1 21/n 112.004; 9.7942; 17.4116
90; 107.633; 90		1950.9Naugle, Mercedes S.; Keller, Brittany T.; Zeller, Matthias; Zaleski, Curtis M.
Di-μ-chlorido-bis[chlorido(dimethylformamide-κ<i>N</i>)(3,5-diphenyl-1<i>H</i>-pyrazole-κ<i>N</i>^2^)copper(II)]
IUCrData, 2018, 3, x181186
1552860 CIF
HKL
Paper		C34 H45 Li Mo N4 O4 P2P -111.7633; 12.5731; 13.7249
87.283; 75.537; 67.45		1812.66Höhne, Martha; Spannenberg, Anke; Müller, Bernd H.; Peulecke, Normen; Rosenthal, Uwe
Tetracarbonyl-2κ^4^<i>C</i>-[μ-5-methyl-1,1,3-triphenyl-2-(propan-2-yl)-2,4-diaza-1,3-diphosphahexan-4-ido-1κ<i>N</i>^4^:2κ<i>P</i>^1^,<i>P</i>^3^](<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethane-1,2-diamine-1κ^2^<i>N</i>,<i>N</i>')lithiummolybdenum
IUCrData, 2018, 3, x181149
1552893 CIFC56 H32 N6P -19; 19.58; 23.93
77.99; 83.67; 89.86		4098.6Le Vaillant, Franck; Garreau, Marion; Nicolai, Stefano; Gryn'ova, Ganna; Corminboeuf, Clemence; Waser, Jerome
Fine-tuned organic photoredox catalysts for fragmentation-alkynylation cascades of cyclic oxime ethers.
Chemical science, 2018, 9, 5883-5889
1552894 CIFC24 H8 Cl Cr4 N32 O0.94P m -3 m18.6689; 18.6689; 18.6689
90; 90; 90		6506.63Asgari, Mehrdad; Jawahery, Sudi; Bloch, Eric D.; Hudson, Matthew R.; Flacau, Roxana; Vlaisavljevich, Bess; Long, Jeffrey R.; Brown, Craig M.; Queen, Wendy L.
An experimental and computational study of CO<sub>2</sub> adsorption in the sodalite-type M-BTT (M = Cr, Mn, Fe, Cu) metal-organic frameworks featuring open metal sites.
Chemical science, 2018, 9, 4579-4588
1552895 CIFC24 H8 Cl1.77 Cu5.54 N32 O0.7P m -3 m18.51977; 18.51977; 18.51977
90; 90; 90		6351.95Asgari, Mehrdad; Jawahery, Sudi; Bloch, Eric D.; Hudson, Matthew R.; Flacau, Roxana; Vlaisavljevich, Bess; Long, Jeffrey R.; Brown, Craig M.; Queen, Wendy L.
An experimental and computational study of CO<sub>2</sub> adsorption in the sodalite-type M-BTT (M = Cr, Mn, Fe, Cu) metal-organic frameworks featuring open metal sites.
Chemical science, 2018, 9, 4579-4588
1552896 CIFC26.22 H8 Cl Cr4 N32 O5.38P m -3 m18.6867; 18.6867; 18.6867
90; 90; 90		6525.26Asgari, Mehrdad; Jawahery, Sudi; Bloch, Eric D.; Hudson, Matthew R.; Flacau, Roxana; Vlaisavljevich, Bess; Long, Jeffrey R.; Brown, Craig M.; Queen, Wendy L.
An experimental and computational study of CO<sub>2</sub> adsorption in the sodalite-type M-BTT (M = Cr, Mn, Fe, Cu) metal-organic frameworks featuring open metal sites.
Chemical science, 2018, 9, 4579-4588
1552897 CIFC29.23 H15.77 Cl Fe4.36 N32 O7.88P m -3 m18.90048; 18.90048; 18.90048
90; 90; 90		6751.78Asgari, Mehrdad; Jawahery, Sudi; Bloch, Eric D.; Hudson, Matthew R.; Flacau, Roxana; Vlaisavljevich, Bess; Long, Jeffrey R.; Brown, Craig M.; Queen, Wendy L.
An experimental and computational study of CO<sub>2</sub> adsorption in the sodalite-type M-BTT (M = Cr, Mn, Fe, Cu) metal-organic frameworks featuring open metal sites.
Chemical science, 2018, 9, 4579-4588
1552898 CIFC26.59 H15.77 Cl Fe4.36 N32 O2.59P m -3 m18.8957; 18.8957; 18.8957
90; 90; 90		6746.66Asgari, Mehrdad; Jawahery, Sudi; Bloch, Eric D.; Hudson, Matthew R.; Flacau, Roxana; Vlaisavljevich, Bess; Long, Jeffrey R.; Brown, Craig M.; Queen, Wendy L.
An experimental and computational study of CO<sub>2</sub> adsorption in the sodalite-type M-BTT (M = Cr, Mn, Fe, Cu) metal-organic frameworks featuring open metal sites.
Chemical science, 2018, 9, 4579-4588
1552899 CIFC28.51 Cl Fe5.24 N32 O4.74P m -3 m18.80041; 18.80041; 18.80041
90; 90; 90		6645.11Asgari, Mehrdad; Jawahery, Sudi; Bloch, Eric D.; Hudson, Matthew R.; Flacau, Roxana; Vlaisavljevich, Bess; Long, Jeffrey R.; Brown, Craig M.; Queen, Wendy L.
An experimental and computational study of CO<sub>2</sub> adsorption in the sodalite-type M-BTT (M = Cr, Mn, Fe, Cu) metal-organic frameworks featuring open metal sites.
Chemical science, 2018, 9, 4579-4588
1552900 CIFC26.13 H8 Cl1.77 Cu5.54 N32 O4.96P m -3 m18.52951; 18.52951; 18.52951
90; 90; 90		6361.97Asgari, Mehrdad; Jawahery, Sudi; Bloch, Eric D.; Hudson, Matthew R.; Flacau, Roxana; Vlaisavljevich, Bess; Long, Jeffrey R.; Brown, Craig M.; Queen, Wendy L.
An experimental and computational study of CO<sub>2</sub> adsorption in the sodalite-type M-BTT (M = Cr, Mn, Fe, Cu) metal-organic frameworks featuring open metal sites.
Chemical science, 2018, 9, 4579-4588
1552901 CIFC33.47 H15.77 Cl Fe4.36 N32 O16.34P m -3 m18.8952; 18.8952; 18.8952
90; 90; 90		6746.13Asgari, Mehrdad; Jawahery, Sudi; Bloch, Eric D.; Hudson, Matthew R.; Flacau, Roxana; Vlaisavljevich, Bess; Long, Jeffrey R.; Brown, Craig M.; Queen, Wendy L.
An experimental and computational study of CO<sub>2</sub> adsorption in the sodalite-type M-BTT (M = Cr, Mn, Fe, Cu) metal-organic frameworks featuring open metal sites.
Chemical science, 2018, 9, 4579-4588
1552902 CIFC30.7 H8 Cl1.77 Cu5.54 N32 O14.09P m -3 m18.5323; 18.5323; 18.5323
90; 90; 90		6364.85Asgari, Mehrdad; Jawahery, Sudi; Bloch, Eric D.; Hudson, Matthew R.; Flacau, Roxana; Vlaisavljevich, Bess; Long, Jeffrey R.; Brown, Craig M.; Queen, Wendy L.
An experimental and computational study of CO<sub>2</sub> adsorption in the sodalite-type M-BTT (M = Cr, Mn, Fe, Cu) metal-organic frameworks featuring open metal sites.
Chemical science, 2018, 9, 4579-4588
1552903 CIFC25.75 H8 Cl Cr4 N32 O4.45P m -3 m18.7761; 18.7761; 18.7761
90; 90; 90		6619.4Asgari, Mehrdad; Jawahery, Sudi; Bloch, Eric D.; Hudson, Matthew R.; Flacau, Roxana; Vlaisavljevich, Bess; Long, Jeffrey R.; Brown, Craig M.; Queen, Wendy L.
An experimental and computational study of CO<sub>2</sub> adsorption in the sodalite-type M-BTT (M = Cr, Mn, Fe, Cu) metal-organic frameworks featuring open metal sites.
Chemical science, 2018, 9, 4579-4588
1552904 CIFC31.66 H8 Cl Cr4 N32 O16.26P m -3 m18.68163; 18.68163; 18.68163
90; 90; 90		6519.95Asgari, Mehrdad; Jawahery, Sudi; Bloch, Eric D.; Hudson, Matthew R.; Flacau, Roxana; Vlaisavljevich, Bess; Long, Jeffrey R.; Brown, Craig M.; Queen, Wendy L.
An experimental and computational study of CO<sub>2</sub> adsorption in the sodalite-type M-BTT (M = Cr, Mn, Fe, Cu) metal-organic frameworks featuring open metal sites.
Chemical science, 2018, 9, 4579-4588
1552905 CIFC54 H85 K N2 Ni O7 SP -112.5636; 13.3254; 17.435
83.702; 82.251; 72.027		2743.9Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W.
Synthesis and reactivity of a nickel(ii) thioperoxide complex: demonstration of sulfide-mediated N<sub>2</sub>O reduction.
Chemical science, 2018, 9, 6580-6588
1552906 CIFC61 H93 K N2 Ni O6 S2P -112.8138; 13.34; 20.566
80.905; 87.457; 62.801		3085.9Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W.
Synthesis and reactivity of a nickel(ii) thioperoxide complex: demonstration of sulfide-mediated N<sub>2</sub>O reduction.
Chemical science, 2018, 9, 6580-6588
1552907 CIFC60 H89 K N2 Ni O8P 1 21/c 120.875; 11.044; 26.136
90; 101.289; 90		5909Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W.
Synthesis and reactivity of a nickel(ii) thioperoxide complex: demonstration of sulfide-mediated N<sub>2</sub>O reduction.
Chemical science, 2018, 9, 6580-6588
1552908 CIFC101 H166 K2 N4 Ni2 O18P 1 21/n 124.849; 17.4488; 27.016
90; 115.268; 90		10593Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W.
Synthesis and reactivity of a nickel(ii) thioperoxide complex: demonstration of sulfide-mediated N<sub>2</sub>O reduction.
Chemical science, 2018, 9, 6580-6588
1552909 CIFC59 H105 K N2 Ni O8 S2C 1 2/c 138.446; 18.5998; 18.9696
90; 112.48; 90		12534Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W.
Synthesis and reactivity of a nickel(ii) thioperoxide complex: demonstration of sulfide-mediated N<sub>2</sub>O reduction.
Chemical science, 2018, 9, 6580-6588
1552910 CIFC117 H178 K2 N4 Ni2 O16 S2P 1 21/n 112.5942; 20.265; 22.942
90; 92.03; 90		5851.6Hartmann, Nathaniel J.; Wu, Guang; Hayton, Trevor W.
Synthesis and reactivity of a nickel(ii) thioperoxide complex: demonstration of sulfide-mediated N<sub>2</sub>O reduction.
Chemical science, 2018, 9, 6580-6588
1552911 CIFC17 H10 F3 N O3 SP 21 21 215.66599; 8.61364; 31.0135
90; 90; 90		1513.61Greenhalgh, Mark D.; Qu, Shen; Slawin, Alexandra M. Z.; Smith, Andrew D.
Multiple roles of aryloxide leaving groups in enantioselective annulations employing α,β-unsaturated acyl ammonium catalysis.
Chemical science, 2018, 9, 4909-4918
1552912 CIFC64 H70 B F20 YC 1 2/c 127.336; 11.5772; 19.4333
90; 106.049; 90		5910.4Randall McClain, K.; Gould, Colin A.; Chakarawet, Khetpakorn; Teat, Simon J.; Groshens, Thomas J.; Long, Jeffrey R.; Harvey, Benjamin G.
High-temperature magnetic blocking and magneto-structural correlations in a series of dysprosium(iii) metallocenium single-molecule magnets.
Chemical science, 2018, 9, 8492-8503
1552913 CIFC62 H66 B F20 YP 1 21/n 115.0163; 23.1163; 16.7813
90; 90.902; 90		5824.4Randall McClain, K.; Gould, Colin A.; Chakarawet, Khetpakorn; Teat, Simon J.; Groshens, Thomas J.; Long, Jeffrey R.; Harvey, Benjamin G.
High-temperature magnetic blocking and magneto-structural correlations in a series of dysprosium(iii) metallocenium single-molecule magnets.
Chemical science, 2018, 9, 8492-8503
1552914 CIFC58 H58 B F20 YP 1 21 116.538; 14.4952; 22.753
90; 90.053; 90		5454.4Randall McClain, K.; Gould, Colin A.; Chakarawet, Khetpakorn; Teat, Simon J.; Groshens, Thomas J.; Long, Jeffrey R.; Harvey, Benjamin G.
High-temperature magnetic blocking and magneto-structural correlations in a series of dysprosium(iii) metallocenium single-molecule magnets.
Chemical science, 2018, 9, 8492-8503
1552915 CIFC60 H62 B F20 YP 1 21/c 114.599; 16.737; 47.12
90; 90.253; 90		11513Randall McClain, K.; Gould, Colin A.; Chakarawet, Khetpakorn; Teat, Simon J.; Groshens, Thomas J.; Long, Jeffrey R.; Harvey, Benjamin G.
High-temperature magnetic blocking and magneto-structural correlations in a series of dysprosium(iii) metallocenium single-molecule magnets.
Chemical science, 2018, 9, 8492-8503
1552918 CIFC220 H195 Au25 Cl2 F10.62 P10 S5 Sb2.02P 1 21/n 120.449; 35.9379; 31.80647
90; 91.1204; 90		23369.9Nair, Lakshmi V.; Hossain, Sakiat; Takagi, Shunjiro; Imai, Yukari; Hu, Guoxiang; Wakayama, Shota; Kumar, Bharat; Kurashige, Wataru; Jiang, De-En; Negishi, Yuichi
Hetero-biicosahedral [Au<sub>24</sub>Pd(PPh<sub>3</sub>)<sub>10</sub>(SC<sub>2</sub>H<sub>4</sub>Ph)<sub>5</sub>Cl<sub>2</sub>]<sup>+</sup> nanocluster: selective synthesis and optical and electrochemical properties.
Nanoscale, 2018, 10, 18969-18979
1552959 CIFC22 H23 Eu N2 O9C 1 2/c 128.22; 14.54; 13.394
90; 100.684; 90		5401Wang, Xin-Yu; Yao, Xu; Huang, Qiang; Li, Yu-Xin; An, Guang-Hui; Li, Guang-Ming
Triple-Wavelength-Region Luminescence Sensing Based on a Color-Tunable Emitting Lanthanide Metal Organic Framework.
Analytical chemistry, 2018, 90, 6675-6682
1552960 CIFC22 H21 La N2 O9C 1 2/c 128.492; 14.539; 13.492
90; 101.87; 90		5469Wang, Xin-Yu; Yao, Xu; Huang, Qiang; Li, Yu-Xin; An, Guang-Hui; Li, Guang-Ming
Triple-Wavelength-Region Luminescence Sensing Based on a Color-Tunable Emitting Lanthanide Metal Organic Framework.
Analytical chemistry, 2018, 90, 6675-6682
1552961 CIFC22 H23 N2 O9 TbC 1 2/c 128.614; 14.383; 13.644
90; 97.284; 90		5570Wang, Xin-Yu; Yao, Xu; Huang, Qiang; Li, Yu-Xin; An, Guang-Hui; Li, Guang-Ming
Triple-Wavelength-Region Luminescence Sensing Based on a Color-Tunable Emitting Lanthanide Metal Organic Framework.
Analytical chemistry, 2018, 90, 6675-6682
1552962 CIFC51 H80 O38C 1 2 118.661; 24.3629; 15.4291
90; 110.652; 90		6563.9Suzuki, Nozomu; Kinoshita, Mariko; Miyabe, Kanji
Kinetic Study of Chiral Intermolecular Interactions by Moment Analysis Based on Affinity Capillary Electrophoresis.
Analytical chemistry, 2018, 90, 11048-11053
1553243 CIFC15 H20 O4P 21 21 2113.0489; 12.6807; 7.92534
90; 90; 90		1311.4Zhang, Xiao-Yan; Liu, Zhan-Liang; Sun, Bing-Da; Niu, Shu-Bin; Wang, Meng-Hua; Tan, Xiang-Mei; Zou, Zhong-Mei; Ding, Gang
Bioactive Resorcylic Acid Lactones with Different Ring Systems from Desert Plant Chaetosphaeronema hispidulum. [corrected].
Journal of agricultural and food chemistry, 2018, 66, 8976-8982
1553246 CIFC27 H37 N2 O3.5P 1 21/c 126.9572; 9.9991; 19.3387
90; 100.974; 90		5117.4Smith, Catherine J.; Mansfield, Steven J.; Anderson, Edward A.; Burton, Jonathan W.
Four Step Total Synthesis of an H3Receptor Antagonist Using Only Tools Found in a Typical Teaching Laboratory
Journal of Chemical Education, 2018, 96, 137
1553247 CIFC11 H12 Br N O2P 329.9756; 9.9756; 9.8502
90; 90; 120		848.89Smith, Catherine J.; Mansfield, Steven J.; Anderson, Edward A.; Burton, Jonathan W.
Four Step Total Synthesis of an H3Receptor Antagonist Using Only Tools Found in a Typical Teaching Laboratory
Journal of Chemical Education, 2018, 96, 137
1553248 CIFC17 H17 N O3I 1 a 19.8846; 9.7683; 15.0513
90; 97.453; 90		1441.01Smith, Catherine J.; Mansfield, Steven J.; Anderson, Edward A.; Burton, Jonathan W.
Four Step Total Synthesis of an H3Receptor Antagonist Using Only Tools Found in a Typical Teaching Laboratory
Journal of Chemical Education, 2018, 96, 137
1553253 CIFC19 H23 Cl F N O4 SP 1 21/c 122.01; 9.223; 9.454
90; 100.101; 90		1889.4Focken, Thilo; Chowdhury, Sultan; Zenova, Alla; Grimwood, Michael E.; Chabot, Christine; Sheng, Tao; Hemeon, Ivan; Decker, Shannon M.; Wilson, Michael; Bichler, Paul; Jia, Qi; Sun, Shaoyi; Young, Clint; Lin, Sophia; Goodchild, Samuel J.; Shuart, Noah G.; Chang, Elaine; Xie, Zhiwei; Li, Bowen; Khakh, Kuldip; Bankar, Girish; Waldbrook, Matthew; Kwan, Rainbow; Nelkenbrecher, Karen; Karimi Tari, Parisa; Chahal, Navjot; Sojo, Luis; Robinette, C. Lee; White, Andrew D.; Chen, Chien-An; Zhang, Yi; Pang, Jodie; Chang, Jae H.; Hackos, David H.; Johnson, Jr, J P; Cohen, Charles J.; Ortwine, Daniel F.; Sutherlin, Daniel P.; Dehnhardt, Christoph M.; Safina, Brian S.
Design of Conformationally Constrained Acyl Sulfonamide Isosteres: Identification of N-([1,2,4]Triazolo[4,3- a]pyridin-3-yl)methane-sulfonamides as Potent and Selective hNa<sub>V</sub>1.7 Inhibitors for the Treatment of Pain.
Journal of medicinal chemistry, 2018, 61, 4810-4831
1553254 CIFC27 H28 Br N5 O3P 1 21 113.774; 18.775; 10.658
90; 110.084; 90		2588.6Xue, Yu; Song, Peiran; Song, Zilan; Wang, Aoli; Tong, Linjiang; Geng, Meiyu; Ding, Jian; Liu, Qingsong; Sun, Liping; Xie, Hua; Zhang, Ao
Discovery of 4,7-Diamino-5-(4-phenoxyphenyl)-6-methylene-pyrimido[5,4- b]pyrrolizines as Novel Bruton's Tyrosine Kinase Inhibitors.
Journal of medicinal chemistry, 2018, 61, 4608-4627
1553255 CIFC12 H11 N O3P 21 21 216.917; 8.4769; 18.1729
90; 90; 90		1065.56Xue, Yu; Song, Peiran; Song, Zilan; Wang, Aoli; Tong, Linjiang; Geng, Meiyu; Ding, Jian; Liu, Qingsong; Sun, Liping; Xie, Hua; Zhang, Ao
Discovery of 4,7-Diamino-5-(4-phenoxyphenyl)-6-methylene-pyrimido[5,4- b]pyrrolizines as Novel Bruton's Tyrosine Kinase Inhibitors.
Journal of medicinal chemistry, 2018, 61, 4608-4627
1553256 CIFC26 H20 F N5 O2P -17.7758; 10.3458; 14.6505
71.053; 75.006; 80.624		1072.75Zhao, Yujun; Zhou, Bing; Bai, Longchuan; Liu, Liu; Yang, Chao-Yie; Meagher, Jennifer L.; Stuckey, Jeanne A.; McEachern, Donna; Przybranowski, Sally; Wang, Mi; Ran, Xu; Aguilar, Angelo; Hu, Yang; Kampf, Jeff W.; Li, Xiaoqin; Zhao, Ting; Li, Siwei; Wen, Bo; Sun, Duxin; Wang, Shaomeng
Structure-Based Discovery of CF53 as a Potent and Orally Bioavailable Bromodomain and Extra-Terminal (BET) Bromodomain Inhibitor.
Journal of medicinal chemistry, 2018, 61, 6110-6120
1553257 CIFC H OP 21 21 216.9288; 7.9172; 52.844
90; 90; 90		2898.8Das, Pronay; Babbar, Palak; Malhotra, Nipun; Sharma, Manmohan; Jachak, Goraknath R.; Gonnade, Rajesh G.; Shanmugam, Dhanasekaran; Harlos, Karl; Yogavel, Manickam; Sharma, Amit; Reddy, D. Srinivasa
Specific Stereoisomeric Conformations Determine the Drug Potency of Cladosporin Scaffold against Malarial Parasite.
Journal of medicinal chemistry, 2018, 61, 5664-5678
1553258 CIFC16 H20 O5P 43 21 28.0784; 8.0784; 45.237
90; 90; 90		2952.2Das, Pronay; Babbar, Palak; Malhotra, Nipun; Sharma, Manmohan; Jachak, Goraknath R.; Gonnade, Rajesh G.; Shanmugam, Dhanasekaran; Harlos, Karl; Yogavel, Manickam; Sharma, Amit; Reddy, D. Srinivasa
Specific Stereoisomeric Conformations Determine the Drug Potency of Cladosporin Scaffold against Malarial Parasite.
Journal of medicinal chemistry, 2018, 61, 5664-5678
1553259 CIFC16 H20 O5P 1 21 17.7904; 11.4929; 16.2869
90; 103.739; 90		1416.5Das, Pronay; Babbar, Palak; Malhotra, Nipun; Sharma, Manmohan; Jachak, Goraknath R.; Gonnade, Rajesh G.; Shanmugam, Dhanasekaran; Harlos, Karl; Yogavel, Manickam; Sharma, Amit; Reddy, D. Srinivasa
Specific Stereoisomeric Conformations Determine the Drug Potency of Cladosporin Scaffold against Malarial Parasite.
Journal of medicinal chemistry, 2018, 61, 5664-5678
1553260 CIFC21 H25 F2 N3 O2P 21 21 217.5165; 8.0959; 24.661
90; 90; 90		1500.7Das, Pronay; Babbar, Palak; Malhotra, Nipun; Sharma, Manmohan; Jachak, Goraknath R.; Gonnade, Rajesh G.; Shanmugam, Dhanasekaran; Harlos, Karl; Yogavel, Manickam; Sharma, Amit; Reddy, D. Srinivasa
Specific Stereoisomeric Conformations Determine the Drug Potency of Cladosporin Scaffold against Malarial Parasite.
Journal of medicinal chemistry, 2018, 61, 5664-5678
1553261 CIFC27 H32 N2 O4P 1 21/c 19.41991; 10.1144; 23.7285
90; 91.6653; 90		2259.82Zhang, Xiao-Ru; Wang, Hao-Wen; Tang, Wen-Lin; Zhang, Yu; Yang, Hui; Hu, De-Xuan; Ravji, Azhar; Marchand, Christophe; Kiselev, Evgeny; Ofori-Atta, Kwabena; Agama, Keli; Pommier, Yves; An, Lin-Kun
Discovery, Synthesis, and Evaluation of Oxynitidine Derivatives as Dual Inhibitors of DNA Topoisomerase IB (TOP1) and Tyrosyl-DNA Phosphodiesterase 1 (TDP1), and Potential Antitumor Agents.
Journal of medicinal chemistry, 2018, 61, 9908-9930
1553262 CIFC29.2 H31.8 Cl Ir N5 O0.2P -19.804; 15.8991; 18.4457
82.7271; 86.7456; 72.239		2715.65Chen, Feng; Moat, John; McFeely, Daniel; Clarkson, Guy; Hands-Portman, Ian J; Furner-Pardoe, Jessica P; Harrison, Freya; Dowson, Christopher G.; Sadler, Peter J.
Biguanide Iridium(III) Complexes with Potent Antimicrobial Activity.
Journal of medicinal chemistry, 2018, 61, 7330-7344
1553263 CIFC18.75 H26 Cl Ir N5 O0.75P b c a11.78544; 14.43434; 23.04719
90; 90; 90		3920.67Chen, Feng; Moat, John; McFeely, Daniel; Clarkson, Guy; Hands-Portman, Ian J; Furner-Pardoe, Jessica P; Harrison, Freya; Dowson, Christopher G.; Sadler, Peter J.
Biguanide Iridium(III) Complexes with Potent Antimicrobial Activity.
Journal of medicinal chemistry, 2018, 61, 7330-7344
1553264 CIFC26 H23 N3 O3P -17.738; 10.534; 14.044
70.163; 86.367; 81.901		1065.9Wu, Qiong; Zheng, Kangdi; Huang, Xiaoting; Li, Li; Mei, Wenjie
Tanshinone-IIA-Based Analogues of Imidazole Alkaloid Act as Potent Inhibitors To Block Breast Cancer Invasion and Metastasis in Vivo.
Journal of medicinal chemistry, 2018, 61, 10488-10501
1553265 CIFC12 H11.556 N0.889 O0.889P 1 21/c 112.27; 21.5852; 8.2015
90; 99.774; 90		2140.64Wu, Qiong; Zheng, Kangdi; Huang, Xiaoting; Li, Li; Mei, Wenjie
Tanshinone-IIA-Based Analogues of Imidazole Alkaloid Act as Potent Inhibitors To Block Breast Cancer Invasion and Metastasis in Vivo.
Journal of medicinal chemistry, 2018, 61, 10488-10501
1553266 CIFC26 H24 N2 O2P 1 21/c 110.2122; 16.083; 12.5447
90; 104.737; 90		1992.6Wu, Qiong; Zheng, Kangdi; Huang, Xiaoting; Li, Li; Mei, Wenjie
Tanshinone-IIA-Based Analogues of Imidazole Alkaloid Act as Potent Inhibitors To Block Breast Cancer Invasion and Metastasis in Vivo.
Journal of medicinal chemistry, 2018, 61, 10488-10501
1553278 CIFC9 H7 Cl N6P 21 21 215.436; 9.003; 21.664
90; 90; 90		1060.2Tokarenko, Anna; Lišková, Barbora; Smoleń, Sabina; Táborská, Natálie; Tichý, Michal; Gurská, Soňa; Perlíková, Pavla; Frydrych, Ivo; Tloušt'ová, Eva; Znojek, Pawel; Mertlíková-Kaiserová, Helena; Poštová Slavětínská, Lenka; Pohl, Radek; Klepetářová, Blanka; Khalid, Noor-Ul-Ain; Wenren, Yiqian; Laposa, Rebecca R.; Džubák, Petr; Hajdúch, Marián; Hocek, Michal
Synthesis and Cytotoxic and Antiviral Profiling of Pyrrolo- and Furo-Fused 7-Deazapurine Ribonucleosides.
Journal of medicinal chemistry, 2018, 61, 9347-9359
1553279 CIFC9 H7 Cl N4P 1 21/n 18.2465; 6.6263; 16.392
90; 97.969; 90		887.07Tokarenko, Anna; Lišková, Barbora; Smoleń, Sabina; Táborská, Natálie; Tichý, Michal; Gurská, Soňa; Perlíková, Pavla; Frydrych, Ivo; Tloušt'ová, Eva; Znojek, Pawel; Mertlíková-Kaiserová, Helena; Poštová Slavětínská, Lenka; Pohl, Radek; Klepetářová, Blanka; Khalid, Noor-Ul-Ain; Wenren, Yiqian; Laposa, Rebecca R.; Džubák, Petr; Hajdúch, Marián; Hocek, Michal
Synthesis and Cytotoxic and Antiviral Profiling of Pyrrolo- and Furo-Fused 7-Deazapurine Ribonucleosides.
Journal of medicinal chemistry, 2018, 61, 9347-9359
1553313 CIFC14 H20 O4P 6515.7712; 15.7712; 10.4612
90; 90; 120		2253.42Li, Tian-Xiao; Liu, Rui-Huan; Wang, Xiao-Bing; Luo, Jun; Luo, Jian-Guang; Kong, Ling-Yi; Yang, Ming-Hua
Hypoxia-Protective Azaphilone Adducts from Peyronellaea glomerata.
Journal of natural products, 2018, 81, 1148-1153
1553314 CIFC15 H24 O2P 1 21 15.8459; 7.8647; 14.9863
90; 96.369; 90		684.76Zhou, Qin-Mei; Chen, Ming-Hua; Li, Xiao-Hong; Peng, Cheng; Lin, Da-Sheng; Li, Xiao-Nian; He, Yang; Xiong, Liang
Absolute Configurations and Bioactivities of Guaiane-Type Sesquiterpenoids Isolated from Pogostemon cablin.
Journal of natural products, 2018, 81, 1919-1927
1553315 CIFC15 H26 O2P 1 21 110.28; 15.493; 10.27
90; 119.71; 90		1420.7Zhou, Qin-Mei; Chen, Ming-Hua; Li, Xiao-Hong; Peng, Cheng; Lin, Da-Sheng; Li, Xiao-Nian; He, Yang; Xiong, Liang
Absolute Configurations and Bioactivities of Guaiane-Type Sesquiterpenoids Isolated from Pogostemon cablin.
Journal of natural products, 2018, 81, 1919-1927
1553316 CIFC15 H24 O2P 1 21 111.5078; 10.0306; 12.1928
90; 101.04; 90		1381.37Zhou, Qin-Mei; Chen, Ming-Hua; Li, Xiao-Hong; Peng, Cheng; Lin, Da-Sheng; Li, Xiao-Nian; He, Yang; Xiong, Liang
Absolute Configurations and Bioactivities of Guaiane-Type Sesquiterpenoids Isolated from Pogostemon cablin.
Journal of natural products, 2018, 81, 1919-1927
1553317 CIFC15 H24 O2P 1 21 17.5723; 9.7359; 9.3881
90; 102.926; 90		674.58Zhou, Qin-Mei; Chen, Ming-Hua; Li, Xiao-Hong; Peng, Cheng; Lin, Da-Sheng; Li, Xiao-Nian; He, Yang; Xiong, Liang
Absolute Configurations and Bioactivities of Guaiane-Type Sesquiterpenoids Isolated from Pogostemon cablin.
Journal of natural products, 2018, 81, 1919-1927
1553318 CIFC20 H26 O5P 1 21 111.6575; 9.7318; 15.2642
90; 93.137; 90		1729.11Hu, Hai-Jun; Zhou, Yue; Han, Zhu-Zhen; Shi, Yan-Hong; Zhang, Shu-Sheng; Wang, Zheng-Tao; Yang, Li
Abietane Diterpenoids from the Roots of Clerodendrum trichotomum and Their Nitric Oxide Inhibitory Activities.
Journal of natural products, 2018, 81, 1508-1516
1553319 CIFC20 H24 O5C 1 2 119.3772; 8.318; 11.812
90; 109.092; 90		1799.13Hu, Hai-Jun; Zhou, Yue; Han, Zhu-Zhen; Shi, Yan-Hong; Zhang, Shu-Sheng; Wang, Zheng-Tao; Yang, Li
Abietane Diterpenoids from the Roots of Clerodendrum trichotomum and Their Nitric Oxide Inhibitory Activities.
Journal of natural products, 2018, 81, 1508-1516
1553320 CIFC20 H22 O5P 21 21 218.2214; 10.0997; 20.3117
90; 90; 90		1686.56Hu, Hai-Jun; Zhou, Yue; Han, Zhu-Zhen; Shi, Yan-Hong; Zhang, Shu-Sheng; Wang, Zheng-Tao; Yang, Li
Abietane Diterpenoids from the Roots of Clerodendrum trichotomum and Their Nitric Oxide Inhibitory Activities.
Journal of natural products, 2018, 81, 1508-1516
1553321 CIFC19 H15 N O5P -16.93466; 9.91657; 11.54675
71.8945; 84.5865; 75.6285		730.985Zhang, Jun; Zhang, Qing-Ying; Tu, Peng-Fei; Xu, Fu-Chun; Liang, Hong
Mucroniferanines A-G, Isoquinoline Alkaloids from Corydalis mucronifera.
Journal of natural products, 2018, 81, 364-370
1553322 CIFC15 H24 O3P 21 21 211.3606; 13.5941; 9.1502
90; 90; 90		1413.13Xie, Shuangshuang; Wu, Ye; Qiao, Yuben; Guo, Yi; Wang, Jianping; Hu, Zhengxi; Zhang, Qing; Li, Xiaonian; Huang, Jinfeng; Zhou, Qun; Luo, Zengwei; Liu, Junjun; Zhu, Hucheng; Xue, Yongbo; Zhang, Yonghui
Protoilludane, Illudalane, and Botryane Sesquiterpenoids from the Endophytic Fungus Phomopsis sp. TJ507A.
Journal of natural products, 2018, 81, 1311-1320
1553323 CIFC16 H24 O3P -18.7757; 9.156; 9.8895
73.107; 85.312; 82.044		752.29Xie, Shuangshuang; Wu, Ye; Qiao, Yuben; Guo, Yi; Wang, Jianping; Hu, Zhengxi; Zhang, Qing; Li, Xiaonian; Huang, Jinfeng; Zhou, Qun; Luo, Zengwei; Liu, Junjun; Zhu, Hucheng; Xue, Yongbo; Zhang, Yonghui
Protoilludane, Illudalane, and Botryane Sesquiterpenoids from the Endophytic Fungus Phomopsis sp. TJ507A.
Journal of natural products, 2018, 81, 1311-1320
1553324 CIFC15 H20 O3P 21 21 217.9251; 11.9865; 14.2732
90; 90; 90		1355.87Xie, Shuangshuang; Wu, Ye; Qiao, Yuben; Guo, Yi; Wang, Jianping; Hu, Zhengxi; Zhang, Qing; Li, Xiaonian; Huang, Jinfeng; Zhou, Qun; Luo, Zengwei; Liu, Junjun; Zhu, Hucheng; Xue, Yongbo; Zhang, Yonghui
Protoilludane, Illudalane, and Botryane Sesquiterpenoids from the Endophytic Fungus Phomopsis sp. TJ507A.
Journal of natural products, 2018, 81, 1311-1320
1553325 CIFC26.5 H31 F N O6P 1 21 19.4144; 25.4932; 10.9393
90; 115.504; 90		2369.63Egbewande, Folake A.; Sadowski, Martin C.; Levrier, Claire; Tousignant, Kaylyn D.; White, Jonathan M.; Coster, Mark J.; Nelson, Colleen C.; Davis, Rohan A.
Identification of Gibberellic Acid Derivatives That Deregulate Cholesterol Metabolism in Prostate Cancer Cells.
Journal of natural products, 2018, 81, 838-845
1553326 CIFC9 H9 N O3P b c a8.7826; 13.1341; 16.1714
90; 90; 90		1865.4Chang, Fang-Rong; Li, Pei-Shian; Huang Liu, Rosa; Hu, Hao-Chun; Hwang, Tsong-Long; Lee, Jin-Ching; Chen, Shu-Li; Wu, Yang-Chang; Cheng, Yuan-Bin
Bioactive Phenolic Components from the Twigs of Atalantia buxifolia.
Journal of natural products, 2018, 81, 1534-1539
1553327 CIFC20 H34 O5P 1 21 16.6038; 20.8285; 7.1958
90; 112.565; 90		913.99Zhu, Yu-Xun; Zhang, Zhao-Xin; Yan, Hui-Min; Lu, Di; Zhang, Huan-Ping; Li, Li; Liu, Yun-Bao; Li, Yong
Antinociceptive Diterpenoids from the Leaves and Twigs of Rhododendron decorum.
Journal of natural products, 2018, 81, 1183-1192
1553328 CIFC16 H13 N O4P 1 21/c 17.4572; 8.9283; 18.5642
90; 92.91; 90		1234.4Ndongo, Joseph T.; Mbing, Joséphine N; Monteillier, Aymeric; Tala, Michel F.; Rütten, Michael; Mombers, Daniel; Cuendet, Muriel; Pegnyemb, Dieudonné E; Dittrich, Birger; Laatsch, Hartmut
Carbazole-, Aspidofractinine-, and Aspidocarpamine-Type Alkaloids from Pleiocarpa pycnantha.
Journal of natural products, 2018, 81, 1193-1202
1553329 CIFC23 H28 N2 O4P 1 21 17.4061; 9.1421; 14.8478
90; 95.826; 90		1000.11Ndongo, Joseph T.; Mbing, Joséphine N; Monteillier, Aymeric; Tala, Michel F.; Rütten, Michael; Mombers, Daniel; Cuendet, Muriel; Pegnyemb, Dieudonné E; Dittrich, Birger; Laatsch, Hartmut
Carbazole-, Aspidofractinine-, and Aspidocarpamine-Type Alkaloids from Pleiocarpa pycnantha.
Journal of natural products, 2018, 81, 1193-1202
1553330 CIFC20 H28 O4P 21 21 218.8766; 10.9773; 18.104
90; 90; 90		1764.07Qi, Xiao-Li; Zhang, Ying-Ying; Zhao, Peng; Zhou, Le; Wang, Xiao-Bo; Huang, Xiao-Xiao; Lin, Bin; Song, Shao-Jiang
ent-Kaurane Diterpenoids with Neuroprotective Properties from Corn Silk ( Zea mays).
Journal of natural products, 2018, 81, 1225-1234
1553331 CIFC1.43 H1.43 O0.72P 21 21 214.7901; 19.0871; 8.0499
90; 90; 90		2272.49Cai, Runlin; Wu, Yingnan; Chen, Senhua; Cui, Hui; Liu, Zhaoming; Li, Chunyuan; She, Zhigang
Peniisocoumarins A-J: Isocoumarins from Penicillium commune QQF-3, an Endophytic Fungus of the Mangrove Plant Kandelia candel.
Journal of natural products, 2018, 81, 1376-1383
1553332 CIFC H OI 1 2/a 127.9933; 9.57267; 22.8556
90; 118.274; 90		5393.91Cai, Runlin; Wu, Yingnan; Chen, Senhua; Cui, Hui; Liu, Zhaoming; Li, Chunyuan; She, Zhigang
Peniisocoumarins A-J: Isocoumarins from Penicillium commune QQF-3, an Endophytic Fungus of the Mangrove Plant Kandelia candel.
Journal of natural products, 2018, 81, 1376-1383
1553333 CIFC28 H24 O12P -18.1894; 10.3069; 15.1113
82.627; 87.492; 76.457		1229.66Cai, Runlin; Wu, Yingnan; Chen, Senhua; Cui, Hui; Liu, Zhaoming; Li, Chunyuan; She, Zhigang
Peniisocoumarins A-J: Isocoumarins from Penicillium commune QQF-3, an Endophytic Fungus of the Mangrove Plant Kandelia candel.
Journal of natural products, 2018, 81, 1376-1383
1553334 CIFC13 H13 Cl O5C 1 2 122.066; 9.1694; 6.5996
90; 107.302; 90		1274.89Cai, Runlin; Wu, Yingnan; Chen, Senhua; Cui, Hui; Liu, Zhaoming; Li, Chunyuan; She, Zhigang
Peniisocoumarins A-J: Isocoumarins from Penicillium commune QQF-3, an Endophytic Fungus of the Mangrove Plant Kandelia candel.
Journal of natural products, 2018, 81, 1376-1383
1553335 CIFC13 H15 Cl O7P 15.0238; 5.5679; 12.8812
99.395; 94.679; 105.645		339.31Cai, Runlin; Wu, Yingnan; Chen, Senhua; Cui, Hui; Liu, Zhaoming; Li, Chunyuan; She, Zhigang
Peniisocoumarins A-J: Isocoumarins from Penicillium commune QQF-3, an Endophytic Fungus of the Mangrove Plant Kandelia candel.
Journal of natural products, 2018, 81, 1376-1383
1553336 CIFC15 H14 O6P 21 21 214.5542; 11.4674; 25.3578
90; 90; 90		1324.31Cai, Runlin; Wu, Yingnan; Chen, Senhua; Cui, Hui; Liu, Zhaoming; Li, Chunyuan; She, Zhigang
Peniisocoumarins A-J: Isocoumarins from Penicillium commune QQF-3, an Endophytic Fungus of the Mangrove Plant Kandelia candel.
Journal of natural products, 2018, 81, 1376-1383
1553337 CIFC20 H26 O3P 21 21 216.6328; 11.7781; 22.7943
90; 90; 90		1780.73Zhang, Chun-Yan; Zhang, Li-Jun; Lu, Zhi-Cheng; Ma, Chen-Yun; Ye, Ying; Rahman, Khalid; Zhang, Hong; Zhu, Jian-Yong
Antitumor Activity of Diterpenoids from Jatropha gossypiifolia: Cell Cycle Arrest and Apoptosis-Inducing Activity in RKO Colon Cancer Cells.
Journal of natural products, 2018, 81, 1701-1710
1553338 CIFC22 H30 O4P 21 21 218.9197; 13.6933; 16.4126
90; 90; 90		2004.64Zhang, Chun-Yan; Zhang, Li-Jun; Lu, Zhi-Cheng; Ma, Chen-Yun; Ye, Ying; Rahman, Khalid; Zhang, Hong; Zhu, Jian-Yong
Antitumor Activity of Diterpenoids from Jatropha gossypiifolia: Cell Cycle Arrest and Apoptosis-Inducing Activity in RKO Colon Cancer Cells.
Journal of natural products, 2018, 81, 1701-1710
1553339 CIFC22 H30 O4P 21 21 210.775; 20.705; 9.606
90; 90; 90		2143.1Zhang, Chun-Yan; Zhang, Li-Jun; Lu, Zhi-Cheng; Ma, Chen-Yun; Ye, Ying; Rahman, Khalid; Zhang, Hong; Zhu, Jian-Yong
Antitumor Activity of Diterpenoids from Jatropha gossypiifolia: Cell Cycle Arrest and Apoptosis-Inducing Activity in RKO Colon Cancer Cells.
Journal of natural products, 2018, 81, 1701-1710
1553340 CIFC12 H18 O8P 21 21 216.7584; 14.2353; 27.7506
90; 90; 90		2669.83Deans, Bianca J.; Kilah, Nathan L.; Jordan, Gregory J.; Bissember, Alex C.; Smith, Jason A.
Arbutin Derivatives Isolated from Ancient Proteaceae: Potential Phytochemical Markers Present in Bellendena, Cenarrhenes, and Persoonia Genera.
Journal of natural products, 2018, 81, 1241-1251
1553341 CIFC22 H28 O11P 1 21 114.958; 4.754; 15.974
90; 100.84; 90		1115.6Deans, Bianca J.; Kilah, Nathan L.; Jordan, Gregory J.; Bissember, Alex C.; Smith, Jason A.
Arbutin Derivatives Isolated from Ancient Proteaceae: Potential Phytochemical Markers Present in Bellendena, Cenarrhenes, and Persoonia Genera.
Journal of natural products, 2018, 81, 1241-1251
1553342 CIFC17 H22 O9P 14.9; 12.5; 14.55
86.4; 88.07; 80.31		876.5Deans, Bianca J.; Kilah, Nathan L.; Jordan, Gregory J.; Bissember, Alex C.; Smith, Jason A.
Arbutin Derivatives Isolated from Ancient Proteaceae: Potential Phytochemical Markers Present in Bellendena, Cenarrhenes, and Persoonia Genera.
Journal of natural products, 2018, 81, 1241-1251
1553343 CIFC17 H24 O10C 1 2 114.2391; 6.4146; 19.8531
90; 95.8796; 90		1803.81Deans, Bianca J.; Kilah, Nathan L.; Jordan, Gregory J.; Bissember, Alex C.; Smith, Jason A.
Arbutin Derivatives Isolated from Ancient Proteaceae: Potential Phytochemical Markers Present in Bellendena, Cenarrhenes, and Persoonia Genera.
Journal of natural products, 2018, 81, 1241-1251
1553344 CIFC21 H22 O10P 21 21 215.353; 17.855; 19.903
90; 90; 90		1902.3Deans, Bianca J.; Kilah, Nathan L.; Jordan, Gregory J.; Bissember, Alex C.; Smith, Jason A.
Arbutin Derivatives Isolated from Ancient Proteaceae: Potential Phytochemical Markers Present in Bellendena, Cenarrhenes, and Persoonia Genera.
Journal of natural products, 2018, 81, 1241-1251
1553345 CIFC27 H36 O8I 427.2552; 27.2552; 7.0051
90; 90; 90		5203.71Qi, Changxing; Liu, Mengting; Zhou, Qun; Gao, Weixi; Chen, Chunmei; Lai, Yongji; Hu, Zhengxi; Xue, Yongbo; Zhang, Jinwen; Li, Dongyan; Li, Xiao-Nian; Zhang, Qing; Wang, Jianping; Zhu, Hucheng; Zhang, Yonghui
BACE1 Inhibitory Meroterpenoids from Aspergillus terreus.
Journal of natural products, 2018, 81, 1937-1945
1553346 CIFC26 H34 O8P 21 21 218.0835; 14.1264; 21.173
90; 90; 90		2417.76Qi, Changxing; Liu, Mengting; Zhou, Qun; Gao, Weixi; Chen, Chunmei; Lai, Yongji; Hu, Zhengxi; Xue, Yongbo; Zhang, Jinwen; Li, Dongyan; Li, Xiao-Nian; Zhang, Qing; Wang, Jianping; Zhu, Hucheng; Zhang, Yonghui
BACE1 Inhibitory Meroterpenoids from Aspergillus terreus.
Journal of natural products, 2018, 81, 1937-1945
1553347 CIFC27 H40 O9P 21 21 217.8574; 11.5792; 28.3079
90; 90; 90		2575.52Qi, Changxing; Liu, Mengting; Zhou, Qun; Gao, Weixi; Chen, Chunmei; Lai, Yongji; Hu, Zhengxi; Xue, Yongbo; Zhang, Jinwen; Li, Dongyan; Li, Xiao-Nian; Zhang, Qing; Wang, Jianping; Zhu, Hucheng; Zhang, Yonghui
BACE1 Inhibitory Meroterpenoids from Aspergillus terreus.
Journal of natural products, 2018, 81, 1937-1945
1553348 CIFC26 H34 O8P 16.5706; 7.0972; 13.8873
103.479; 90.068; 105.91		604.17Qi, Changxing; Liu, Mengting; Zhou, Qun; Gao, Weixi; Chen, Chunmei; Lai, Yongji; Hu, Zhengxi; Xue, Yongbo; Zhang, Jinwen; Li, Dongyan; Li, Xiao-Nian; Zhang, Qing; Wang, Jianping; Zhu, Hucheng; Zhang, Yonghui
BACE1 Inhibitory Meroterpenoids from Aspergillus terreus.
Journal of natural products, 2018, 81, 1937-1945
1553349 CIFC26 H30 O9P 1 21 118.2722; 8.8097; 30.3644
90; 106.554; 90		4685.2Qi, Changxing; Liu, Mengting; Zhou, Qun; Gao, Weixi; Chen, Chunmei; Lai, Yongji; Hu, Zhengxi; Xue, Yongbo; Zhang, Jinwen; Li, Dongyan; Li, Xiao-Nian; Zhang, Qing; Wang, Jianping; Zhu, Hucheng; Zhang, Yonghui
BACE1 Inhibitory Meroterpenoids from Aspergillus terreus.
Journal of natural products, 2018, 81, 1937-1945
1553350 CIFC26 H34 O7P 1 21 112.239; 8.3534; 23.758
90; 97.666; 90		2407.2Qi, Changxing; Liu, Mengting; Zhou, Qun; Gao, Weixi; Chen, Chunmei; Lai, Yongji; Hu, Zhengxi; Xue, Yongbo; Zhang, Jinwen; Li, Dongyan; Li, Xiao-Nian; Zhang, Qing; Wang, Jianping; Zhu, Hucheng; Zhang, Yonghui
BACE1 Inhibitory Meroterpenoids from Aspergillus terreus.
Journal of natural products, 2018, 81, 1937-1945
1553351 CIFC15 H24 O2P 21 21 216.02825; 12.9002; 17.5524
90; 90; 90		1364.97Zhang, Ruifei; Feng, Xiao; Su, Guozhu; Mu, Zejing; Zhang, Hexinge; Zhao, Yanan; Jiao, Shungang; Cao, Lan; Chen, Suyile; Tu, Pengfei; Chai, Xingyun
Bioactive Sesquiterpenoids from the Peeled Stems of Syringa pinnatifolia.
Journal of natural products, 2018, 81, 1711-1720
1553352 CIFC16 H26 O3P -17.4903; 10.5587; 11.233
63.805; 72.976; 85.623		760.77Zhang, Ruifei; Feng, Xiao; Su, Guozhu; Mu, Zejing; Zhang, Hexinge; Zhao, Yanan; Jiao, Shungang; Cao, Lan; Chen, Suyile; Tu, Pengfei; Chai, Xingyun
Bioactive Sesquiterpenoids from the Peeled Stems of Syringa pinnatifolia.
Journal of natural products, 2018, 81, 1711-1720
1553353 CIFC15 H26 OP 1 21 16.0061; 25.4056; 13.9957
90; 92.894; 90		2132.86Zhang, Ruifei; Feng, Xiao; Su, Guozhu; Mu, Zejing; Zhang, Hexinge; Zhao, Yanan; Jiao, Shungang; Cao, Lan; Chen, Suyile; Tu, Pengfei; Chai, Xingyun
Bioactive Sesquiterpenoids from the Peeled Stems of Syringa pinnatifolia.
Journal of natural products, 2018, 81, 1711-1720
1553354 CIFC15 H24 O2P 21 21 216.0342; 12.8921; 17.5406
90; 90; 90		1364.54Zhang, Ruifei; Feng, Xiao; Su, Guozhu; Mu, Zejing; Zhang, Hexinge; Zhao, Yanan; Jiao, Shungang; Cao, Lan; Chen, Suyile; Tu, Pengfei; Chai, Xingyun
Bioactive Sesquiterpenoids from the Peeled Stems of Syringa pinnatifolia.
Journal of natural products, 2018, 81, 1711-1720
1553355 CIFC29.25 H43 O3.25C 1 2 145.884; 7.0425; 15.7032
90; 103.902; 90		4925.7Liu, Fei; Wang, Ya-Nan; Li, Yong; Ma, Shuang-Gang; Qu, Jing; Liu, Yun-Bao; Niu, Chang-Shan; Tang, Zhong-Hai; Li, Yu-Huan; Li, Li; Yu, Shi-Shan
Minor Nortriterpenoids from the Twigs and Leaves of Rhododendron latoucheae.
Journal of natural products, 2018, 81, 1721-1733
1553356 CIFC34 H48 O10P -19.8858; 12.0145; 14.3049
89.442; 76.043; 85.25		1643.12Li, Yan-Ping; Hu, Kun; Yang, Xing-Wei; Xu, Gang
Antibacterial Dimeric Acylphloroglucinols from Hypericum japonicum.
Journal of natural products, 2018, 81, 1098-1102
1553357 CIFC10 H8 N O3P -16.7548; 7.6045; 8.7945
109.953; 90.989; 98.977		418.22Ghate, Nikhil B.; Chaudhuri, Dipankar; Panja, Sourav; Singh, Sudhir S.; Gupta, Gajendra; Lee, Chang Yeon; Mandal, Nripendranath
In Vitro Mechanistic Study of the Anti-inflammatory Activity of a Quinoline Isolated from Spondias pinnata Bark.
Journal of natural products, 2018, 81, 1956-1961
1553358 CIFC15 H19 Cl N2 O6P 21 21 217.1002; 12.6795; 18.118
90; 90; 90		1631.1Fitch, Richard W.; Snider, Barry B.; Zhou, Quan; Foxman, Bruce M.; Pandya, Anshul A.; Yakel, Jerrel L.; Olson, Thao T.; Al-Muhtasib, Nour; Xiao, Yingxian; Welch, Kevin D.; Panter, Kip E.
Absolute Configuration and Pharmacology of the Poison Frog Alkaloid Phantasmidine.
Journal of natural products, 2018, 81, 1029-1035
1553359 CIFC20 H20 O7P 1 21 18.3572; 11.9056; 9.5276
90; 110.117; 90		890.14Ren, Fengxia; Chen, Shenxi; Zhang, Yang; Zhu, Shuaiming; Xiao, Junhai; Liu, Xingzhong; Su, Ruibin; Che, Yongsheng
Hawaiienols A-D, Highly Oxygenated p-Terphenyls from an Insect-Associated Fungus, Paraconiothyrium hawaiiense.
Journal of natural products, 2018, 81, 1752-1759
1553360 CIFC24 H39 N O7P 18.054; 12.548; 14.0945
115.86; 94.702; 102.435		1226.37Wang, Wenjing; Gong, Jiaojiao; Liu, Xiaorui; Dai, Chong; Wang, Yanyan; Li, Xiao-Nian; Wang, Jianping; Luo, Zengwei; Zhou, Yuan; Xue, Yongbo; Zhu, Hucheng; Chen, Chunmei; Zhang, Yonghui
Cytochalasans Produced by the Coculture of Aspergillus flavipes and Chaetomium globosum.
Journal of natural products, 2018, 81, 1578-1587
1553361 CIFC17 H18 O4P 21 21 217.4196; 10.8293; 17.811
90; 90; 90		1431.1Shi, Zhen-Zhen; Miao, Feng-Ping; Fang, Sheng-Tao; Yin, Xiu-Li; Ji, Nai-Yun
Trichorenins A-C, Algicidal Tetracyclic Metabolites from the Marine-Alga-Epiphytic Fungus Trichoderma virens Y13-3.
Journal of natural products, 2018, 81, 1121-1124
1553362 CIFC20 H28 N2 O5P 1 21 18.2777; 11.3247; 10.202
90; 94.708; 90		953.13Yeap, Joanne Soon-Yee; Navanesan, Suerialoasan; Sim, Kae-Shin; Yong, Kien-Thai; Gurusamy, Subramaniam; Lim, Siew-Huah; Low, Yun-Yee; Kam, Toh-Seok
Ajmaline, Oxindole, and Cytotoxic Macroline-Akuammiline Bisindole Alkaloids from Alstonia penangiana.
Journal of natural products, 2018, 81, 1266-1277
1553363 CIFC45 H56 Cl6 N4 O5P 1 21 19.4917; 12.8453; 18.5275
90; 99.113; 90		2230.4Yeap, Joanne Soon-Yee; Navanesan, Suerialoasan; Sim, Kae-Shin; Yong, Kien-Thai; Gurusamy, Subramaniam; Lim, Siew-Huah; Low, Yun-Yee; Kam, Toh-Seok
Ajmaline, Oxindole, and Cytotoxic Macroline-Akuammiline Bisindole Alkaloids from Alstonia penangiana.
Journal of natural products, 2018, 81, 1266-1277
1553364 CIFC37 H54 O12P 21 21 2112.5134; 15.207; 20.2912
90; 90; 90		3861.24Ye, Ye; Dawa, Drolma; Liu, Guang-Hui; Zhao, Min; Tseden, Dorje; Gu, Yu-Cheng; Ding, Li-Sheng; Cao, Zhi-Xing; Zhou, Yan
Antiproliferative Sesquiterpenoids from Ligularia rumicifolia with Diverse Skeletons.
Journal of natural products, 2018, 81, 1992-2003
1553365 CIFC30 H45 O5P 1 21 17.2485; 11.0572; 17.0554
90; 99.689; 90		1347.46Bai, Wei; Yang, Hong-Ying; Jiao, Xing-Zhi; Feng, Ke-Na; Chen, Jian-Jun; Gao, Kun
Structurally Diverse Highly Oxygenated Triterpenoids from the Roots of Ailanthus altissima and Their Cytotoxicity.
Journal of natural products, 2018, 81, 1777-1785
1553366 CIFC17 H14 O7P 1 21/n 19.176; 8.194; 19.269
90; 93.524; 90		1446.1Olivon, Florent; Nothias, Louis-Félix; Dumontet, Vincent; Retailleau, Pascal; Berger, Sylvie; Ferry, Gilles; Cohen, William; Pfeiffer, Bruno; Boutin, Jean A.; Scalbert, Elisabeth; Roussi, Fanny; Litaudon, Marc
Natural Inhibitors of the RhoA-p115 Complex from the Bark of Meiogyne baillonii.
Journal of natural products, 2018, 81, 1610-1618
1553371 CIFC17.5 H24 O3.5P 21 21 2110.272; 16.583; 18.9486
90; 90; 90		3227.72Huang, Guang-Hui; Hu, Zhu; Lei, Chun; Wang, Pei-Pei; Yang, Jing; Li, Jing-Ya; Li, Jia; Hou, Ai-Jun
Enantiomeric Pairs of Meroterpenoids with Diverse Heterocyclic Systems from Rhododendron nyingchiense.
Journal of natural products, 2018, 81, 1810-1818
1553372 CIFC17 H22 O2C 1 2 129.658; 6.8498; 7.4333
90; 104.45; 90		1462.31Huang, Guang-Hui; Hu, Zhu; Lei, Chun; Wang, Pei-Pei; Yang, Jing; Li, Jing-Ya; Li, Jia; Hou, Ai-Jun
Enantiomeric Pairs of Meroterpenoids with Diverse Heterocyclic Systems from Rhododendron nyingchiense.
Journal of natural products, 2018, 81, 1810-1818
1553373 CIFC17 H22 O2P 21 21 216.0879; 8.0119; 29.617
90; 90; 90		1444.59Huang, Guang-Hui; Hu, Zhu; Lei, Chun; Wang, Pei-Pei; Yang, Jing; Li, Jing-Ya; Li, Jia; Hou, Ai-Jun
Enantiomeric Pairs of Meroterpenoids with Diverse Heterocyclic Systems from Rhododendron nyingchiense.
Journal of natural products, 2018, 81, 1810-1818
1553374 CIFC17 H24 O5P 21 21 219.3465; 9.3699; 18.6281
90; 90; 90		1631.37Huang, Guang-Hui; Hu, Zhu; Lei, Chun; Wang, Pei-Pei; Yang, Jing; Li, Jing-Ya; Li, Jia; Hou, Ai-Jun
Enantiomeric Pairs of Meroterpenoids with Diverse Heterocyclic Systems from Rhododendron nyingchiense.
Journal of natural products, 2018, 81, 1810-1818
1553375 CIFC18 H26 O3P 21 21 2110.1815; 10.1849; 15.7912
90; 90; 90		1637.51Huang, Guang-Hui; Hu, Zhu; Lei, Chun; Wang, Pei-Pei; Yang, Jing; Li, Jing-Ya; Li, Jia; Hou, Ai-Jun
Enantiomeric Pairs of Meroterpenoids with Diverse Heterocyclic Systems from Rhododendron nyingchiense.
Journal of natural products, 2018, 81, 1810-1818
1553376 CIFC21 H32 O3P 16.2785; 10.5538; 14.393
100.197; 100.924; 91.722		919.64Zhang, Shasha; Wang, Xia; Hao, Jin; Li, Dangdang; Csuk, René; Li, Shengkun
Expediently Scalable Synthesis and Antifungal Exploration of (+)-Yahazunol and Related Meroterpenoids.
Journal of natural products, 2018, 81, 2010-2017
1553377 CIFC20 H16 N2 O3C 1 c 125.67; 7.0317; 17.015
90; 103.786; 90		2982.8Liu, Ye; Yu, Heng-Yi; Xu, Hong-Zhe; Liu, Jun-Jun; Meng, Xiang-Gao; Zhou, Ming; Ruan, Han-Li
Alkaloids with Immunosuppressive Activity from the Bark of Pausinystalia yohimbe.
Journal of natural products, 2018, 81, 1841-1849
1553378 CIFC20 H18 N2 O4P 1 21/n 110.596; 19.264; 16.921
90; 106.312; 90		3314.9Liu, Ye; Yu, Heng-Yi; Xu, Hong-Zhe; Liu, Jun-Jun; Meng, Xiang-Gao; Zhou, Ming; Ruan, Han-Li
Alkaloids with Immunosuppressive Activity from the Bark of Pausinystalia yohimbe.
Journal of natural products, 2018, 81, 1841-1849
1553379 CIFC29 H35 N O3P b c a12.9258; 18.5966; 20.6239
90; 90; 90		4957.49Ma, Xiao-Li; Li, Jun; Zheng, Jiao; Gu, Xiao-Pan; Ferreira, Daneel; Zjawiony, Jordan K.; Zhao, Ming-Bo; Guo, Xiao-Yu; Tu, Peng-Fei; Jiang, Yong
LC-MS-Guided Isolation of Insulin-Secretion-Promoting Monoterpenoid Carbazole Alkaloids from Murraya microphylla.
Journal of natural products, 2018, 81, 2371-2380
1553380 CIFC29 H35 N O3P 1 21 17.72842; 10.28179; 15.3023
90; 91.9454; 90		1215.25Ma, Xiao-Li; Li, Jun; Zheng, Jiao; Gu, Xiao-Pan; Ferreira, Daneel; Zjawiony, Jordan K.; Zhao, Ming-Bo; Guo, Xiao-Yu; Tu, Peng-Fei; Jiang, Yong
LC-MS-Guided Isolation of Insulin-Secretion-Promoting Monoterpenoid Carbazole Alkaloids from Murraya microphylla.
Journal of natural products, 2018, 81, 2371-2380
1553381 CIFC15 H18 O6P 1 21 15.6966; 5.6223; 22.2355
90; 95.895; 90		708.39Pang, Xiaoyan; Lin, Xiuping; Yang, Jie; Zhou, Xuefeng; Yang, Bin; Wang, Junfeng; Liu, Yonghong
Spiro-Phthalides and Isocoumarins Isolated from the Marine-Sponge-Derived Fungus Setosphaeria sp. SCSIO41009.
Journal of natural products, 2018, 81, 1860-1868
1553382 CIFC16 H20 O7P 21 21 217.73476; 8.02415; 25.5244
90; 90; 90		1584.17Pang, Xiaoyan; Lin, Xiuping; Yang, Jie; Zhou, Xuefeng; Yang, Bin; Wang, Junfeng; Liu, Yonghong
Spiro-Phthalides and Isocoumarins Isolated from the Marine-Sponge-Derived Fungus Setosphaeria sp. SCSIO41009.
Journal of natural products, 2018, 81, 1860-1868
1553383 CIFC11 H14 O5P 1 21/n 14.2311; 13.8888; 18.56
90; 91.894; 90		1090.1Pang, Xiaoyan; Lin, Xiuping; Yang, Jie; Zhou, Xuefeng; Yang, Bin; Wang, Junfeng; Liu, Yonghong
Spiro-Phthalides and Isocoumarins Isolated from the Marine-Sponge-Derived Fungus Setosphaeria sp. SCSIO41009.
Journal of natural products, 2018, 81, 1860-1868
1553384 CIFC20 H32 O5P 1 21 111.0078; 6.8749; 12.6547
90; 98.677; 90		946.72Wei, Wen-Jun; Song, Qiu-Yan; Zheng, Zai-Qin; Yao, Xiaojun; Li, Ya; Gao, Kun
Phytotoxic ent-Isopimarane-Type Diterpenoids from Euphorbia hylonoma.
Journal of natural products, 2018, 81, 2381-2391
1553385 CIFC18 H26 O6P 21 21 216.7154; 15.1719; 17.1256
90; 90; 90		1744.8Xiong, Juan; Wang, Li-Jun; Qian, Jianchang; Wang, Pei-Pei; Wang, Xue-Jiao; Ma, Guang-Lei; Zeng, Huaqiang; Li, Jia; Hu, Jin-Feng
Structurally Diverse Sesquiterpenoids from the Endangered Ornamental Plant Michelia shiluensis.
Journal of natural products, 2018, 81, 2195-2204
1553386 CIFC18 H26 O7P 1 21 110.7912; 7.2246; 11.6007
90; 96.97; 90		897.73Xiong, Juan; Wang, Li-Jun; Qian, Jianchang; Wang, Pei-Pei; Wang, Xue-Jiao; Ma, Guang-Lei; Zeng, Huaqiang; Li, Jia; Hu, Jin-Feng
Structurally Diverse Sesquiterpenoids from the Endangered Ornamental Plant Michelia shiluensis.
Journal of natural products, 2018, 81, 2195-2204
1553387 CIFC19 H26 O7P 1 21 18.9106; 10.0011; 11.0207
90; 110.689; 90		918.78Xiong, Juan; Wang, Li-Jun; Qian, Jianchang; Wang, Pei-Pei; Wang, Xue-Jiao; Ma, Guang-Lei; Zeng, Huaqiang; Li, Jia; Hu, Jin-Feng
Structurally Diverse Sesquiterpenoids from the Endangered Ornamental Plant Michelia shiluensis.
Journal of natural products, 2018, 81, 2195-2204
1553388 CIFC19 H23 O6.5P 21 21 218.32583; 13.41861; 29.848
90; 90; 90		3334.65Huang, Hongbo; Song, Yongxiang; Li, Xin; Wang, Xin; Ling, Chunyao; Qin, Xiangjing; Zhou, Zhenbin; Li, Qinglian; Wei, Xiaoyi; Ju, Jianhua
Abyssomicin Monomers and Dimers from the Marine-Derived Streptomyces koyangensis SCSIO 5802.
Journal of natural products, 2018, 81, 1892-1898
1553389 CIFC19 H24 O7P 21 21 216.6414; 14.9068; 17.8924
90; 90; 90		1771.38Huang, Hongbo; Song, Yongxiang; Li, Xin; Wang, Xin; Ling, Chunyao; Qin, Xiangjing; Zhou, Zhenbin; Li, Qinglian; Wei, Xiaoyi; Ju, Jianhua
Abyssomicin Monomers and Dimers from the Marine-Derived Streptomyces koyangensis SCSIO 5802.
Journal of natural products, 2018, 81, 1892-1898
1553390 CIFC38 H50 O14 SP 6213.403; 13.403; 17.8604
90; 90; 120		2778.6Huang, Hongbo; Song, Yongxiang; Li, Xin; Wang, Xin; Ling, Chunyao; Qin, Xiangjing; Zhou, Zhenbin; Li, Qinglian; Wei, Xiaoyi; Ju, Jianhua
Abyssomicin Monomers and Dimers from the Marine-Derived Streptomyces koyangensis SCSIO 5802.
Journal of natural products, 2018, 81, 1892-1898
1553391 CIFC20 H32 O2C 1 2 136.457; 4.886; 20.2686
90; 105.385; 90		3481Raghavan, Vijay; Johnson, Jordan L.; Stec, Donald F.; Song, Bongkeun; Zajac, Grzegorz; Baranska, Malgorzata; Harris, Constance M.; Schley, Nathan D.; Polavarapu, Prasad L.; Harris, Thomas M.
Absolute Configurations of Naturally Occurring [5]- and [3]-Ladderanoic Acids: Isolation, Chiroptical Spectroscopy, and Crystallography.
Journal of natural products, 2018, 81, 2654-2666
1553392 CIFC20 H30 O2C 1 2 164.164; 4.8171; 10.9786
90; 90.556; 90		3393.2Raghavan, Vijay; Johnson, Jordan L.; Stec, Donald F.; Song, Bongkeun; Zajac, Grzegorz; Baranska, Malgorzata; Harris, Constance M.; Schley, Nathan D.; Polavarapu, Prasad L.; Harris, Thomas M.
Absolute Configurations of Naturally Occurring [5]- and [3]-Ladderanoic Acids: Isolation, Chiroptical Spectroscopy, and Crystallography.
Journal of natural products, 2018, 81, 2654-2666
1553393 CIFC28 H36 O3P 1 21 15.3774; 14.7492; 43.061
90; 90.817; 90		3414.9Raghavan, Vijay; Johnson, Jordan L.; Stec, Donald F.; Song, Bongkeun; Zajac, Grzegorz; Baranska, Malgorzata; Harris, Constance M.; Schley, Nathan D.; Polavarapu, Prasad L.; Harris, Thomas M.
Absolute Configurations of Naturally Occurring [5]- and [3]-Ladderanoic Acids: Isolation, Chiroptical Spectroscopy, and Crystallography.
Journal of natural products, 2018, 81, 2654-2666
1553394 CIFC26.5 H50 O11.5P 1 21 16.3352; 39.6779; 11.4316
90; 90.621; 90		2873.4Sun, Na; Zhu, Yan; Zhou, Haofeng; Zhou, Junfei; Zhang, Hanqi; Zhang, Mengke; Zeng, Hong; Yao, Guangmin
Grayanane Diterpenoid Glucosides from the Leaves of Rhododendron micranthum and Their Bioactivities Evaluation.
Journal of natural products, 2018, 81, 2673-2681
1553395 CIFC27 H46 O9P 21 21 216.9345; 13.2666; 28.7946
90; 90; 90		2649.02Sun, Na; Zhu, Yan; Zhou, Haofeng; Zhou, Junfei; Zhang, Hanqi; Zhang, Mengke; Zeng, Hong; Yao, Guangmin
Grayanane Diterpenoid Glucosides from the Leaves of Rhododendron micranthum and Their Bioactivities Evaluation.
Journal of natural products, 2018, 81, 2673-2681
1553396 CIFC26 H44 O10P 1 21 112.2958; 6.6149; 15.8066
90; 92.789; 90		1284.11Sun, Na; Zhu, Yan; Zhou, Haofeng; Zhou, Junfei; Zhang, Hanqi; Zhang, Mengke; Zeng, Hong; Yao, Guangmin
Grayanane Diterpenoid Glucosides from the Leaves of Rhododendron micranthum and Their Bioactivities Evaluation.
Journal of natural products, 2018, 81, 2673-2681
1553397 CIFC30 H42 O4P 21 21 219.209; 14.6102; 18.3937
90; 90; 90		2474.79Tabefam, Marzieh; Moridi Farimani, Mahdi; Danton, Ombeline; Ramseyer, Justine; Nejad Ebrahimi, Samad; Neuburger, Markus; Kaiser, Marcel; Salehi, Peyman; Potterat, Olivier; Hamburger, Matthias
Antiprotozoal Isoprenoids from Salvia hydrangea.
Journal of natural products, 2018, 81, 2682-2691
1553398 CIFC36 H48 O9P 1 21 114.1355; 18.3034; 20.5777
90; 97.024; 90		5284.1Kúsz, Norbert; Orvos, Péter; Bereczki, Laura; Fertey, Pierre; Bombicz, Petra; Csorba, Attila; Tálosi, László; Jakab, Gusztáv; Hohmann, Judit; Rédei, Dóra
Diterpenoids from Euphorbia dulcis with Potassium Ion Channel Inhibitory Activity with Selective G Protein-Activated Inwardly Rectifying Ion Channel (GIRK) Blocking Effect.
Journal of natural products, 2018, 81, 2483-2492
1553399 CIFC25 H28 O9P 32 2 111.686; 11.686; 29.8596
90; 90; 120		3531.4Arunrattiyakorn, Panarat; Kuno, Mayuso; Aree, Thammarat; Laphookhieo, Surat; Sriyatep, Teerayut; Kanzaki, Hiroshi; Garcia Chavez, Miguel Angel; Wang, Yan Alexander; Andersen, Raymond J.
Biotransformation of β-Mangostin by an Endophytic Fungus of Garcinia mangostana to Furnish Xanthenes with an Unprecedented Heterocyclic Skeleton.
Journal of natural products, 2018, 81, 2244-2250
1553400 CIFC25 H28 O9P 31 2 111.6878; 11.6878; 29.8747
90; 90; 120		3534.27Arunrattiyakorn, Panarat; Kuno, Mayuso; Aree, Thammarat; Laphookhieo, Surat; Sriyatep, Teerayut; Kanzaki, Hiroshi; Garcia Chavez, Miguel Angel; Wang, Yan Alexander; Andersen, Raymond J.
Biotransformation of β-Mangostin by an Endophytic Fungus of Garcinia mangostana to Furnish Xanthenes with an Unprecedented Heterocyclic Skeleton.
Journal of natural products, 2018, 81, 2244-2250
1553401 CIFC25 H28 O9C 1 2/c 122.1574; 10.8642; 21.0512
90; 115.067; 90		4590.2Arunrattiyakorn, Panarat; Kuno, Mayuso; Aree, Thammarat; Laphookhieo, Surat; Sriyatep, Teerayut; Kanzaki, Hiroshi; Garcia Chavez, Miguel Angel; Wang, Yan Alexander; Andersen, Raymond J.
Biotransformation of β-Mangostin by an Endophytic Fungus of Garcinia mangostana to Furnish Xanthenes with an Unprecedented Heterocyclic Skeleton.
Journal of natural products, 2018, 81, 2244-2250
1553655 CIFC72 H84 N12R -3 :H24.741; 24.741; 19.826
90; 90; 120		10510Slater, A. G.; Little, M. A.; Briggs, M. E.; Jelfs, K. E.; Cooper, A. I.
A solution-processable dissymmetric porous organic cage
Molecular Systems Design & Engineering, 2018, 3, 223
1553656 CIFC73.1 H89.96 Cl1.55 N12 O1.89R -3 :H24.483; 24.483; 19.6123
90; 90; 120		10181Slater, A. G.; Little, M. A.; Briggs, M. E.; Jelfs, K. E.; Cooper, A. I.
A solution-processable dissymmetric porous organic cage
Molecular Systems Design & Engineering, 2018, 3, 223
1553657 CIFC4 H18 N2 O22 Se6 V3P -110.0027; 10.4765; 12.2924
74.478; 72.643; 79.707		1177.8Xu, Rosalind J.; Olshansky, Jacob H.; Adler, Philip D. F.; Huang, Yongjia; Smith, Matthew D.; Zeller, Matthias; Schrier, Joshua; Norquist, Alexander J.
Understanding structural adaptability: a reactant informatics approach to experiment design
Molecular Systems Design & Engineering, 2018, 3, 473
1553658 CIFC4 H12 N2 O10 Se2 V2P 1 21/c 110.0879; 6.2047; 10.6765
90; 116.566; 90		597.71Xu, Rosalind J.; Olshansky, Jacob H.; Adler, Philip D. F.; Huang, Yongjia; Smith, Matthew D.; Zeller, Matthias; Schrier, Joshua; Norquist, Alexander J.
Understanding structural adaptability: a reactant informatics approach to experiment design
Molecular Systems Design & Engineering, 2018, 3, 473
1553659 CIFC8 H44 N4 O48 Se12 V6C 1 2/c 118.816; 7.934; 34.439
90; 95.85; 90		5114Xu, Rosalind J.; Olshansky, Jacob H.; Adler, Philip D. F.; Huang, Yongjia; Smith, Matthew D.; Zeller, Matthias; Schrier, Joshua; Norquist, Alexander J.
Understanding structural adaptability: a reactant informatics approach to experiment design
Molecular Systems Design & Engineering, 2018, 3, 473
1553660 CIFC8 H58.67 N6 O65.33 Se16 V8P 1 21/c 117.999; 15.658; 26.0344
90; 113.803; 90		6713.1Xu, Rosalind J.; Olshansky, Jacob H.; Adler, Philip D. F.; Huang, Yongjia; Smith, Matthew D.; Zeller, Matthias; Schrier, Joshua; Norquist, Alexander J.
Understanding structural adaptability: a reactant informatics approach to experiment design
Molecular Systems Design & Engineering, 2018, 3, 473
1553661 CIFC8 H43 N4 O47 Se12 V6P 1 21/c 124.713; 7.9212; 34.399
90; 130.376; 90		5129.9Xu, Rosalind J.; Olshansky, Jacob H.; Adler, Philip D. F.; Huang, Yongjia; Smith, Matthew D.; Zeller, Matthias; Schrier, Joshua; Norquist, Alexander J.
Understanding structural adaptability: a reactant informatics approach to experiment design
Molecular Systems Design & Engineering, 2018, 3, 473
1553696 CIFC42 H28 Cu2 N10 O8P -4 3 n27.6887; 27.6887; 27.6887
90; 90; 90		21227.9Tan, Jing; Zhou, Beibei; Liang, Congcong; Zinky, Hannah; Zhou, Hao-Long; Zhang, Yue-Biao
Secondary-amine-functionalized isoreticular metal‒organic frameworks for controllable and selective dye capture
Materials Chemistry Frontiers, 2018, 2, 129
1553697 CIFC42 H28 N10 O8 Zn2P -4 3 n28.1049; 28.1049; 28.1049
90; 90; 90		22199.7Tan, Jing; Zhou, Beibei; Liang, Congcong; Zinky, Hannah; Zhou, Hao-Long; Zhang, Yue-Biao
Secondary-amine-functionalized isoreticular metal‒organic frameworks for controllable and selective dye capture
Materials Chemistry Frontiers, 2018, 2, 129
1553698 CIFC22 H16 N2 OP -18.7512; 8.8377; 11.1832
90.101; 91.344; 106.984		826.93Zheng, Chao; Zang, Qiguang; Nie, Han; Huang, Weitao; Zhao, Zujin; Qin, Anjun; Hu, Rongrong; Tang, Ben Zhong
Fluorescence visualization of crystal formation and transformation processes of organic luminogens with crystallization-induced emission characteristics
Materials Chemistry Frontiers, 2018, 2, 180
1553699 CIFC22 H16 N2 OP 1 21/c 110.8856; 5.8214; 26.159
90; 95.577; 90		1649.8Zheng, Chao; Zang, Qiguang; Nie, Han; Huang, Weitao; Zhao, Zujin; Qin, Anjun; Hu, Rongrong; Tang, Ben Zhong
Fluorescence visualization of crystal formation and transformation processes of organic luminogens with crystallization-induced emission characteristics
Materials Chemistry Frontiers, 2018, 2, 180
1553700 CIFC22 H16 N2 OP -19.2692; 9.9355; 10.8222
79.332; 65.483; 69.001		845.8Zheng, Chao; Zang, Qiguang; Nie, Han; Huang, Weitao; Zhao, Zujin; Qin, Anjun; Hu, Rongrong; Tang, Ben Zhong
Fluorescence visualization of crystal formation and transformation processes of organic luminogens with crystallization-induced emission characteristics
Materials Chemistry Frontiers, 2018, 2, 180
1553701 CIFC39 H50 N2 O S4P -17.622; 14.074; 18.644
108.82; 99.259; 95.596		1844.3Hashikawa, Yoshifumi; Yasui, Hidefumi; Kurotobi, Kei; Murata, Yasujiro
Synthesis and properties of open-cage fullerene C60 derivatives: impact of the extended π-conjugation
Materials Chemistry Frontiers, 2018, 2, 206
1553702 CIFC26 H34 B20P -17.1876; 10.559; 10.841
77.421; 88.462; 76.313		779.9Mori, Hiroki; Nishino, Kenta; Wada, Keisuke; Morisaki, Yasuhiro; Tanaka, Kazuo; Chujo, Yoshiki
Modulation of luminescence chromic behaviors and environment-responsive intensity changes by substituents in bis-o-carborane-substituted conjugated molecules
Materials Chemistry Frontiers, 2018, 2, 573
1553703 CIFC28 H34 O4 Si2P 1 21/c 18.3944; 14.3259; 11.7204
90; 90.646; 90		1409.4Shimizu, Masaki; Kinoshita, Takumi; Shigitani, Ryosuke; Miyake, Yusuke; Tajima, Kunihiko
Use of silylmethoxy groups as inducers of efficient room temperature phosphorescence from precious-metal-free organic luminophores
Materials Chemistry Frontiers, 2018, 2, 347
1553704 CIFC48 H42 O4 Si2P 1 21/c 111.7637; 12.6947; 13.4413
90; 92.205; 90		2005.8Shimizu, Masaki; Kinoshita, Takumi; Shigitani, Ryosuke; Miyake, Yusuke; Tajima, Kunihiko
Use of silylmethoxy groups as inducers of efficient room temperature phosphorescence from precious-metal-free organic luminophores
Materials Chemistry Frontiers, 2018, 2, 347
1553705 CIFC34 H46 O4 Si2P -18.0255; 15.7261; 15.9887
111.511; 104.2; 100.188		1738.5Shimizu, Masaki; Kinoshita, Takumi; Shigitani, Ryosuke; Miyake, Yusuke; Tajima, Kunihiko
Use of silylmethoxy groups as inducers of efficient room temperature phosphorescence from precious-metal-free organic luminophores
Materials Chemistry Frontiers, 2018, 2, 347
1553706 CIFC76 H48 Cl20 N4 O18 Ru4P -110.295; 15.211; 15.71
97.505; 103.952; 98.491		2325.7Kosaka, Wataru; Itoh, Masahisa; Miyasaka, Hitoshi
Metamagnetism with TN = 97 K in a layered assembly of paddlewheel [Ru2] units and TCNQ: an empirical rule for interlayer distances determining the magnetic ground state
Materials Chemistry Frontiers, 2018, 2, 497
1553707 CIFC72 H60 O12P -113.2528; 16.273; 18.7976
100.659; 93.188; 98.3918		3927.09Hisaki, Ichiro; Ikenaka, Nobuaki; Tsuzuki, Seiji; Tohnai, Norimitsu
Sterically crowded hydrogen-bonded hexagonal network frameworks
Materials Chemistry Frontiers, 2018, 2, 338
1553708 CIFC72 H60 O12P -114.593; 15.3214; 20.375
102.97; 102.468; 97.238		4261.2Hisaki, Ichiro; Ikenaka, Nobuaki; Tsuzuki, Seiji; Tohnai, Norimitsu
Sterically crowded hydrogen-bonded hexagonal network frameworks
Materials Chemistry Frontiers, 2018, 2, 338
1553709 CIFC60 H24 F12 O12I 1 2/a 112.2591; 38.9347; 18.0305
90; 93.869; 90		8586.4Hisaki, Ichiro; Ikenaka, Nobuaki; Tsuzuki, Seiji; Tohnai, Norimitsu
Sterically crowded hydrogen-bonded hexagonal network frameworks
Materials Chemistry Frontiers, 2018, 2, 338
1553710 CIFC80 H68 O14I 1 2/a 127.8455; 22.4501; 29.8331
90; 95.3352; 90		18568.9Hisaki, Ichiro; Ikenaka, Nobuaki; Tsuzuki, Seiji; Tohnai, Norimitsu
Sterically crowded hydrogen-bonded hexagonal network frameworks
Materials Chemistry Frontiers, 2018, 2, 338
1553711 CIFC63 H55 N6P 1 21/n 114.2255; 29.98; 22.944
90; 92.5721; 90		9775Sakamaki, Daisuke; Saeki, Hidenori; Seki, Shu
Synthesis and properties of a twin donor molecule composed of cofacially stacked dihydrodiazapentacenes
Materials Chemistry Frontiers, 2018, 2, 530
1553712 CIFC63 H58 F6 N6 O SbP 1 21/n 115.927; 13.626; 25.437
90; 106.335; 90		5297.5Sakamaki, Daisuke; Saeki, Hidenori; Seki, Shu
Synthesis and properties of a twin donor molecule composed of cofacially stacked dihydrodiazapentacenes
Materials Chemistry Frontiers, 2018, 2, 530
1553713 CIFC19 H20 I N2 O2P 1 21/c 18.9246; 26.061; 15.999
90; 103.344; 90		3620.6Suzuki, Shuichi; Nakamura, Fumiya; Naota, Takeshi
A direct synthetic method for (nitronyl nitroxide)-substituted π-electronic compounds via a palladium-catalyzed cross-coupling reaction with a zinc complex
Materials Chemistry Frontiers, 2018, 2, 591
1553714 CIFC25 H24 N3 O2 SP -18.9325; 9.7653; 13.1883
81.1923; 77.908; 74.017		1075.8Suzuki, Shuichi; Nakamura, Fumiya; Naota, Takeshi
A direct synthetic method for (nitronyl nitroxide)-substituted π-electronic compounds via a palladium-catalyzed cross-coupling reaction with a zinc complex
Materials Chemistry Frontiers, 2018, 2, 591
1553715 CIFC24 H16 Cl O6 S12C 1 2/c 133.29; 7.227; 13.232
90; 105.227; 90		3072Ueda, Akira; Mori, Hatsumi
A phenol-fused tetrathiafulvalene: modulation of hydrogen-bond patterns and electrical conductivity in the charge-transfer salt
Materials Chemistry Frontiers, 2018, 2, 566
1553716 CIFC12 H8 O S6P 1 21/c 112.369; 11.196; 10.011
90; 92.537; 90		1385Ueda, Akira; Mori, Hatsumi
A phenol-fused tetrathiafulvalene: modulation of hydrogen-bond patterns and electrical conductivity in the charge-transfer salt
Materials Chemistry Frontiers, 2018, 2, 566
1553717 CIFC13 H7P -4 c 214.367; 14.367; 7.992
90; 90; 90		1649.6Xu, Jinjia; Takai, Atsuro; Bannaron, Alisa; Nakagawa, Takafumi; Matsuo, Yutaka; Sugimoto, Manabu; Matsushita, Yoshitaka; Takeuchi, Masayuki
A helically-twisted ladder based on 9,9′-bifluorenylidene: synthesis, characterization, and carrier-transport properties
Materials Chemistry Frontiers, 2018, 2, 780
1553718 CIFC64 H36 Cl4P 1 21/n 118.181; 12.65; 19.801
90; 96.169; 90		4527.7Xu, Jinjia; Takai, Atsuro; Bannaron, Alisa; Nakagawa, Takafumi; Matsuo, Yutaka; Sugimoto, Manabu; Matsushita, Yoshitaka; Takeuchi, Masayuki
A helically-twisted ladder based on 9,9′-bifluorenylidene: synthesis, characterization, and carrier-transport properties
Materials Chemistry Frontiers, 2018, 2, 780
1553719 CIFC61 H62 Cl2 Ge O12 S4P -19.768; 11.2196; 25.3543
88.261; 82.947; 86.248		2751Furukawa, Shunsuke; Hayashi, Keisuke; Yamagishi, Ken; Saito, Masaichi
Synthesis and properties of spiro-type heterasumanenes containing group 14 elements as bridging atoms
Materials Chemistry Frontiers, 2018, 2, 929
1553720 CIFC60 H60 O12 S4 SiP -19.7198; 13.551; 21.616
104.724; 100.877; 95.266		2674.7Furukawa, Shunsuke; Hayashi, Keisuke; Yamagishi, Ken; Saito, Masaichi
Synthesis and properties of spiro-type heterasumanenes containing group 14 elements as bridging atoms
Materials Chemistry Frontiers, 2018, 2, 929
1553721 CIFC61 H62 Cl2 O12 S4 SnP 1 21/n 19.2728; 21.8232; 27.505
90; 97.123; 90		5523Furukawa, Shunsuke; Hayashi, Keisuke; Yamagishi, Ken; Saito, Masaichi
Synthesis and properties of spiro-type heterasumanenes containing group 14 elements as bridging atoms
Materials Chemistry Frontiers, 2018, 2, 929
1553722 CIFC14 H15 N O4P -15.0788; 10.061; 12.9069
76.261; 80.914; 81.176		627.97Cui, Rong Rong; Lv, Yuan Chao; Zhao, Yong Sheng; Zhao, Na; Li, Nan
Solid-state fluorescent materials based on coumarin derivatives: polymorphism, stimuli-responsive emission, self-assembly and optical waveguides
Materials Chemistry Frontiers, 2018, 2, 910
1553723 CIFC60 H56 O10P 1 21/c 19.1235; 60.8969; 8.8517
90; 93.03; 90		4911.07Nabeya, Kota; Muraoka, Takahiro; Hoshino, Norihisa; Aizawa, Miho; Kajitani, Takashi; Akutagawa, Tomoyuki; Shishido, Atsushi; Fukushima, Takanori; Kinbara, Kazushi
Thermal and optical properties of multiblock macrocycles with hysteretic polymorphic transition
Materials Chemistry Frontiers, 2018, 2, 969
1553856 CIFC81 H82 O10P -112.0438; 14.5042; 22.049
72.623; 76.291; 77.888		3530.8Al-Azemi, Talal F.; Mohamod, Abdirahman A.; Vinodh, Mickey; Alipour, Fatemeh H.
A new approach for the synthesis of mono- and A1/A2-dihydroxy-substituted pillar[5]arenes and their complexation with alkyl alcohols in solution and in the solid state
Organic Chemistry Frontiers, 2018, 5, 10
1553857 CIFC44 H48 O12P 1 21/n 112.791; 20.978; 14.779
90; 98.582; 90		3921Al-Azemi, Talal F.; Mohamod, Abdirahman A.; Vinodh, Mickey; Alipour, Fatemeh H.
A new approach for the synthesis of mono- and A1/A2-dihydroxy-substituted pillar[5]arenes and their complexation with alkyl alcohols in solution and in the solid state
Organic Chemistry Frontiers, 2018, 5, 10
1553858 CIFC90 H125 N3 O10P -113.633; 15.357; 20.965
91.591; 94.087; 111.251		4073.6Al-Azemi, Talal F.; Mohamod, Abdirahman A.; Vinodh, Mickey; Alipour, Fatemeh H.
A new approach for the synthesis of mono- and A1/A2-dihydroxy-substituted pillar[5]arenes and their complexation with alkyl alcohols in solution and in the solid state
Organic Chemistry Frontiers, 2018, 5, 10
1553859 CIFC42 H46 O11P 1 21 114.289; 23.102; 20.977
90; 108.428; 90		6570Al-Azemi, Talal F.; Mohamod, Abdirahman A.; Vinodh, Mickey; Alipour, Fatemeh H.
A new approach for the synthesis of mono- and A1/A2-dihydroxy-substituted pillar[5]arenes and their complexation with alkyl alcohols in solution and in the solid state
Organic Chemistry Frontiers, 2018, 5, 10
1553860 CIFC119 H158 Cl9 O10P -114.89; 18.123; 21.671
81.371; 82.134; 87.707		5726Al-Azemi, Talal F.; Mohamod, Abdirahman A.; Vinodh, Mickey; Alipour, Fatemeh H.
A new approach for the synthesis of mono- and A1/A2-dihydroxy-substituted pillar[5]arenes and their complexation with alkyl alcohols in solution and in the solid state
Organic Chemistry Frontiers, 2018, 5, 10
1553861 CIFC110 H140 O10C 1 2/c 143.045; 21.347; 23.043
90; 104.773; 90		20474Al-Azemi, Talal F.; Mohamod, Abdirahman A.; Vinodh, Mickey; Alipour, Fatemeh H.
A new approach for the synthesis of mono- and A1/A2-dihydroxy-substituted pillar[5]arenes and their complexation with alkyl alcohols in solution and in the solid state
Organic Chemistry Frontiers, 2018, 5, 10
1553862 CIFC82 H85 O12P 1 21 116.77; 21.69; 18.89
90; 93.48; 90		6858Al-Azemi, Talal F.; Mohamod, Abdirahman A.; Vinodh, Mickey; Alipour, Fatemeh H.
A new approach for the synthesis of mono- and A1/A2-dihydroxy-substituted pillar[5]arenes and their complexation with alkyl alcohols in solution and in the solid state
Organic Chemistry Frontiers, 2018, 5, 10
1553863 CIFC75 H110 O10P -116.619; 16.686; 16.858
95.191; 117.822; 114.325		3527.9Al-Azemi, Talal F.; Mohamod, Abdirahman A.; Vinodh, Mickey; Alipour, Fatemeh H.
A new approach for the synthesis of mono- and A1/A2-dihydroxy-substituted pillar[5]arenes and their complexation with alkyl alcohols in solution and in the solid state
Organic Chemistry Frontiers, 2018, 5, 10
1553864 CIFC81 H84 O10P -112.31; 16.48; 18.98
83.427; 80.887; 69.254		3548Al-Azemi, Talal F.; Mohamod, Abdirahman A.; Vinodh, Mickey; Alipour, Fatemeh H.
A new approach for the synthesis of mono- and A1/A2-dihydroxy-substituted pillar[5]arenes and their complexation with alkyl alcohols in solution and in the solid state
Organic Chemistry Frontiers, 2018, 5, 10
1553865 CIFC82 H86 Cl2 O10P -112.2178; 15.0675; 20.9593
78.186; 85.869; 67.284		3483.6Al-Azemi, Talal F.; Mohamod, Abdirahman A.; Vinodh, Mickey; Alipour, Fatemeh H.
A new approach for the synthesis of mono- and A1/A2-dihydroxy-substituted pillar[5]arenes and their complexation with alkyl alcohols in solution and in the solid state
Organic Chemistry Frontiers, 2018, 5, 10
1553872 CIFC30 H30 I N3 O5P 21 21 2112.1518; 12.3848; 19.412
90; 90; 90		2921.5Zhu, Jing-Yan; Yang, Wu-Lin; Liu, Yang-Zi; Shang, Shao-Jing; Deng, Wei-Ping
A copper(i)-catalyzed asymmetric Mannich reaction of glycine Schiff bases with isatin-derived ketimines: enantioselective synthesis of 3-substituted 3-aminooxindoles
Organic Chemistry Frontiers, 2018, 5, 70
1553873 CIFC13 H23 N O4 SP 21 21 216.1598; 8.133; 31.1006
90; 90; 90		1558.07Wang, Zhi-Peng; Wu, Qi; Jiang, Jia; Li, Zi-Rui; Peng, Xiao-Jiao; Shao, Pan-Lin; He, Yun
Catalytic asymmetric synthesis of pyrrolidine derivatives bearing heteroatom-substituted quaternary stereocenters
Organic Chemistry Frontiers, 2018, 5, 36
1553874 CIFC21 H24 N2 O6 SP 21 21 217.9925; 13.9906; 19.0487
90; 90; 90		2130.02Wang, Zhi-Peng; Wu, Qi; Jiang, Jia; Li, Zi-Rui; Peng, Xiao-Jiao; Shao, Pan-Lin; He, Yun
Catalytic asymmetric synthesis of pyrrolidine derivatives bearing heteroatom-substituted quaternary stereocenters
Organic Chemistry Frontiers, 2018, 5, 36
1553880 CIFC10 H8 Cl N O2P 1 21/c 13.8516; 11.2844; 21.4208
90; 89.074; 90		930.89Ledovskaya, Maria S.; Rodygin, Konstantin S.; Ananikov, Valentine P.
Calcium-mediated one-pot preparation of isoxazoles with deuterium incorporation
Organic Chemistry Frontiers, 2018, 5, 226
1553883 CIFC43 H60 N2 P Sc Si2P -110.8597; 13.0923; 18.0508
75.984; 74.865; 66.722		2247.6Gao, Hongjie; Su, Jianhong; Xu, Pengfei; Xu, Xin
Scandium-catalyzed C(sp3)‒H alkylation of N,N-dimethyl anilines with alkenes
Organic Chemistry Frontiers, 2018, 5, 59
1553884 CIFC19 H20 OP 1 21/c 18.859; 21.377; 8.0979
90; 106.44; 90		1470.9Zang, Wenqing; Wei, Yin; Shi, Min
Gold(i) catalyzed cascade cyclization: intramolecular two-fold nucleophilic addition to vinylidenecyclopropanes (VDCPs)
Organic Chemistry Frontiers, 2018, 5, 197
1553885 CIFC15 H12 Cl2 O2P -16.059; 8.893; 13.346
91.59; 93.75; 108.42		679.9Dai, Jie; Ren, Wenlong; Li, Jingfu; Shi, Yian
An effective approach to aryl-substituted propanoic acids via the Pd-catalyzed hydrocarboxylation of stilbenes
Organic Chemistry Frontiers, 2018, 5, 561
1553886 CIFC18 H20 O2P -18.26; 10.221; 10.602
102.5; 107.52; 109.03		756.2Dai, Jie; Ren, Wenlong; Li, Jingfu; Shi, Yian
An effective approach to aryl-substituted propanoic acids via the Pd-catalyzed hydrocarboxylation of stilbenes
Organic Chemistry Frontiers, 2018, 5, 561
1553887 CIFC18 H17 N O3 SP 1 21/c 117.558; 9.331; 9.8891
90; 91.367; 90		1619.71Sun, Deli; Zhang, Ronghua
Transition-metal-free, visible-light-induced oxidative cross-coupling for constructing β-acetylamino acrylosulfones from sodium sulfinates and enamides
Organic Chemistry Frontiers, 2018, 5, 92
1553888 CIFC13 H15 N O3 SP 1 21/c 115.8995; 8.3725; 9.9537
90; 100.406; 90		1303.2Sun, Deli; Zhang, Ronghua
Transition-metal-free, visible-light-induced oxidative cross-coupling for constructing β-acetylamino acrylosulfones from sodium sulfinates and enamides
Organic Chemistry Frontiers, 2018, 5, 92
1553889 CIFC18 H17 Cl N2 O3 SP 1 21/n 113.2285; 9.3407; 14.9536
90; 95.087; 90		1840.4Jiang, Dong-Fang; Hu, Jie-Yu; Hao, Wen-Juan; Wang, Shu-Liang; Tu, Shu-Jiang; Jiang, Bo
Tunable Cu(i)-catalyzed site-selective dehydrogenative amination of β,γ-unsaturated hydrazones for divergent synthesis of pyrazol-4-ones and 1,6-dihydropyradazines
Organic Chemistry Frontiers, 2018, 5, 189
1553890 CIFC17 H14 Cl2 N2 O2 SP 1 21/n 111.6687; 8.7574; 17.8369
90; 96.512; 90		1810.9Jiang, Dong-Fang; Hu, Jie-Yu; Hao, Wen-Juan; Wang, Shu-Liang; Tu, Shu-Jiang; Jiang, Bo
Tunable Cu(i)-catalyzed site-selective dehydrogenative amination of β,γ-unsaturated hydrazones for divergent synthesis of pyrazol-4-ones and 1,6-dihydropyradazines
Organic Chemistry Frontiers, 2018, 5, 189
1553891 CIFC27 H35 N O1.5 PC 1 2/c 110.5217; 14.8118; 29.451
90; 94.42; 90		4576.1Wang, Huanan; Li, Shuaiqi; Wang, Baiquan; Li, Bin
The regioselective synthesis of 2-phosphinoylindoles via Rh(iii)-catalyzed C‒H activation
Organic Chemistry Frontiers, 2018, 5, 88
1553892 CIFC28 H24 N O2 PC 1 2/c 124.609; 9.508; 21.415
90; 115.972; 90		4504.7Wang, Huanan; Li, Shuaiqi; Wang, Baiquan; Li, Bin
The regioselective synthesis of 2-phosphinoylindoles via Rh(iii)-catalyzed C‒H activation
Organic Chemistry Frontiers, 2018, 5, 88
1553893 CIFC30 H23 Au F3 N4 O3 P SP 1 21/c 111.707; 16.717; 15.157
90; 96.39; 90		2948Huang, Ronghui; Yang, Yongchun; Wang, Duo-Sheng; Zhang, Liang; Wang, Dawei
Where does Au coordinate to N-(2-pyridiyl)benzotriazole: gold-catalyzed chemoselective dehydrogenation and borrowing hydrogen reactions
Organic Chemistry Frontiers, 2018, 5, 203
1553894 CIFC24 H20 N2 O5P 1 21 110.31419; 19.2062; 11.0205
90; 109.532; 90		2057.49Ruan, Sai; Lin, Xiaobin; Xie, Lihua; Lin, Lili; Feng, Xiaoming; Liu, Xiaohua
Asymmetric synthesis of 3-aminodihydrocoumarins via the chiral guanidine catalyzed cascade reaction of azlactones
Organic Chemistry Frontiers, 2018, 5, 32
1553895 CIFC21 H17 Br N2 OP 1 21/n 18.7889; 8.9182; 22.444
90; 91.02; 90		1758.9Zhang, Qianqian; Song, Chuanjun; Huang, He; Zhang, Kun; Chang, Junbiao
Cesium carbonate promoted cascade reaction involving DMF as a reactant for the synthesis of dihydropyrrolizino[3,2-b]indol-10-ones
Organic Chemistry Frontiers, 2018, 5, 80
1553896 CIFC15 H14 N2 OP 1 21/n 19.8465; 26.3558; 9.9725
90; 104.267; 90		2508.2Zhang, Qianqian; Song, Chuanjun; Huang, He; Zhang, Kun; Chang, Junbiao
Cesium carbonate promoted cascade reaction involving DMF as a reactant for the synthesis of dihydropyrrolizino[3,2-b]indol-10-ones
Organic Chemistry Frontiers, 2018, 5, 80
1553897 CIFC23 H20 Cl F3 N2 O3P b c a18.1727; 10.5743; 23.813
90; 90; 90		4576Sun, Yao-Liang; Wei, Yin; Shi, Min
Phosphine catalyzed δ-carbon addition and isomerization of alkynones to ketimines: the preparation of 1,3-diene substituted dihydroquinazolinones and 3-aminooxindoles
Organic Chemistry Frontiers, 2018, 5, 210
1553898 CIFC20 H24 N2 O4P 1 21/c 118.416; 11.31; 9.759
90; 93.907; 90		2027.9Sun, Yao-Liang; Wei, Yin; Shi, Min
Phosphine catalyzed δ-carbon addition and isomerization of alkynones to ketimines: the preparation of 1,3-diene substituted dihydroquinazolinones and 3-aminooxindoles
Organic Chemistry Frontiers, 2018, 5, 210
1553899 CIFC14 H19 N O3 SP 21 21 215.36821; 11.71337; 21.6232
90; 90; 90		1359.66Reboredo, Silvia; García-Marijuan, Ainara; Uria, Uxue; Reyes, Efraím; Carrillo, Luisa; Ugarriza, Iratxe; Vicario, Jose L.
Highly diastereoselective C →N acyl rearrangement in polysubstituted pyrrolidine 2,2-dicarboxylates. Stereocontrolled synthesis of densely functionalized prolines
Organic Chemistry Frontiers, 2018, 5, 933
1553900 CIFC13 H13 Br N2 OP 1 21/c 19.673; 11.975; 10.6305
90; 96.144; 90		1224.3Zhao, He; Chen, Xiuwen; Jiang, Huanfeng; Zhang, Min
Copper-catalysed dehydrogenative α-C(sp3)‒H amination of tetrahydroquinolines with O-benzoyl hydroxylamines
Organic Chemistry Frontiers, 2018, 5, 539
1553901 CIFC17 H17 N O3P 21 21 216.5337; 8.4509; 26.0879
90; 90; 90		1440.46Xu, Youguo; Zhang, Sheng; Li, Lijun; Wang, Yukang; Zha, Zhenggen; Wang, Zhiyong
l-Phenylalanine potassium catalyzed asymmetric formal [3 + 3] annulation of 2-enoyl-pyridine N-oxides with acetone
Organic Chemistry Frontiers, 2018, 5, 376
1553902 CIFC16 H36 Br Cl3 Fe NP n n a18.4928; 11.5835; 11.4759
90; 90; 90		2458.3Li, Sanliang; Zhu, Bo; Lee, Richmond; Qiao, Baokun; Jiang, Zhiyong
Visible light-induced selective aerobic oxidative transposition of vinyl halides using a tetrahalogenoferrate(iii) complex catalyst
Organic Chemistry Frontiers, 2018, 5, 380
1553903 CIFC24 H13 FP 1 21/n 110.4684; 7.428; 18.7773
90; 90.086; 90		1460.11Shi, Xinzhe; Roisnel, Thierry; Soulé, Jean-François; Doucet, Henri
Synthesis of mono- and di-arylated acenaphthylenes and programmed access to dibenzo[j,l]fluoranthenes via palladium-catalysed C‒H bond functionalisation
Organic Chemistry Frontiers, 2018, 5, 398
1553904 CIFC24 H14 Cl2C 1 2/c 116.8237; 11.333; 10.2994
90; 114.382; 90		1788.6Shi, Xinzhe; Roisnel, Thierry; Soulé, Jean-François; Doucet, Henri
Synthesis of mono- and di-arylated acenaphthylenes and programmed access to dibenzo[j,l]fluoranthenes via palladium-catalysed C‒H bond functionalisation
Organic Chemistry Frontiers, 2018, 5, 398
1553905 CIFC20 H22 N4 SP 1 21/n 117.47; 5.702; 20.396
90; 114.211; 90		1853Amendola, Valeria; Boiocchi, Massimo; Fabbrizzi, Luigi; La Cognata, Sonia; Legnani, Laura; Lo Presti, Eliana; Mangano, Carlo; Miljkovic, Ana
Anion-induced isomerization of fluorescent semi(thio)carbazones
Organic Chemistry Frontiers, 2018, 5, 391
1553906 CIFC23 H25 N O2C 1 2 117.0278; 8.4534; 14.668
90; 110.034; 90		1983.59Shen, Hong-Qiang; Liu, Cong; Zhou, Ji; Zhou, Yong-Gui
Enantioselective palladium-catalyzed C‒H functionalization of pyrroles using an axially chiral 2,2′-bipyridine ligand
Organic Chemistry Frontiers, 2018, 5, 611
1553907 CIFC25.5 H35 Cl2 Fe N3 O1.5P 1 21 116.1979; 9.8887; 17.2384
90; 100.854; 90		2711.8Chen, Jianhui; Xi, Tuo; Lu, Zhan
10 gram-scale synthesis of a chiral oxazoline iminopyridine ligand and its applications
Organic Chemistry Frontiers, 2018, 5, 247
1553908 CIFC21 H19 Br O2P 1 21/n 18.277; 19.206; 11.294
90; 93.738; 90		1791.6Qi, Jifeng; Zheng, Jing; Cui, Sunliang
Facile synthesis of carbo- and heterocycles via Fe(iii)-catalyzed alkene hydrofunctionalization
Organic Chemistry Frontiers, 2018, 5, 222
1553909 CIFC26 H28 O2P -18.914; 9.542; 13.652
86.106; 80.322; 67.976		1061Qi, Jifeng; Zheng, Jing; Cui, Sunliang
Facile synthesis of carbo- and heterocycles via Fe(iii)-catalyzed alkene hydrofunctionalization
Organic Chemistry Frontiers, 2018, 5, 222
1553910 CIFC38 H26 N4 O4P b c n21.1618; 11.9414; 23.2097
90; 90; 90		5865.1Zwoliński, K. M.; Sieroń, L.; Eilmes, J.
One-flask synthesis of dibenzotetraaza[14]annulene cyclic congeners bearing buta-1,3-diyne bridges
Organic Chemistry Frontiers, 2018, 5, 171
1553911 CIFC46 H50 N4 O8 S4 ZnP 1 21 111.2639; 15.6341; 13.7495
90; 110.204; 90		2272.3Zwoliński, K. M.; Sieroń, L.; Eilmes, J.
One-flask synthesis of dibenzotetraaza[14]annulene cyclic congeners bearing buta-1,3-diyne bridges
Organic Chemistry Frontiers, 2018, 5, 171
1553912 CIFC3.8 H2.8 Br0.2 N0.2 O0.4P 1 21/c 117.1209; 6.8257; 14.2218
90; 100.2; 90		1635.72Chen, Changjun; Pan, Yixiao; Zhao, Haoqiang; Xu, Xin; Xu, Jianbin; Zhang, Zongyao; Xi, Siqi; Xu, Lijin; Li, Huanrong
A versatile rhodium(iii) catalyst for direct acyloxylation of aryl and alkenyl C‒H bonds with carboxylic acids
Organic Chemistry Frontiers, 2018, 5, 415
1553913 CIFC24 H28 N O2 RhP -18.581; 10.888; 11.352
93.19; 106.92; 90.49		1012.8Chen, Changjun; Pan, Yixiao; Zhao, Haoqiang; Xu, Xin; Xu, Jianbin; Zhang, Zongyao; Xi, Siqi; Xu, Lijin; Li, Huanrong
A versatile rhodium(iii) catalyst for direct acyloxylation of aryl and alkenyl C‒H bonds with carboxylic acids
Organic Chemistry Frontiers, 2018, 5, 415
1553914 CIFC2.44 H1.78 N0.22 O0.22P -17.1832; 10.3531; 12.7041
99.499; 102.356; 98.881		892.4Chen, Changjun; Pan, Yixiao; Zhao, Haoqiang; Xu, Xin; Xu, Jianbin; Zhang, Zongyao; Xi, Siqi; Xu, Lijin; Li, Huanrong
A versatile rhodium(iii) catalyst for direct acyloxylation of aryl and alkenyl C‒H bonds with carboxylic acids
Organic Chemistry Frontiers, 2018, 5, 415
1553915 CIFC29 H32 O3C 1 2/c 130.962; 10.076; 20.18
90; 121.016; 90		5395.5Liu, Lina; Yuan, Zhenbo; Pan, Rui; Zeng, Yuye; Lin, Aijun; Yao, Hequan; Huang, Yue
1,6-Conjugated addition-mediated [4 + 1] annulation: an approach to 2,3-dihydrobenzofurans
Organic Chemistry Frontiers, 2018, 5, 623
1553916 CIFC17 H13 Cl N2 O4P -110.1754; 13.7004; 13.8309
119.49; 102.929; 92.342		1609.7Daggupati, Ramana V.; Malapaka, Chandrasekharam
Cu(i)-Catalyzed amidation/imidation of N-arylglycine ester derivatives via C‒N coupling under mild conditions
Organic Chemistry Frontiers, 2018, 5, 788

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