Crystallography Open Database
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Searching year of publication is 2018
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1549010 | CIF | C41 H64 O9 | C 2 2 21 | 7.8136; 22.8068; 65.613 90; 90; 90 | 11692.4 | Remy, Simon; Olivon, Florent; Desrat, Sandy; Blanchard, Florent; Eparvier, Véronique; Leyssen, Pieter; Neyts, Johan; Roussi, Fanny; Touboul, David; Litaudon, Marc Structurally Diverse Diterpenoids from Sandwithia guyanensis Journal of Natural Products, 2018 |
| 1549011 | CIF | C27 H29 Cl F6 N2 P Rh | P 1 21/n 1 | 15.9555; 11.5878; 17.1391 90; 116.061; 90 | 2846.6 | Banerjee, Samya; Soldevila-Barreda, Joan J; Wolny, Juliusz A.; Wootton, Christopher A.; Habtemariam, Abraha; Romero-Canelón, Isolda; Chen, Feng; Clarkson, Guy J.; Prokes, Ivan; Song, Lijiang; O'Connor, Peter B; Schünemann, Volker; Sadler, Peter J. New activation mechanism for half-sandwich organometallic anticancer complexes. Chemical science, 2018, 9, 3177-3185 |
| 1549012 | CIF | C20 H23 Cl F6 N2 P Rh | P m n 21 | 12.9507; 8.31; 10.5094 90; 90; 90 | 1131.02 | Banerjee, Samya; Soldevila-Barreda, Joan J; Wolny, Juliusz A.; Wootton, Christopher A.; Habtemariam, Abraha; Romero-Canelón, Isolda; Chen, Feng; Clarkson, Guy J.; Prokes, Ivan; Song, Lijiang; O'Connor, Peter B; Schünemann, Volker; Sadler, Peter J. New activation mechanism for half-sandwich organometallic anticancer complexes. Chemical science, 2018, 9, 3177-3185 |
| 1549013 | CIF | C31 H37 Cl F6 N2 O2 P Rh | P -1 | 8.51582; 13.5384; 14.2569 94.5969; 92.9146; 92.6758 | 1634.15 | Banerjee, Samya; Soldevila-Barreda, Joan J; Wolny, Juliusz A.; Wootton, Christopher A.; Habtemariam, Abraha; Romero-Canelón, Isolda; Chen, Feng; Clarkson, Guy J.; Prokes, Ivan; Song, Lijiang; O'Connor, Peter B; Schünemann, Volker; Sadler, Peter J. New activation mechanism for half-sandwich organometallic anticancer complexes. Chemical science, 2018, 9, 3177-3185 |
| 1549014 | CIF | C36 H35 Cl F6 N2 O P Rh | P -1 | 8.7508; 14.4955; 14.5101 84.91; 74.415; 82.382 | 1754.53 | Banerjee, Samya; Soldevila-Barreda, Joan J; Wolny, Juliusz A.; Wootton, Christopher A.; Habtemariam, Abraha; Romero-Canelón, Isolda; Chen, Feng; Clarkson, Guy J.; Prokes, Ivan; Song, Lijiang; O'Connor, Peter B; Schünemann, Volker; Sadler, Peter J. New activation mechanism for half-sandwich organometallic anticancer complexes. Chemical science, 2018, 9, 3177-3185 |
| 1549015 | CIF | C25 H28 F12 N3 O0.5 P2 Rh | P -1 | 9.84864; 10.1712; 16.1627 101.363; 90.9323; 109.801 | 1487.41 | Banerjee, Samya; Soldevila-Barreda, Joan J; Wolny, Juliusz A.; Wootton, Christopher A.; Habtemariam, Abraha; Romero-Canelón, Isolda; Chen, Feng; Clarkson, Guy J.; Prokes, Ivan; Song, Lijiang; O'Connor, Peter B; Schünemann, Volker; Sadler, Peter J. New activation mechanism for half-sandwich organometallic anticancer complexes. Chemical science, 2018, 9, 3177-3185 |
| 1549016 | CIF | C36 H39 Cl F6 N2 O P Rh | P 1 21/n 1 | 8.0233; 28.1842; 16.1096 90; 94.393; 90 | 3632.2 | Banerjee, Samya; Soldevila-Barreda, Joan J; Wolny, Juliusz A.; Wootton, Christopher A.; Habtemariam, Abraha; Romero-Canelón, Isolda; Chen, Feng; Clarkson, Guy J.; Prokes, Ivan; Song, Lijiang; O'Connor, Peter B; Schünemann, Volker; Sadler, Peter J. New activation mechanism for half-sandwich organometallic anticancer complexes. Chemical science, 2018, 9, 3177-3185 |
| 1549017 | CIF | C34 H35 Cl F6 N2 O P Rh | P -1 | 8.40215; 12.9603; 15.392 80; 86.442; 86.175 | 1644.79 | Banerjee, Samya; Soldevila-Barreda, Joan J; Wolny, Juliusz A.; Wootton, Christopher A.; Habtemariam, Abraha; Romero-Canelón, Isolda; Chen, Feng; Clarkson, Guy J.; Prokes, Ivan; Song, Lijiang; O'Connor, Peter B; Schünemann, Volker; Sadler, Peter J. New activation mechanism for half-sandwich organometallic anticancer complexes. Chemical science, 2018, 9, 3177-3185 |
| 1549018 | CIF | C28 H29 Cl F6 N2 O P Rh | P -1 | 8.20707; 10.08952; 17.2032 82.3397; 81.4575; 84.0175 | 1390.95 | Banerjee, Samya; Soldevila-Barreda, Joan J; Wolny, Juliusz A.; Wootton, Christopher A.; Habtemariam, Abraha; Romero-Canelón, Isolda; Chen, Feng; Clarkson, Guy J.; Prokes, Ivan; Song, Lijiang; O'Connor, Peter B; Schünemann, Volker; Sadler, Peter J. New activation mechanism for half-sandwich organometallic anticancer complexes. Chemical science, 2018, 9, 3177-3185 |
| 1549019 | CIF HKL Paper | C10 H10 N2 O4 S2 | P 21 21 2 | 11.232; 12.283; 4.401 90; 90; 90 | 607.2 | Lynch, Will; Padgett, Clifford W. 2,2′-Disulfanediylbis(pyridine N-oxide)‒hydrogen peroxide (1/1) IUCrData, 2018, 3 |
| 1549020 | CIF | C27 H20 N2 O3 S | P 1 21/c 1 | 12.6727; 15.398; 11.9061 90; 110.633; 90 | 2174.3 | Roy, Bibhisan; Reddy, Mallu Chenna; Hazra, Partha Developing the structure-property relationship to design solid state multi-stimuli responsive materials and their potential applications in different fields. Chemical science, 2018, 9, 3592-3606 |
| 1549021 | CIF | C15 H11 N O3 S | P -1 | 7.089; 7.256; 13.569 85.46; 77.9; 70.37 | 642.8 | Roy, Bibhisan; Reddy, Mallu Chenna; Hazra, Partha Developing the structure-property relationship to design solid state multi-stimuli responsive materials and their potential applications in different fields. Chemical science, 2018, 9, 3592-3606 |
| 1549022 | CIF | C27 H18 N2 O3 S | C 1 2 1 | 25.719; 7.5368; 11.759 90; 116.39; 90 | 2041.8 | Roy, Bibhisan; Reddy, Mallu Chenna; Hazra, Partha Developing the structure-property relationship to design solid state multi-stimuli responsive materials and their potential applications in different fields. Chemical science, 2018, 9, 3592-3606 |
| 1549023 | CIF | C17 H16 N2 O3 S | P 1 21/n 1 | 8.172; 9.666; 20.305 90; 99.512; 90 | 1581.9 | Roy, Bibhisan; Reddy, Mallu Chenna; Hazra, Partha Developing the structure-property relationship to design solid state multi-stimuli responsive materials and their potential applications in different fields. Chemical science, 2018, 9, 3592-3606 |
| 1549024 | CIF | C27 H22 N2 O | P -1 | 9.904; 9.9455; 11.4559 107.381; 98.533; 111.288 | 960.64 | Shivraj, ?; Siddlingeshwar, B.; Kirilova, Elena M.; Belyakov, Sergey V.; Divakar, Darshan Devang; Alkheraif, Abdulaziz Abdullah Photophysical properties of benzanthrone derivatives: effect of substituent, solvent polarity and hydrogen bonding. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 453-464 |
| 1549025 | CIF | C32 H40 N4 O3 | P -1 | 10.3648; 11.5481; 12.5472 81.87; 77.716; 87.248 | 1452.4 | Molla, Habib Ali; Bhowmick, Rahul; Islam, Abu Saleh Musha; Show, Bibhutibhushan; Mukherjee, Nillohit; Mondal, Anup; Ali, Mahammad A turn-on fluorogenic chemosensor for Fe<sup>3+</sup> and a Schottky barrier diode with frequency-switching device applications. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 465-473 |
| 1549026 | CIF | C159 H132 N23 O29 Zn6 | P 1 21/n 1 | 16.255; 18.811; 23.568 90; 93.435; 90 | 7194 | Kim, Hyun-Chul; Huh, Seong; Lee, Do Nam; Kim, Youngmee Selective carbon dioxide sorption by a new breathing three-dimensional Zn-MOF with Lewis basic nitrogen-rich channels. Dalton transactions (Cambridge, England : 2003), 2018, 47, 4820-4826 |
| 1549027 | CIF | C48 H30 N6 O8 Zn2 | P -1 | 10.7074; 14.8797; 15.0461 112.453; 94.452; 108.095 | 2052.7 | Kim, Hyun-Chul; Huh, Seong; Lee, Do Nam; Kim, Youngmee Selective carbon dioxide sorption by a new breathing three-dimensional Zn-MOF with Lewis basic nitrogen-rich channels. Dalton transactions (Cambridge, England : 2003), 2018, 47, 4820-4826 |
| 1549028 | CIF | C23 H26 Br2 O2 | P 21 21 21 | 7.5979; 14.0001; 19.629 90; 90; 90 | 2088 | Chang, Shirui; Wang, Lei; Lin, Xufeng Synthesis and application of a new hexamethyl-1,1'-spirobiindane-based chiral bisphosphine (HMSI-PHOS) ligand in asymmetric allylic alkylation. Organic & biomolecular chemistry, 2018, 16, 2239-2247 |
| 1549029 | CIF | C86 H162 Co Cr7 F8 N O33 | I 4 | 19.9066; 19.9066; 16.1991 90; 90; 90 | 6419.3 | Garlatti, Elena; Guidi, Tatiana; Chiesa, Alessandro; Ansbro, Simon; Baker, Michael L.; Ollivier, Jacques; Mutka, Hannu; Timco, Grigore A.; Vitorica-Yrezabal, Inigo; Pavarini, Eva; Santini, Paolo; Amoretti, Giuseppe; Winpenny, Richard E. P.; Carretta, Stefano Anisotropy of Co<sup>II</sup> transferred to the Cr<sub>7</sub>Co polymetallic cluster <i>via</i> strong exchange interactions. Chemical science, 2018, 9, 3555-3562 |
| 1549030 | CIF | C15 H20 O3 | P 21 21 2 | 6.83018; 26.1293; 7.49108 90; 90; 90 | 1336.92 | Zhang, Chen; Wen, Ran; Ma, Xiao-Li; Zeng, Ke-Wu; Xue, Yang; Zhang, Pu-Ming; Zhao, Ming-Bo; Jiang, Yong; Liu, Guo-Qing; Tu, Peng-Fei Nitric Oxide Inhibitory Sesquiterpenoids and Its Dimers from Artemisia freyniana. Journal of natural products, 2018 |
| 1549031 | CIF | C16 H16 N4 O | P 1 21/n 1 | 6.812; 22.167; 9.4317 90; 91.2974; 90 | 1423.8 | Meisner, 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 |
| 1549032 | CIF | C16 H16 N4 O | P b c a | 7.6447; 13.1287; 29.1836 90; 90; 90 | 2929.01 | Meisner, 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 |
| 1549033 | CIF | C H5 Br3 N2 Pb | R -3 :H | 8.347; 8.347; 10.218 90; 90; 120 | 616.53 | Govinda, Sharada; Kore, Bhushan P.; Swain, Diptikanta; Hossain, Akmal; De, Chandan; Guru Row, Tayur N.; Sarma, D. D. Critical Comparison of FAPbX3 and MAPbX3 (X = Br and Cl): How Do They Differ? The Journal of Physical Chemistry C, 2018 |
| 1549034 | CIF | C H5 Cl3 N2 Pb | P m -3 m | 5.7379; 5.7379; 5.7379 90; 90; 90 | 188.912 | Govinda, Sharada; Kore, Bhushan P.; Swain, Diptikanta; Hossain, Akmal; De, Chandan; Guru Row, Tayur N.; Sarma, D. D. Critical Comparison of FAPbX3 and MAPbX3 (X = Br and Cl): How Do They Differ? The Journal of Physical Chemistry C, 2018 |
| 1549035 | CIF | C3 H6 N3 O10 P | P 1 21/c 1 | 12.37; 8.1257; 9.943 90; 97.638; 90 | 990.6 | Manner, Virginia W.; Cawkwell, Marc J.; Kober, Edward M.; Myers, Thomas W.; Brown, Geoff W.; Tian, Hongzhao; Snyder, Christopher J.; Perriot, Romain; Preston, Daniel N. Examining the chemical and structural properties that influence the sensitivity of energetic nitrate esters. Chemical science, 2018, 9, 3649-3663 |
| 1549036 | CIF | C4 H7 N3 O9 | P -1 | 7.6451; 7.8238; 8.9723 100.557; 96.753; 114.76 | 467.59 | Manner, Virginia W.; Cawkwell, Marc J.; Kober, Edward M.; Myers, Thomas W.; Brown, Geoff W.; Tian, Hongzhao; Snyder, Christopher J.; Perriot, Romain; Preston, Daniel N. Examining the chemical and structural properties that influence the sensitivity of energetic nitrate esters. Chemical science, 2018, 9, 3649-3663 |
| 1549037 | CIF HKL Paper | C16 H14 N2 O | P -1 | 7.3502; 17.3508; 17.9449 118.226; 100.042; 92.294 | 1965.63 | Ramli, Youssef; El Bakri, Youness; El Ghayati, L'houssaine; Essassi, El Mokhtar; Mague, Joel T. 1-Benzyl-3-methylquinoxalin-2(1<i>H</i>)-one IUCrData, 2018, 3, x180390 |
| 1549038 | CIF HKL Paper | C13 H18 F N O5 | P 1 21 1 | 10.561; 5.156; 12.504 90; 90.606; 90 | 680.8 | Mossine, Valeri V.; Barnes, Charles L.; Mawhinney, Thomas P. 1-Deoxy-1-(<i>N</i>-methyl-4-fluorophenylamino)-<small>D</small>-<i>arabino</i>-hexulose IUCrData, 2018, 3, x180369 |
| 1549039 | CIF | O4 Si Zn2 | I m m a | 5.73982; 11.50723; 8.39608 90; 90; 90 | 554.556 | Kanzaki, M. Crystal structures of Zn2GeO4 cubic/tetragonal spinel and Zn2SiO4 modified spinel phases Journal of Mineralogical and Petrological Sciences, 2018, 113, 41-46 |
| 1549040 | CIF | Ge O4 Zn2 | F d -3 m :1 | 8.35436; 8.35436; 8.35436 90; 90; 90 | 583.095 | Kanzaki, M. Crystal structures of Zn2GeO4 cubic/tetragonal spinel and Zn2SiO4 modified spinel phases Journal of Mineralogical and Petrological Sciences, 2018, 113, 41-46 |
| 1549041 | CIF | Ge O4 Zn2 | P 43 2 2 | 5.93787; 5.93787; 8.25629 90; 90; 90 | 291.103 | Kanzaki, M. Crystal structures of Zn2GeO4 cubic/tetragonal spinel and Zn2SiO4 modified spinel phases Journal of Mineralogical and Petrological Sciences, 2018, 113, 41-46 |
| 1549042 | CIF | C17 H19 B F4 N2 O | P 1 21/c 1 | 19.5805; 9.7595; 8.9644 90; 103.158; 90 | 1668.08 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549043 | CIF | C31 H35 B N2 O | P 21 21 21 | 9.49835; 11.89113; 22.8675 90; 90; 90 | 2582.8 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549044 | CIF | C10 H16 I N O | P 1 21 1 | 5.40542; 6.94898; 16.0701 90; 95.864; 90 | 600.47 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549045 | CIF | C40 H66 Cl2 N10 O16 | I 1 2/a 1 | 15.1489; 13.2904; 24.594 90; 97.293; 90 | 4911.6 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549046 | CIF | C17 H19 Cl N2 O | P 1 21/c 1 | 18.7661; 8.8339; 9.6084 90; 100.318; 90 | 1567.1 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549047 | CIF | C19 H26 Cl N5 O3 | P 1 21/c 1 | 7.10113; 13.625; 20.6821 90; 91.5054; 90 | 2000.36 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549048 | CIF | C22 H32 N2 O6 | C 1 2 1 | 13.5545; 5.84781; 14.1657 90; 110.071; 90 | 1054.64 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549049 | CIF | C14 H18 F18 K N3 P2 S | P 1 21/c 1 | 24.3732; 10.4084; 9.9932 90; 93.1701; 90 | 2531.26 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549050 | CIF | C34 H42 N4 O8 S | P 1 21 1 | 8.6454; 9.463; 20.0392 90; 96.753; 90 | 1628.06 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549051 | CIF | C17 H21 N2 O5 P | P 1 21/c 1 | 20.7561; 9.5134; 8.5352 90; 96.5078; 90 | 1674.51 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549052 | CIF | C14 H18 Br F6 N3 S | P 1 21/c 1 | 10.9874; 14.2737; 23.2106 90; 90.2783; 90 | 3640.1 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549053 | CIF | C38 H48.7 N4 O11.35 | P 1 21 1 | 8.81; 9.7133; 21.7147 90; 100.169; 90 | 1829.03 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549054 | CIF | C18 H19 N3 O S | P 1 21/c 1 | 19.8981; 8.0213; 10.8806 90; 100.435; 90 | 1707.92 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549055 | CIF | C17 H19 I N2 O | P 1 21/c 1 | 19.6674; 8.1224; 10.8447 90; 105.289; 90 | 1671.09 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549056 | CIF | C10 H16 I N O | P 21 21 21 | 7.32726; 18.9411; 25.6662 90; 90; 90 | 3562.12 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549057 | CIF | C10 H16 Cl N O | P 1 21 1 | 7.2565; 6.1232; 12.557 90; 102.256; 90 | 545.23 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549058 | CIF | C11 H16 N2 O S | P 21 21 21 | 6.09862; 7.52704; 27.3811 90; 90; 90 | 1256.92 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549059 | CIF | C42 H46 N4 O16 Sb2 | C 1 2 1 | 22.3684; 8.4156; 15.6852 90; 130.585; 90 | 2242.36 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549060 | CIF | C31 H35 B N2 O | P 1 21/n 1 | 10.1433; 18.6189; 14.0467 90; 99.569; 90 | 2615.91 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549061 | CIF | C10 H16 Br N O | P 1 21 1 | 7.4467; 6.20961; 12.5863 90; 101.176; 90 | 570.97 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549062 | CIF | C36 H38 N4 O8 | P 1 21 1 | 9.0081; 9.3218; 19.4957 90; 95.351; 90 | 1629.95 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549063 | CIF | C19 H23 Cl I N5 O | P 1 21/c 1 | 12.9279; 12.5457; 13.139 90; 109.843; 90 | 2004.48 | Nievergelt, Philipp P.; Babor, Martin; Čejka, Jan; Spingler, Bernhard A high throughput screening method for the nano-crystallization of salts of organic cations. Chemical science, 2018, 9, 3716-3722 |
| 1549064 | CIF | C35 H35 N4 O2 | P 1 21/c 1 | 19.675; 16.984; 8.859 90; 95.45; 90 | 2947 | Andrews, M. Crawford; Peng, Ping; Rajput, Amit; Cozzolino, Anthony F. Modulation of the carboxamidine redox potential through photoinduced spiropyran or fulgimide isomerisation. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 432-441 |
| 1549065 | CIF HKL Paper | C14 H11 Br2 N O2 | P 1 21/n 1 | 16.7219; 6.90389; 23.0811 90; 99.502; 90 | 2628.07 | Pal, Tarun Kumar; Hossain, Md Dulal; Sheikh, Md Chanmiya; Miyatake, Ryuta; Alam, Md Ashraful 2,4-Dibromo-6-[(2-hydroxy-5-methylanilino)methylidene]cyclohexa-2,4-dienone IUCrData, 2018, 3, x180388 |
| 1549066 | CIF HKL Paper | C15 H21 N3 O2 S | P c c n | 29.5823; 15.1971; 7.4303 90; 90; 90 | 3340.4 | Chaurasia, Rahul; Bharti, Akhilesh; Butcher, Ray J.; Wikaira, Jan L.; Bharty, Manoj K. 4-Cyclohexyl-1-(2-methoxybenzoyl)thiosemicarbazide with an unknown solvent IUCrData, 2018, 3, x180383 |
| 1549067 | CIF | C18 H18.5 N4 | P 1 21/n 1 | 6.1903; 35.9841; 14.2498 90; 98.3233; 90 | 3140.7 | Bazley, Isabel J.; Erie, Ellen A.; Feiereisel, Garrett M.; LeWarne, Christopher J.; Peterson, Jack M.; Sandquist, Katherine L.; Oshin, Kayode D.; Zeller, Matthias X-ray Crystallography Analysis of Complexes Synthesized with Tris(2-pyridylmethyl)amine: A Laboratory Experiment for Undergraduate Students Integrating Interdisciplinary Concepts and Techniques Journal of Chemical Education, 2018 |
| 1549068 | CIF | C140.5 H113.5 Cl5.5 O1.5 | P -1 | 15.3025; 16.0955; 22.2445 94.998; 108.991; 92.221 | 5147.8 | Cruz, Carlos M.; Márquez, Irene R; Mariz, Inês F A; Blanco, Victor; Sánchez-Sánchez, Carlos; Sobrado, Jesús M; Martín-Gago, José A; Cuerva, Juan M.; Maçôas, Ermelinda; Campaña, Araceli G Enantiopure distorted ribbon-shaped nanographene combining two-photon absorption-based upconversion and circularly polarized luminescence. Chemical science, 2018, 9, 3917-3924 |
| 1549069 | CIF | C116 H103 F3 O4 S | P -1 | 14.3675; 17.3718; 18.9206 67.525; 86.143; 89.598 | 4352.9 | Cruz, Carlos M.; Márquez, Irene R; Mariz, Inês F A; Blanco, Victor; Sánchez-Sánchez, Carlos; Sobrado, Jesús M; Martín-Gago, José A; Cuerva, Juan M.; Maçôas, Ermelinda; Campaña, Araceli G Enantiopure distorted ribbon-shaped nanographene combining two-photon absorption-based upconversion and circularly polarized luminescence. Chemical science, 2018, 9, 3917-3924 |
| 1549070 | CIF | C30 H38 O5 | P 21 21 21 | 6.2081; 19.8715; 20.2149 90; 90; 90 | 2493.8 | Chen, He-Ping; Zhao, Zhen-Zhu; Li, Zheng-Hui; Huang, Ying; Zhang, Shuai-Bing; Tang, Yang; Yao, Jian-Neng; Chen, Lin; Isaka, Masahiko; Feng, Tao; Liu, Ji-Kai Antiproliferative and Anti-inflammatory Lanostane Triterpenoids from the Polish Edible Mushroom Macrolepiota procera. Journal of agricultural and food chemistry, 2018 |
| 1549071 | CIF | C75 H175 Ag19 Au O24 P12 S24 | P 1 21/c 1 | 29.6903; 17.3784; 30.3868 90; 110.373; 90 | 14697.9 | Lin, Yan-Ru; Kishore, Pilli V. V. N.; Liao, Jian-Hong; Kahlal, Samia; Liu, Yu-Chiao; Chiang, Ming-Hsi; Saillard, Jean-Yves; Liu, C. W. Synthesis, structural characterization and transformation of an eight-electron superatomic alloy, [Au@Ag<sub>19</sub>{S<sub>2</sub>P(OPr)<sub>2</sub>}<sub>12</sub>]. Nanoscale, 2018, 10, 6855-6860 |
| 1549072 | CIF | C75 H61 B Cl5 F4 O3 Os P3 S2 | P 1 21/c 1 | 24.7978; 14.1129; 20.1547 90; 96.645; 90 | 7006.1 | Lu, Zhengyu; Cai, Yuanting; Wei, Yuanqing; Lin, Qin; Chen, Jiangxi; He, Xumin; Li, Shunhua; Wu, Weitai; Xia, Haiping Photothermal Möbius aromatic metallapentalenofuran and its NIR-responsive copolymer Polymer Chemistry, 2018, 9, 2092 |
| 1549073 | CIF | C77 H59 B Cl F4 O3 Os P3 S3 | P -1 | 11.1803; 14.1709; 23.4379 76.653; 84.029; 69.337 | 3379.62 | Lu, Zhengyu; Cai, Yuanting; Wei, Yuanqing; Lin, Qin; Chen, Jiangxi; He, Xumin; Li, Shunhua; Wu, Weitai; Xia, Haiping Photothermal Möbius aromatic metallapentalenofuran and its NIR-responsive copolymer Polymer Chemistry, 2018, 9, 2092 |
| 1549074 | CIF HKL Paper | C14 H7 Br2 N O2 | P n m a | 15.116; 6.8728; 12.7492 90; 90; 90 | 1324.5 | El-Hiti, Gamal A.; Smith, Keith; Alamri, Mesfer; Morris, Ceri A.; Kille, Peter; Kariuki, Benson M. 5-Bromo-1-(4-bromophenyl)isatin IUCrData, 2018, 3, x180426 |
| 1549075 | CIF HKL Paper | C24 H22 N4 O2 S | P 1 21/c 1 | 6.2938; 10.9254; 31.229 90; 90.221; 90 | 2147.4 | El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Khidre, Rizk E.; Mostafa, Mohamed S.; Hegazy, Amany S.; Kariuki, Benson M. 1-{2-Anilino-4-methyl-5-[5-methyl-1-(4-methylphenyl)-1<i>H</i>-1,2,3-triazole-4-carbonyl]thiophen-3-yl}ethanone IUCrData, 2018, 3, x180402 |
| 1549076 | CIF HKL Paper | C20 H18 N8 O2 | C 1 2/c 1 | 61.5399; 11.8988; 8.2661 90; 93.301; 90 | 6042.8 | El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Mostafa, Mohamed S.; Khidre, Rizk E.; Hegazy, Amany S.; Kariuki, Benson M. 5-Methyl-<i>N</i>'-(5-methyl-1-phenyl-1<i>H</i>-1,2,3-triazole-4-carbonyl)-1-phenyl-1<i>H</i>-1,2,3-triazole-4-carbohydrazide IUCrData, 2018, 3, x180424 |
| 1549077 | CIF | C21 H18 Cl N3 | P 21 3 | 13.484; 13.484; 13.484 90; 90; 90 | 2451.6 | Xu, Jiaxi; Liu, Jingjing; Li, Zhenjiang; Xu, Songquan; Wang, Haixin; Guo, Tianfo; Gao, Yu; Zhang, Lei; Zhang, Chan; Guo, Kai Opposite-charge repulsive cation and anion pair cooperative organocatalysis in ring-opening polymerization Polymer Chemistry, 2018, 9, 2183 |
| 1549078 | CIF | C36 H26 N2 O2 | P 1 21/c 1 | 29.8205; 8.8627; 25.1375 90; 110.05; 90 | 6241 | Zhang, Chang-Wei; Ou, Bo; Jiang, Shu-Ting; Yin, Guang-Qiang; Chen, Li-Jun; Xu, Lin; Li, Xiaopeng; Yang, Hai-Bo Cross-linked AIE supramolecular polymer gels with multiple stimuli-responsive behaviours constructed by hierarchical self-assembly Polymer Chemistry, 2018, 9, 2021 |
| 1549079 | CIF | C43 H29 N6 O4 Ru | P 1 21/c 1 | 12.139; 15.53; 24.301 90; 98.77; 90 | 4528 | Xiang, Wenjing; Li, Lin; Dai, Zengjin; Meng, Xianggao; Li, Renjie; Zhang, Jing; Peng, Tianyou TiO2 modified with a Ru(ii)‒N′NN′ 8-hydroxyquinolyl complex for efficient gaseous photoreduction of CO2 Catalysis Science & Technology, 2018, 8, 2098 |
| 1549080 | CIF | C25 H15 N O2 | P 1 21/n 1 | 15.4892; 7.8471; 15.5804 90; 114.831; 90 | 1718.65 | Mu, Yingxiao; Yang, Zhiyong; Chen, Junru; Yang, Zhan; Li, Wenlang; Tan, Xianbao; Mao, Zhu; Yu, Tao; Zhao, Juan; Zheng, Shizhao; Liu, Siwei; Zhang, Yi; Chi, Zhenguo; Xu, Jiarui; Aldred, Matthew P. Mechano-induced persistent room-temperature phosphorescence from purely organic molecules. Chemical science, 2018, 9, 3782-3787 |
| 1549081 | CIF | C57 H83 B2 Li O4 | P c c n | 21.5605; 26.1802; 19.2608 90; 90; 90 | 10871.9 | Kaese, Thomas; Trageser, Timo; Budy, Hendrik; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias A redox-active diborane platform performs C(sp<sup>3</sup>)-H activation and nucleophilic substitution reactions. Chemical science, 2018, 9, 3881-3891 |
| 1549082 | CIF | C56 H85 B2 Li O4 | P 1 21/n 1 | 10.7242; 21.4641; 24.027 90; 97.208; 90 | 5487 | Kaese, Thomas; Trageser, Timo; Budy, Hendrik; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias A redox-active diborane platform performs C(sp<sup>3</sup>)-H activation and nucleophilic substitution reactions. Chemical science, 2018, 9, 3881-3891 |
| 1549083 | CIF | C44 H56 B2 | P -1 | 5.974; 14.639; 21.461 82.273; 89.91; 86.79 | 1856.8 | Kaese, Thomas; Trageser, Timo; Budy, Hendrik; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias A redox-active diborane platform performs C(sp<sup>3</sup>)-H activation and nucleophilic substitution reactions. Chemical science, 2018, 9, 3881-3891 |
| 1549084 | CIF | C66 H98 B2 Li2 O7 | P 1 21/c 1 | 12.9451; 18.3459; 27.0962 90; 101.393; 90 | 6308.3 | Kaese, Thomas; Trageser, Timo; Budy, Hendrik; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias A redox-active diborane platform performs C(sp<sup>3</sup>)-H activation and nucleophilic substitution reactions. Chemical science, 2018, 9, 3881-3891 |
| 1549085 | CIF | C53 H75 B2 Li O3 | P 1 21 1 | 14.775; 19.9973; 17.9098 90; 109.105; 90 | 5000.2 | Kaese, Thomas; Trageser, Timo; Budy, Hendrik; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias A redox-active diborane platform performs C(sp<sup>3</sup>)-H activation and nucleophilic substitution reactions. Chemical science, 2018, 9, 3881-3891 |
| 1549086 | CIF | C61 H90 B2 Cl Li O8 | F d d 2 | 12.2698; 43.946; 21.961 90; 90; 90 | 11841.6 | Kaese, Thomas; Trageser, Timo; Budy, Hendrik; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias A redox-active diborane platform performs C(sp<sup>3</sup>)-H activation and nucleophilic substitution reactions. Chemical science, 2018, 9, 3881-3891 |
| 1549087 | CIF | C63 H87 B2 Li O4 | P 1 21/c 1 | 19.497; 24.7864; 23.972 90; 92.463; 90 | 11574 | Kaese, Thomas; Trageser, Timo; Budy, Hendrik; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias A redox-active diborane platform performs C(sp<sup>3</sup>)-H activation and nucleophilic substitution reactions. Chemical science, 2018, 9, 3881-3891 |
| 1549088 | CIF | C43 H54 B2 | P c a 21 | 41.344; 14.272; 6.1349 90; 90; 90 | 3620 | Kaese, Thomas; Trageser, Timo; Budy, Hendrik; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias A redox-active diborane platform performs C(sp<sup>3</sup>)-H activation and nucleophilic substitution reactions. Chemical science, 2018, 9, 3881-3891 |
| 1549089 | CIF | C70 H84 B2 O | P -1 | 10.4041; 11.5484; 25.736 79.323; 85.313; 81.22 | 2998.51 | Kaese, Thomas; Trageser, Timo; Budy, Hendrik; Bolte, Michael; Lerner, Hans-Wolfram; Wagner, Matthias A redox-active diborane platform performs C(sp<sup>3</sup>)-H activation and nucleophilic substitution reactions. Chemical science, 2018, 9, 3881-3891 |
| 1549092 | CIF | C28 H34 N2 O4 S | P -1 | 10.0007; 10.5374; 12.7404 102.821; 90.215; 102.549 | 1275.9 | Al Mousawi, Assi; Arar, Ahmad; Ibrahim-Ouali, Malika; Duval, Sylvain; Dumur, Frédéric; Garra, Patxi; Toufaily, Joumana; Hamieh, Tayssir; Graff, Bernadette; Gigmes, Didier; Fouassier, Jean-Pierre; Lalevée, Jacques Carbazole-based compounds as photoinitiators for free radical and cationic polymerization upon near visible light illumination. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 578-585 |
| 1549093 | CIF | C30 H38 O7 | P 1 21/c 1 | 14.317; 8.341; 22.569 90; 98.276; 90 | 2667.1 | Niu, Sheng-Li; Li, Da-Hong; Li, Xin-Yu; Wang, Yue-Tong; Li, Sheng-Ge; Bai, Jiao; Pei, Yue-Hu; Jing, Yong-Kui; Li, Zhan-Lin; Hua, Hui-Ming Bioassay- and Chemistry-Guided Isolation of Scalemic Caged Prenylxanthones from the Leaves of Garcinia bracteata Journal of Natural Products, 2018 |
| 1549094 | CIF | C26 H32 O2 S2 | I 1 2/a 1 | 7.7604; 5.9132; 49.45 90; 95.879; 90 | 2257.3 | van der Lee, Arie; Roche, Gilles H.; Wantz, Guillaume; Moreau, Joël J E; Dautel, Olivier J.; Filhol, Jean-Sébastien Experimental and theoretical evidence of a supercritical-like transition in an organic semiconductor presenting colossal uniaxial negative thermal expansion. Chemical science, 2018, 9, 3948-3956 |
| 1549095 | CIF | C26 H32 O2 S2 | I 1 2/a 1 | 7.856; 5.8413; 49.561 90; 95.46; 90 | 2264 | van der Lee, Arie; Roche, Gilles H.; Wantz, Guillaume; Moreau, Joël J E; Dautel, Olivier J.; Filhol, Jean-Sébastien Experimental and theoretical evidence of a supercritical-like transition in an organic semiconductor presenting colossal uniaxial negative thermal expansion. Chemical science, 2018, 9, 3948-3956 |
| 1549096 | CIF | C26 H32 O2 S2 | I 1 2/a 1 | 8.0891; 5.7282; 49.849 90; 94.255; 90 | 2303.4 | van der Lee, Arie; Roche, Gilles H.; Wantz, Guillaume; Moreau, Joël J E; Dautel, Olivier J.; Filhol, Jean-Sébastien Experimental and theoretical evidence of a supercritical-like transition in an organic semiconductor presenting colossal uniaxial negative thermal expansion. Chemical science, 2018, 9, 3948-3956 |
| 1549097 | CIF | C26 H32 O2 S2 | I 1 2/a 1 | 7.9306; 5.8288; 49.645 90; 95.171; 90 | 2285.5 | van der Lee, Arie; Roche, Gilles H.; Wantz, Guillaume; Moreau, Joël J E; Dautel, Olivier J.; Filhol, Jean-Sébastien Experimental and theoretical evidence of a supercritical-like transition in an organic semiconductor presenting colossal uniaxial negative thermal expansion. Chemical science, 2018, 9, 3948-3956 |
| 1549098 | CIF | C26 H32 O2 S2 | I 1 2/a 1 | 7.9631; 5.8073; 49.723 90; 94.85; 90 | 2291.2 | van der Lee, Arie; Roche, Gilles H.; Wantz, Guillaume; Moreau, Joël J E; Dautel, Olivier J.; Filhol, Jean-Sébastien Experimental and theoretical evidence of a supercritical-like transition in an organic semiconductor presenting colossal uniaxial negative thermal expansion. Chemical science, 2018, 9, 3948-3956 |
| 1549099 | CIF | C26 H32 O2 S2 | I 1 2/a 1 | 8.3546; 5.6236; 50.168 90; 93.146; 90 | 2353.5 | van der Lee, Arie; Roche, Gilles H.; Wantz, Guillaume; Moreau, Joël J E; Dautel, Olivier J.; Filhol, Jean-Sébastien Experimental and theoretical evidence of a supercritical-like transition in an organic semiconductor presenting colossal uniaxial negative thermal expansion. Chemical science, 2018, 9, 3948-3956 |
| 1549100 | CIF | C26 H32 O2 S2 | I 1 2/a 1 | 8.0248; 5.7688; 49.827 90; 94.591; 90 | 2299.3 | van der Lee, Arie; Roche, Gilles H.; Wantz, Guillaume; Moreau, Joël J E; Dautel, Olivier J.; Filhol, Jean-Sébastien Experimental and theoretical evidence of a supercritical-like transition in an organic semiconductor presenting colossal uniaxial negative thermal expansion. Chemical science, 2018, 9, 3948-3956 |
| 1549101 | CIF | C26 H32 O2 S2 | I 1 2/a 1 | 8.446; 5.58942; 50.2534 90; 92.829; 90 | 2369.48 | van der Lee, Arie; Roche, Gilles H.; Wantz, Guillaume; Moreau, Joël J E; Dautel, Olivier J.; Filhol, Jean-Sébastien Experimental and theoretical evidence of a supercritical-like transition in an organic semiconductor presenting colossal uniaxial negative thermal expansion. Chemical science, 2018, 9, 3948-3956 |
| 1549102 | CIF | C26 H32 O2 S2 | I 1 2/a 1 | 7.8186; 5.8811; 49.458 90; 95.762; 90 | 2262.7 | van der Lee, Arie; Roche, Gilles H.; Wantz, Guillaume; Moreau, Joël J E; Dautel, Olivier J.; Filhol, Jean-Sébastien Experimental and theoretical evidence of a supercritical-like transition in an organic semiconductor presenting colossal uniaxial negative thermal expansion. Chemical science, 2018, 9, 3948-3956 |
| 1549103 | CIF | C26 H32 O2 S2 | I 1 2/a 1 | 8.1615; 5.6918; 49.87 90; 93.819; 90 | 2311.5 | van der Lee, Arie; Roche, Gilles H.; Wantz, Guillaume; Moreau, Joël J E; Dautel, Olivier J.; Filhol, Jean-Sébastien Experimental and theoretical evidence of a supercritical-like transition in an organic semiconductor presenting colossal uniaxial negative thermal expansion. Chemical science, 2018, 9, 3948-3956 |
| 1549104 | CIF | C26 H32 O2 S2 | I 1 2/a 1 | 8.2606; 5.6541; 49.944 90; 93.621; 90 | 2328 | van der Lee, Arie; Roche, Gilles H.; Wantz, Guillaume; Moreau, Joël J E; Dautel, Olivier J.; Filhol, Jean-Sébastien Experimental and theoretical evidence of a supercritical-like transition in an organic semiconductor presenting colossal uniaxial negative thermal expansion. Chemical science, 2018, 9, 3948-3956 |
| 1549105 | CIF | C40 H53 O2 S4 | P 1 21/c 1 | 8.8413; 22.709; 27.979 90; 94.615; 90 | 5599.3 | McDearmon, 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 |
| 1549106 | CIF | C20 H24 O2 S2 | P -1 | 9.3989; 17.981; 27.49 103.638; 92.242; 96.035 | 4480 | McDearmon, 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 |
| 1549107 | CIF | C30 H60 Br2 F4 Ni2 P4 | P -1 | 11.059; 12.1681; 15.1847 75.96; 89.526; 89.997 | 1982.25 | Thangavadivale, Vargini; Aguiar, Pedro M.; Jasim, Naseralla A.; Pike, Sarah J.; Smith, Dan A.; Whitwood, Adrian C.; Brammer, Lee; Perutz, Robin N. Self-complementary nickel halides enable multifaceted comparisons of intermolecular halogen bonds: fluoride ligands <i>vs.</i> other halides. Chemical science, 2018, 9, 3767-3781 |
| 1549108 | CIF | C18 H30 F5 I Ni P2 | I 1 2 1 | 8.0074; 11.3665; 12.9665 90; 94.616; 90 | 1176.33 | Thangavadivale, Vargini; Aguiar, Pedro M.; Jasim, Naseralla A.; Pike, Sarah J.; Smith, Dan A.; Whitwood, Adrian C.; Brammer, Lee; Perutz, Robin N. Self-complementary nickel halides enable multifaceted comparisons of intermolecular halogen bonds: fluoride ligands <i>vs.</i> other halides. Chemical science, 2018, 9, 3767-3781 |
| 1549109 | CIF | C18 H30 F5 I Ni P2 | I 1 2 1 | 7.8675; 11.3291; 12.9347 90; 94.392; 90 | 1149.51 | Thangavadivale, Vargini; Aguiar, Pedro M.; Jasim, Naseralla A.; Pike, Sarah J.; Smith, Dan A.; Whitwood, Adrian C.; Brammer, Lee; Perutz, Robin N. Self-complementary nickel halides enable multifaceted comparisons of intermolecular halogen bonds: fluoride ligands <i>vs.</i> other halides. Chemical science, 2018, 9, 3767-3781 |
| 1549110 | CIF | C18 H30 F4 Ni P2 | P 43 21 2 | 8.13398; 8.13398; 31.6136 90; 90; 90 | 2091.61 | Thangavadivale, Vargini; Aguiar, Pedro M.; Jasim, Naseralla A.; Pike, Sarah J.; Smith, Dan A.; Whitwood, Adrian C.; Brammer, Lee; Perutz, Robin N. Self-complementary nickel halides enable multifaceted comparisons of intermolecular halogen bonds: fluoride ligands <i>vs.</i> other halides. Chemical science, 2018, 9, 3767-3781 |
| 1549111 | CIF | C18 H30 F4 I2 Ni P2 | C m c 21 | 12.6196; 14.8011; 13.2994 90; 90; 90 | 2484.11 | Thangavadivale, Vargini; Aguiar, Pedro M.; Jasim, Naseralla A.; Pike, Sarah J.; Smith, Dan A.; Whitwood, Adrian C.; Brammer, Lee; Perutz, Robin N. Self-complementary nickel halides enable multifaceted comparisons of intermolecular halogen bonds: fluoride ligands <i>vs.</i> other halides. Chemical science, 2018, 9, 3767-3781 |
| 1549112 | CIF | C18 H30 F4 I2 Ni P2 | P b c a | 14.0519; 14.4485; 24.3473 90; 90; 90 | 4943.2 | Thangavadivale, Vargini; Aguiar, Pedro M.; Jasim, Naseralla A.; Pike, Sarah J.; Smith, Dan A.; Whitwood, Adrian C.; Brammer, Lee; Perutz, Robin N. Self-complementary nickel halides enable multifaceted comparisons of intermolecular halogen bonds: fluoride ligands <i>vs.</i> other halides. Chemical science, 2018, 9, 3767-3781 |
| 1549113 | CIF | C18 H30 F4 I2 Ni P2 | P 1 21/c 1 | 9.9032; 16.1922; 15.2884 90; 93.913; 90 | 2445.85 | Thangavadivale, Vargini; Aguiar, Pedro M.; Jasim, Naseralla A.; Pike, Sarah J.; Smith, Dan A.; Whitwood, Adrian C.; Brammer, Lee; Perutz, Robin N. Self-complementary nickel halides enable multifaceted comparisons of intermolecular halogen bonds: fluoride ligands <i>vs.</i> other halides. Chemical science, 2018, 9, 3767-3781 |
| 1549114 | CIF | C18 H30 F5 I Ni P2 | P 1 21 1 | 9.4116; 12.701; 9.727 90; 95.377; 90 | 1157.62 | Thangavadivale, Vargini; Aguiar, Pedro M.; Jasim, Naseralla A.; Pike, Sarah J.; Smith, Dan A.; Whitwood, Adrian C.; Brammer, Lee; Perutz, Robin N. Self-complementary nickel halides enable multifaceted comparisons of intermolecular halogen bonds: fluoride ligands <i>vs.</i> other halides. Chemical science, 2018, 9, 3767-3781 |
| 1549115 | CIF | C18 H30 F5 I Ni P2 | I 1 2 1 | 7.892; 11.3325; 12.9439 90; 94.434; 90 | 1154.19 | Thangavadivale, Vargini; Aguiar, Pedro M.; Jasim, Naseralla A.; Pike, Sarah J.; Smith, Dan A.; Whitwood, Adrian C.; Brammer, Lee; Perutz, Robin N. Self-complementary nickel halides enable multifaceted comparisons of intermolecular halogen bonds: fluoride ligands <i>vs.</i> other halides. Chemical science, 2018, 9, 3767-3781 |
| 1549116 | CIF | C18 H30 Cl F4 I Ni P2 | P 1 21/c 1 | 9.95341; 16.0611; 15.04577 90; 97.0034; 90 | 2387.31 | Thangavadivale, Vargini; Aguiar, Pedro M.; Jasim, Naseralla A.; Pike, Sarah J.; Smith, Dan A.; Whitwood, Adrian C.; Brammer, Lee; Perutz, Robin N. Self-complementary nickel halides enable multifaceted comparisons of intermolecular halogen bonds: fluoride ligands <i>vs.</i> other halides. Chemical science, 2018, 9, 3767-3781 |
| 1549117 | CIF | C18 H30 Br F4 I Ni P2 | P 1 21/c 1 | 9.95422; 16.0712; 15.0877 90; 95.7803; 90 | 2401.4 | Thangavadivale, Vargini; Aguiar, Pedro M.; Jasim, Naseralla A.; Pike, Sarah J.; Smith, Dan A.; Whitwood, Adrian C.; Brammer, Lee; Perutz, Robin N. Self-complementary nickel halides enable multifaceted comparisons of intermolecular halogen bonds: fluoride ligands <i>vs.</i> other halides. Chemical science, 2018, 9, 3767-3781 |
| 1549118 | CIF | C18 H30 F5 I Ni P2 | C 1 c 1 | 17.1652; 8.5185; 16.935 90; 96.803; 90 | 2458.8 | Thangavadivale, Vargini; Aguiar, Pedro M.; Jasim, Naseralla A.; Pike, Sarah J.; Smith, Dan A.; Whitwood, Adrian C.; Brammer, Lee; Perutz, Robin N. Self-complementary nickel halides enable multifaceted comparisons of intermolecular halogen bonds: fluoride ligands <i>vs.</i> other halides. Chemical science, 2018, 9, 3767-3781 |
| 1549119 | CIF | C18 H30 Cl F4 I Ni P2 | P 1 21 1 | 9.2736; 13.2118; 9.817 90; 95.22; 90 | 1197.8 | Thangavadivale, Vargini; Aguiar, Pedro M.; Jasim, Naseralla A.; Pike, Sarah J.; Smith, Dan A.; Whitwood, Adrian C.; Brammer, Lee; Perutz, Robin N. Self-complementary nickel halides enable multifaceted comparisons of intermolecular halogen bonds: fluoride ligands <i>vs.</i> other halides. Chemical science, 2018, 9, 3767-3781 |
| 1549120 | CIF | C26 H30 F4 I2 Ni P2 | P -1 | 7.8141; 12.9211; 14.7784 76.749; 79.7; 76.748 | 1401.12 | Thangavadivale, Vargini; Aguiar, Pedro M.; Jasim, Naseralla A.; Pike, Sarah J.; Smith, Dan A.; Whitwood, Adrian C.; Brammer, Lee; Perutz, Robin N. Self-complementary nickel halides enable multifaceted comparisons of intermolecular halogen bonds: fluoride ligands <i>vs.</i> other halides. Chemical science, 2018, 9, 3767-3781 |
| 1549121 | CIF | C18 H30 F4 I2 Ni P2 | P 1 21/c 1 | 12.19004; 28.0191; 14.2344 90; 91.6129; 90 | 4859.89 | Thangavadivale, Vargini; Aguiar, Pedro M.; Jasim, Naseralla A.; Pike, Sarah J.; Smith, Dan A.; Whitwood, Adrian C.; Brammer, Lee; Perutz, Robin N. Self-complementary nickel halides enable multifaceted comparisons of intermolecular halogen bonds: fluoride ligands <i>vs.</i> other halides. Chemical science, 2018, 9, 3767-3781 |
| 1549122 | CIF | C69 H54 Fe N6 O4 P2 | P 1 21/c 1 | 17.9956; 14.2843; 23.6299 90; 111.37; 90 | 5656.57 | Lim, Jia Hui; Engelmann, Xenia; Corby, Sacha; Ganguly, Rakesh; Ray, Kallol; Soo, Han Sen C-H activation and nucleophilic substitution in a photochemically generated high valent iron complex. Chemical science, 2018, 9, 3992-4002 |
| 1549123 | CIF | C62 H34 F12 Fe N6 P2 | F d d 2 | 27.5449; 55.4159; 10.2412 90; 90; 90 | 15632 | Brandl, Thomas; Hoffmann, Viktor; Pannwitz, Andrea; Häussinger, Daniel; Neuburger, Markus; Fuhr, Olaf; Bernhard, Stefan; Wenger, Oliver S.; Mayor, Marcel Chiral macrocyclic terpyridine complexes. Chemical science, 2018, 9, 3837-3843 |
| 1549124 | CIF | C66 H44 F12 N6 O P2 Ru | P -4 21 c | 16.392; 16.392; 21.9038 90; 90; 90 | 5885.5 | Brandl, Thomas; Hoffmann, Viktor; Pannwitz, Andrea; Häussinger, Daniel; Neuburger, Markus; Fuhr, Olaf; Bernhard, Stefan; Wenger, Oliver S.; Mayor, Marcel Chiral macrocyclic terpyridine complexes. Chemical science, 2018, 9, 3837-3843 |
| 1549125 | CIF HKL Paper | C16 H12 N2 O | P -1 | 4.0205; 11.316; 13.781 85.067; 88.517; 84.335 | 621.5 | Umezono, Satoru; Okuno, Tsunehisa 5-[Phenyl(pyridin-4-yl)amino]penta-2,4-diyn-1-ol IUCrData, 2018, 3, x180454 |
| 1549126 | CIF HKL | C20 H20 N2 O2 | P 1 21/c 1 | 15.6203; 8.6349; 13.9758 90; 108.948; 90 | 1782.9 | Yousufuddin, Muhammed; Morales, Ruth; Cassis, Waleed; Brown, Gary W.; Singh, Ravi P.; Lovely, Carl J. [1,4-Bis(4-methoxyphenyl)but-3-yn-2-yl](cyano)methylamine IUCrData, 2018, 3, x180389 |
| 1549127 | CIF HKL Paper | C33 H40 N4 O9 S3 | P -1 | 10.5058; 12.8929; 14.0425 80.187; 73.218; 89.188 | 1793.17 | Amirthakumar, C.; Pandi, P.; Kumar, R. Mohan; Chakkaravarthi, G. 2-Aminoanilinium benzene-1,2-diaminium tris(4-methylbenzene-1-sulfonate) IUCrData, 2018, 3, x180437 |
| 1549128 | CIF HKL Paper | C37 H28 Br Cl N8 S | P 1 21/n 1 | 10.4422; 13.3065; 24.0683 90; 90.181; 90 | 3344.25 | El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Khidre, Rizk E.; Mostafa, Mohamed S.; Hegazy, Amany S.; Kariuki, Benson M. 4-(4-Bromophenyl)-2-(3-(4-chlorophenyl)-5-{3-[5-methyl-1-(4-methylphenyl)-1<i>H</i>-1,2,3-triazol-4-yl]-1-phenyl-1<i>H</i>-pyrazol-4-yl}-4,5-dihydro-1<i>H</i>-pyrazol-1-yl)-1,3-thiazole IUCrData, 2018, 3, x180443 |
| 1549129 | CIF HKL Paper | C2 H6 Ni O6 | P 1 21/c 1 | 8.5806; 7.0202; 9.2257 90; 97.551; 90 | 550.91 | Weil, Matthias Redetermination of nickel(II) formate dihydrate IUCrData, 2018, 3, x180428 |
| 1549130 | CIF HKL Paper | C6 H5 F N2 O2 | P 1 21/n 1 | 12.1967; 3.7559; 14.4539 90; 102.143; 90 | 647.31 | Moorthy, K.; NizamMohideen, M.; Vetrivel, S.; Vinoth, E.; Arun, A. 2-Fluoro-5-nitroaniline IUCrData, 2018, 3, x180425 |
| 1549131 | CIF HKL Paper | C37 H28 Br2 N8 S | P 1 21/n 1 | 10.3624; 13.5082; 24.0262 90; 90.457; 90 | 3363.02 | El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Khidre, Rizk E.; Mostafa, Mohamed S.; Hegazy, Amany S.; Kariuki, Benson M. 4-(4-Bromophenyl)-2-(3-(4-bromophenyl)-5-{3-[5-methyl-1-(4-methylphenyl)-1<i>H</i>-1,2,3-triazol-4-yl]-1-phenyl-1<i>H</i>-pyrazol-4-yl}-4,5-dihydro-1<i>H</i>-pyrazol-1-yl)-1,3-thiazole IUCrData, 2018, 3, x180449 |
| 1549132 | CIF | Cd O4 W | I 41/a :2 | 5.159; 5.159; 11.169 90; 90; 90 | 297.266 | Eranjaneya, H.; Chandrappa, G. T. Selective synthesis of scheelite/wolframite CdWO4 nanoparticles: a mechanistic investigation of phase formation and property correlation Journal of Sol-Gel Science and Technology, 2018, 85, 585-594 |
| 1549133 | CIF | C23 H23 Au F6 N O Sb | P 21 21 21 | 6.6287; 16.4246; 21.5858 90; 90; 90 | 2350.1 | Serra, Jordi; Font, Pau; Sosa Carrizo, E. Daiann; Mallet-Ladeira, Sonia; Massou, Stéphane; Parella, Teodor; Miqueu, Karinne; Amgoune, Abderrahmane; Ribas, Xavi; Bourissou, Didier Cyclometalated gold(iii) complexes: noticeable differences between (N,C) and (P,C) ligands in migratory insertion. Chemical science, 2018, 9, 3932-3940 |
| 1549134 | CIF | C24 H22 Au Cl4 N | P -1 | 7.4651; 9.8244; 16.963 98.935; 91.454; 106.868 | 1172.83 | Serra, Jordi; Font, Pau; Sosa Carrizo, E. Daiann; Mallet-Ladeira, Sonia; Massou, Stéphane; Parella, Teodor; Miqueu, Karinne; Amgoune, Abderrahmane; Ribas, Xavi; Bourissou, Didier Cyclometalated gold(iii) complexes: noticeable differences between (N,C) and (P,C) ligands in migratory insertion. Chemical science, 2018, 9, 3932-3940 |
| 1549135 | CIF | C55 H62 N2 P2 | P 1 21/n 1 | 10.9502; 20.9614; 20.7528 90; 97.766; 90 | 4719.7 | Dhara, Debabrata; Kalita, Pankaj; Mondal, Subhadip; Narayanan, Ramakirushnan Suriya; Mote, Kaustubh R.; Huch, Volker; Zimmer, Michael; Yildiz, Cem B.; Scheschkewitz, David; Chandrasekhar, Vadapalli; Jana, Anukul Reactivity enhancement of a diphosphene by reversible N-heterocyclic carbene coordination. Chemical science, 2018, 9, 4235-4243 |
| 1549136 | CIF | C48 H52 P2 | P 1 21/c 1 | 8.3846; 21.347; 11.6195 90; 111.081; 90 | 1940.5 | Dhara, Debabrata; Kalita, Pankaj; Mondal, Subhadip; Narayanan, Ramakirushnan Suriya; Mote, Kaustubh R.; Huch, Volker; Zimmer, Michael; Yildiz, Cem B.; Scheschkewitz, David; Chandrasekhar, Vadapalli; Jana, Anukul Reactivity enhancement of a diphosphene by reversible N-heterocyclic carbene coordination. Chemical science, 2018, 9, 4235-4243 |
| 1549137 | CIF | C31 H37 N2 P | P 1 21/c 1 | 8.304; 23.286; 13.9 90; 90.34; 90 | 2687.8 | Dhara, Debabrata; Kalita, Pankaj; Mondal, Subhadip; Narayanan, Ramakirushnan Suriya; Mote, Kaustubh R.; Huch, Volker; Zimmer, Michael; Yildiz, Cem B.; Scheschkewitz, David; Chandrasekhar, Vadapalli; Jana, Anukul Reactivity enhancement of a diphosphene by reversible N-heterocyclic carbene coordination. Chemical science, 2018, 9, 4235-4243 |
| 1549138 | CIF | C48 H52 O P2 | P b c a | 16.9466; 20.6986; 23.0289 90; 90; 90 | 8077.9 | Dhara, Debabrata; Kalita, Pankaj; Mondal, Subhadip; Narayanan, Ramakirushnan Suriya; Mote, Kaustubh R.; Huch, Volker; Zimmer, Michael; Yildiz, Cem B.; Scheschkewitz, David; Chandrasekhar, Vadapalli; Jana, Anukul Reactivity enhancement of a diphosphene by reversible N-heterocyclic carbene coordination. Chemical science, 2018, 9, 4235-4243 |
| 1549139 | CIF | C55 H64 N2 O P2 | P 1 21/n 1 | 16.228; 16.3739; 17.6769 90; 93.71; 90 | 4687.2 | Dhara, Debabrata; Kalita, Pankaj; Mondal, Subhadip; Narayanan, Ramakirushnan Suriya; Mote, Kaustubh R.; Huch, Volker; Zimmer, Michael; Yildiz, Cem B.; Scheschkewitz, David; Chandrasekhar, Vadapalli; Jana, Anukul Reactivity enhancement of a diphosphene by reversible N-heterocyclic carbene coordination. Chemical science, 2018, 9, 4235-4243 |
| 1549140 | CIF | C65 H42 F6 N4 O11 | P -1 | 10.6269; 14.921; 17.4851 108.065; 102.085; 91.766 | 2563.72 | Shaw, John S.; Vaiyapuri, Rajendran; Parker, Matthew P.; Murray, Claire A.; Lim, Kate J. C.; Pan, Cong; Knappert, Marcus; Cardin, Christine J.; Greenland, Barnaby W.; Grau-Crespo, Ricardo; Colquhoun, Howard M. Elements of fractal geometry in the <sup>1</sup>H NMR spectrum of a copolymer intercalation-complex: identification of the underlying Cantor set. Chemical science, 2018, 9, 4052-4061 |
| 1549141 | CIF | C34 H37 B N2 | P 1 21/c 1 | 22.653; 8.3251; 15.2916 90; 107.682; 90 | 2747.6 | Shi, Yong-Gang; Mellerup, Soren K.; Yuan, Kang; Hu, Guo-Fei; Sauriol, Francoise; Peng, Tai; Wang, Nan; Chen, Pangkuan; Wang, Suning Stabilising fleeting intermediates of stilbene photocyclization with amino-borane functionalisation: the rare isolation of persistent dihydrophenanthrenes and their [1,5] H-shift isomers. Chemical science, 2018, 9, 3844-3855 |
| 1549142 | CIF | C32 H36 B N S | P 1 21/c 1 | 7.925; 21.8524; 16.0075 90; 98.766; 90 | 2739.8 | Shi, Yong-Gang; Mellerup, Soren K.; Yuan, Kang; Hu, Guo-Fei; Sauriol, Francoise; Peng, Tai; Wang, Nan; Chen, Pangkuan; Wang, Suning Stabilising fleeting intermediates of stilbene photocyclization with amino-borane functionalisation: the rare isolation of persistent dihydrophenanthrenes and their [1,5] H-shift isomers. Chemical science, 2018, 9, 3844-3855 |
| 1549143 | CIF | C34 H39 B N2 | P -1 | 10.294; 11.896; 13.128 66.239; 88.621; 75.243 | 1417.2 | Shi, Yong-Gang; Mellerup, Soren K.; Yuan, Kang; Hu, Guo-Fei; Sauriol, Francoise; Peng, Tai; Wang, Nan; Chen, Pangkuan; Wang, Suning Stabilising fleeting intermediates of stilbene photocyclization with amino-borane functionalisation: the rare isolation of persistent dihydrophenanthrenes and their [1,5] H-shift isomers. Chemical science, 2018, 9, 3844-3855 |
| 1549144 | CIF | C34 H39 B N2 | P 1 21/n 1 | 8.41; 34.22; 10.14 90; 97.87; 90 | 2891 | Shi, Yong-Gang; Mellerup, Soren K.; Yuan, Kang; Hu, Guo-Fei; Sauriol, Francoise; Peng, Tai; Wang, Nan; Chen, Pangkuan; Wang, Suning Stabilising fleeting intermediates of stilbene photocyclization with amino-borane functionalisation: the rare isolation of persistent dihydrophenanthrenes and their [1,5] H-shift isomers. Chemical science, 2018, 9, 3844-3855 |
| 1549145 | CIF | C32 H36 B N S | P 1 21/c 1 | 7.9779; 21.8456; 15.7662 90; 98.411; 90 | 2718.2 | Shi, Yong-Gang; Mellerup, Soren K.; Yuan, Kang; Hu, Guo-Fei; Sauriol, Francoise; Peng, Tai; Wang, Nan; Chen, Pangkuan; Wang, Suning Stabilising fleeting intermediates of stilbene photocyclization with amino-borane functionalisation: the rare isolation of persistent dihydrophenanthrenes and their [1,5] H-shift isomers. Chemical science, 2018, 9, 3844-3855 |
| 1549146 | CIF | C35 H40 B N O | P 1 21/c 1 | 7.2959; 22.3592; 17.984 90; 92.626; 90 | 2930.7 | Shi, Yong-Gang; Mellerup, Soren K.; Yuan, Kang; Hu, Guo-Fei; Sauriol, Francoise; Peng, Tai; Wang, Nan; Chen, Pangkuan; Wang, Suning Stabilising fleeting intermediates of stilbene photocyclization with amino-borane functionalisation: the rare isolation of persistent dihydrophenanthrenes and their [1,5] H-shift isomers. Chemical science, 2018, 9, 3844-3855 |
| 1549147 | CIF | C39 H43 B N2 | P -1 | 8.1029; 11.3778; 18.5298 87.821; 85.222; 71.032 | 1609.84 | Shi, Yong-Gang; Mellerup, Soren K.; Yuan, Kang; Hu, Guo-Fei; Sauriol, Francoise; Peng, Tai; Wang, Nan; Chen, Pangkuan; Wang, Suning Stabilising fleeting intermediates of stilbene photocyclization with amino-borane functionalisation: the rare isolation of persistent dihydrophenanthrenes and their [1,5] H-shift isomers. Chemical science, 2018, 9, 3844-3855 |
| 1549148 | CIF | C32 H34 B N S | P n a 21 | 32.54; 9.129; 9.286 90; 90; 90 | 2758 | Shi, Yong-Gang; Mellerup, Soren K.; Yuan, Kang; Hu, Guo-Fei; Sauriol, Francoise; Peng, Tai; Wang, Nan; Chen, Pangkuan; Wang, Suning Stabilising fleeting intermediates of stilbene photocyclization with amino-borane functionalisation: the rare isolation of persistent dihydrophenanthrenes and their [1,5] H-shift isomers. Chemical science, 2018, 9, 3844-3855 |
| 1549149 | CIF | C34 H38 B N | P -1 | 7.868; 12.043; 16.695 69.575; 77.359; 76.219 | 1423.7 | Shi, Yong-Gang; Mellerup, Soren K.; Yuan, Kang; Hu, Guo-Fei; Sauriol, Francoise; Peng, Tai; Wang, Nan; Chen, Pangkuan; Wang, Suning Stabilising fleeting intermediates of stilbene photocyclization with amino-borane functionalisation: the rare isolation of persistent dihydrophenanthrenes and their [1,5] H-shift isomers. Chemical science, 2018, 9, 3844-3855 |
| 1549150 | CIF | C45 H49 B N2 | P -1 | 11.4473; 11.8684; 15.9919 94.282; 106.166; 114.679 | 1850.2 | Shi, Yong-Gang; Mellerup, Soren K.; Yuan, Kang; Hu, Guo-Fei; Sauriol, Francoise; Peng, Tai; Wang, Nan; Chen, Pangkuan; Wang, Suning Stabilising fleeting intermediates of stilbene photocyclization with amino-borane functionalisation: the rare isolation of persistent dihydrophenanthrenes and their [1,5] H-shift isomers. Chemical science, 2018, 9, 3844-3855 |
| 1549151 | CIF | C33 H35 B N2 | P 1 21/c 1 | 22.112; 8.318; 15.429 90; 110.321; 90 | 2661.2 | Shi, Yong-Gang; Mellerup, Soren K.; Yuan, Kang; Hu, Guo-Fei; Sauriol, Francoise; Peng, Tai; Wang, Nan; Chen, Pangkuan; Wang, Suning Stabilising fleeting intermediates of stilbene photocyclization with amino-borane functionalisation: the rare isolation of persistent dihydrophenanthrenes and their [1,5] H-shift isomers. Chemical science, 2018, 9, 3844-3855 |
| 1549152 | CIF | C31 H32 B N | P 1 21/c 1 | 11.8634; 11.878; 18.2134 90; 92.179; 90 | 2564.7 | Shi, Yong-Gang; Mellerup, Soren K.; Yuan, Kang; Hu, Guo-Fei; Sauriol, Francoise; Peng, Tai; Wang, Nan; Chen, Pangkuan; Wang, Suning Stabilising fleeting intermediates of stilbene photocyclization with amino-borane functionalisation: the rare isolation of persistent dihydrophenanthrenes and their [1,5] H-shift isomers. Chemical science, 2018, 9, 3844-3855 |
| 1549153 | CIF | C9 H19 B10 N | P -1 | 7.3461; 7.8073; 12.765 81.469; 78.051; 86.599 | 708 | Zhang, Xiaolei; Yan, Hong Pd(ii)-catalyzed synthesis of bifunctionalized carboranes <i>via</i> cage B-H activation of 1-CH<sub>2</sub>NH<sub>2</sub>-<i>o</i>-carboranes. Chemical science, 2018, 9, 3964-3969 |
| 1549154 | CIF | C21 H21 B10 Br2 N | P 1 21/n 1 | 12.4232; 14.9794; 13.9157 90; 109.509; 90 | 2440.93 | Zhang, Xiaolei; Yan, Hong Pd(ii)-catalyzed synthesis of bifunctionalized carboranes <i>via</i> cage B-H activation of 1-CH<sub>2</sub>NH<sub>2</sub>-<i>o</i>-carboranes. Chemical science, 2018, 9, 3964-3969 |
| 1549155 | CIF | C23 H26 B10 F3 N O | P 1 21/n 1 | 18.1161; 8.1173; 18.6508 90; 113.681; 90 | 2511.7 | Zhang, Xiaolei; Yan, Hong Pd(ii)-catalyzed synthesis of bifunctionalized carboranes <i>via</i> cage B-H activation of 1-CH<sub>2</sub>NH<sub>2</sub>-<i>o</i>-carboranes. Chemical science, 2018, 9, 3964-3969 |
| 1549156 | CIF | C25 H35 B10 N | P 21 21 21 | 8.0494; 15.8108; 20.486 90; 90; 90 | 2607.2 | Zhang, Xiaolei; Yan, Hong Pd(ii)-catalyzed synthesis of bifunctionalized carboranes <i>via</i> cage B-H activation of 1-CH<sub>2</sub>NH<sub>2</sub>-<i>o</i>-carboranes. Chemical science, 2018, 9, 3964-3969 |
| 1549157 | CIF | C21 H28 B10 N2 O2 S | P -1 | 7.7385; 10.4142; 15.9824 92.169; 102.976; 99.951 | 1232.3 | Zhang, Xiaolei; Yan, Hong Pd(ii)-catalyzed synthesis of bifunctionalized carboranes <i>via</i> cage B-H activation of 1-CH<sub>2</sub>NH<sub>2</sub>-<i>o</i>-carboranes. Chemical science, 2018, 9, 3964-3969 |
| 1549158 | CIF | C34 H35 B10 N O P Pd | P 1 21/c 1 | 10.5093; 22.2105; 15.7027 90; 105.021; 90 | 3540 | Zhang, Xiaolei; Yan, Hong Pd(ii)-catalyzed synthesis of bifunctionalized carboranes <i>via</i> cage B-H activation of 1-CH<sub>2</sub>NH<sub>2</sub>-<i>o</i>-carboranes. Chemical science, 2018, 9, 3964-3969 |
| 1549159 | CIF | C25 H40 B20 N2 O Pd | P 1 21/c 1 | 14.4456; 13.2757; 19.9354 90; 90.292; 90 | 3823.1 | Zhang, Xiaolei; Yan, Hong Pd(ii)-catalyzed synthesis of bifunctionalized carboranes <i>via</i> cage B-H activation of 1-CH<sub>2</sub>NH<sub>2</sub>-<i>o</i>-carboranes. Chemical science, 2018, 9, 3964-3969 |
| 1549160 | CIF | C19 H31 B10 N | C 1 2/c 1 | 17.6118; 12.1001; 20.3538 90; 94.094; 90 | 4326.4 | Zhang, Xiaolei; Yan, Hong Pd(ii)-catalyzed synthesis of bifunctionalized carboranes <i>via</i> cage B-H activation of 1-CH<sub>2</sub>NH<sub>2</sub>-<i>o</i>-carboranes. Chemical science, 2018, 9, 3964-3969 |
| 1549161 | CIF Paper | C20 H24 N2 O10 Zn2 | P n n m | 7.4159; 19.318; 7.3457 90; 90; 90 | 1052.3 | Zorina-Tikhonova, Ekaterina N.; Chistyakov, Aleksandr S.; Kiskin, Mikhail A.; Sidorov, Aleksei A.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Voronova, Eugenia D.; Godovikov, Ivan A.; Korlyukov, Alexander A.; Eremenko, Igor L.; Vologzhanina, Anna V. Exploitation of knowledge databases in the synthesis of zinc(II) malonates with photo-sensitive and photo-insensitive <i>N</i>,<i>N</i>'-containing linkers IUCrJ, 2018, 5 |
| 1549162 | CIF | C17 H18 N2 O5 Zn | P 1 21/c 1 | 8.2852; 10.4999; 21.684 90; 117.282; 90 | 1676.5 | Zorina-Tikhonova, Ekaterina N.; Chistyakov, Aleksandr S.; Kiskin, Mikhail A.; Sidorov, Aleksei A.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Voronova, Eugenia D.; Godovikov, Ivan A.; Korlyukov, Alexander A.; Eremenko, Igor L.; Vologzhanina, Anna V. Exploitation of knowledge databases in the synthesis of zinc(II) malonates with photo-sensitive and photo-insensitive <i>N</i>,<i>N</i>'-containing linkers IUCrJ, 2018, 5 |
| 1549163 | CIF | C17 H17 N2 O4.25 Zn | P n n a | 8.3; 10.4; 19.74 90; 90; 90 | 1704 | Zorina-Tikhonova, Ekaterina N.; Chistyakov, Aleksandr S.; Kiskin, Mikhail A.; Sidorov, Aleksei A.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Voronova, Eugenia D.; Godovikov, Ivan A.; Korlyukov, Alexander A.; Eremenko, Igor L.; Vologzhanina, Anna V. Exploitation of knowledge databases in the synthesis of zinc(II) malonates with photo-sensitive and photo-insensitive <i>N</i>,<i>N</i>'-containing linkers IUCrJ, 2018, 5 |
| 1549164 | CIF | C22 H24 N2 O8 Zn | C 1 2/c 1 | 18.0211; 5.8795; 21.7192 90; 113.89; 90 | 2104.1 | Zorina-Tikhonova, Ekaterina N.; Chistyakov, Aleksandr S.; Kiskin, Mikhail A.; Sidorov, Aleksei A.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Voronova, Eugenia D.; Godovikov, Ivan A.; Korlyukov, Alexander A.; Eremenko, Igor L.; Vologzhanina, Anna V. Exploitation of knowledge databases in the synthesis of zinc(II) malonates with photo-sensitive and photo-insensitive <i>N</i>,<i>N</i>'-containing linkers IUCrJ, 2018, 5 |
| 1549165 | CIF | C17 H20 N2 O5 Zn | P 1 21/c 1 | 8.4434; 10.3811; 21.551 90; 115.928; 90 | 1698.8 | Zorina-Tikhonova, Ekaterina N.; Chistyakov, Aleksandr S.; Kiskin, Mikhail A.; Sidorov, Aleksei A.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Voronova, Eugenia D.; Godovikov, Ivan A.; Korlyukov, Alexander A.; Eremenko, Igor L.; Vologzhanina, Anna V. Exploitation of knowledge databases in the synthesis of zinc(II) malonates with photo-sensitive and photo-insensitive <i>N</i>,<i>N</i>'-containing linkers IUCrJ, 2018, 5 |
| 1549166 | CIF | C22 H24 N3 O5 Zn | P 1 21/c 1 | 11.1832; 8.2422; 23.832 90; 99.143; 90 | 2168.8 | Zorina-Tikhonova, Ekaterina N.; Chistyakov, Aleksandr S.; Kiskin, Mikhail A.; Sidorov, Aleksei A.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Voronova, Eugenia D.; Godovikov, Ivan A.; Korlyukov, Alexander A.; Eremenko, Igor L.; Vologzhanina, Anna V. Exploitation of knowledge databases in the synthesis of zinc(II) malonates with photo-sensitive and photo-insensitive <i>N</i>,<i>N</i>'-containing linkers IUCrJ, 2018, 5 |
| 1549167 | CIF | C34 H50 N4 O14 Zn | C 1 2/c 1 | 22.6008; 11.4154; 17.1552 90; 120.308; 90 | 3821.1 | Zorina-Tikhonova, Ekaterina N.; Chistyakov, Aleksandr S.; Kiskin, Mikhail A.; Sidorov, Aleksei A.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Voronova, Eugenia D.; Godovikov, Ivan A.; Korlyukov, Alexander A.; Eremenko, Igor L.; Vologzhanina, Anna V. Exploitation of knowledge databases in the synthesis of zinc(II) malonates with photo-sensitive and photo-insensitive <i>N</i>,<i>N</i>'-containing linkers IUCrJ, 2018, 5 |
| 1549168 | CIF | C22 H22.5 N2.5 O4 Zn | C m c m | 9.8266; 22.0654; 22.1641 90; 90; 90 | 4805.8 | Zorina-Tikhonova, Ekaterina N.; Chistyakov, Aleksandr S.; Kiskin, Mikhail A.; Sidorov, Aleksei A.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Voronova, Eugenia D.; Godovikov, Ivan A.; Korlyukov, Alexander A.; Eremenko, Igor L.; Vologzhanina, Anna V. Exploitation of knowledge databases in the synthesis of zinc(II) malonates with photo-sensitive and photo-insensitive <i>N</i>,<i>N</i>'-containing linkers IUCrJ, 2018, 5 |
| 1549169 | CIF | C22 H22.5 N2.5 O4 Zn | P b c n | 9.845; 22.082; 21.905 90; 90; 90 | 4762 | Zorina-Tikhonova, Ekaterina N.; Chistyakov, Aleksandr S.; Kiskin, Mikhail A.; Sidorov, Aleksei A.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Voronova, Eugenia D.; Godovikov, Ivan A.; Korlyukov, Alexander A.; Eremenko, Igor L.; Vologzhanina, Anna V. Exploitation of knowledge databases in the synthesis of zinc(II) malonates with photo-sensitive and photo-insensitive <i>N</i>,<i>N</i>'-containing linkers IUCrJ, 2018, 5 |
| 1549170 | CIF | C38 H48 N4 O12 Zn | C 1 2/m 1 | 22.881; 6.8976; 14.1573 90; 117.532; 90 | 1981.3 | Zorina-Tikhonova, Ekaterina N.; Chistyakov, Aleksandr S.; Kiskin, Mikhail A.; Sidorov, Aleksei A.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Voronova, Eugenia D.; Godovikov, Ivan A.; Korlyukov, Alexander A.; Eremenko, Igor L.; Vologzhanina, Anna V. Exploitation of knowledge databases in the synthesis of zinc(II) malonates with photo-sensitive and photo-insensitive <i>N</i>,<i>N</i>'-containing linkers IUCrJ, 2018, 5 |
| 1549171 | CIF | C38 H48 N4 O12 Zn | C 1 2/c 1 | 26.8028; 6.8933; 23.069 90; 110.021; 90 | 4004.6 | Zorina-Tikhonova, Ekaterina N.; Chistyakov, Aleksandr S.; Kiskin, Mikhail A.; Sidorov, Aleksei A.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Voronova, Eugenia D.; Godovikov, Ivan A.; Korlyukov, Alexander A.; Eremenko, Igor L.; Vologzhanina, Anna V. Exploitation of knowledge databases in the synthesis of zinc(II) malonates with photo-sensitive and photo-insensitive <i>N</i>,<i>N</i>'-containing linkers IUCrJ, 2018, 5 |
| 1549172 | CIF | C19 H22.75 N2 O4.38 Zn | C 2 2 21 | 24.662; 37.18; 8.7826 90; 90; 90 | 8053.1 | Zorina-Tikhonova, Ekaterina N.; Chistyakov, Aleksandr S.; Kiskin, Mikhail A.; Sidorov, Aleksei A.; Dorovatovskii, Pavel V.; Zubavichus, Yan V.; Voronova, Eugenia D.; Godovikov, Ivan A.; Korlyukov, Alexander A.; Eremenko, Igor L.; Vologzhanina, Anna V. Exploitation of knowledge databases in the synthesis of zinc(II) malonates with photo-sensitive and photo-insensitive <i>N</i>,<i>N</i>'-containing linkers IUCrJ, 2018, 5 |
| 1549173 | CIF HKL Paper | C8 H5 Cl N2 Se | P 1 21/c 1 | 10.3353; 14.0058; 5.954 90; 97.32; 90 | 854.84 | Ravichandran, K.; Ranjith, S.; Sankari, S.; Beemarao, M.; Ponnuswamy, M. N. 4-(4-Chlorophenyl)-1,2,3-selenadiazole IUCrData, 2018, 3, x180462 |
| 1549174 | CIF HKL Paper | C14 H13 N O | P 1 21/n 1 | 4.6976; 19.3656; 12.3116 90; 95.831; 90 | 1114.21 | Swetha, G.; Ida Malarselvi, R.; Ramachandra Raja, C.; Thiruvalluvar, A.; Priscilla, J. (<i>E</i>)-4-Methyl-2-(<i>N</i>-phenylcarboximidoyl)phenol IUCrData, 2018, 3, x180464 |
| 1549175 | CIF | C12 H8 S3 | P 1 21/n 1 | 43.822; 5.689; 48.331 90; 106.79; 90 | 11535 | Resel, Roland; Jones, Andrew O. F.; Schweicher, Guillaume; Fischer, Roland; Demitri, Nicola; Geerts, Yves Henri Polymorphism of terthiophene with surface confinement IUCrJ, 2018, 5 |
| 1549176 | CIF HKL Paper | C6 H6 N4 O | P -1 | 3.8342; 5.5701; 15.0346 93.396; 92.812; 92.361 | 319.83 | El Hafi, Mohamed; Lahmidi, Sanae; Boulhaoua, Mohammed; Ramli, Youssef; Essassi, El Mokhtar; Mague, Joel T. 1-Methyl-1<i>H</i>-pyrazolo[3,4-<i>d</i>]pyrimidin-4(5<i>H</i>)-one IUCrData, 2018, 3, x180483 |
| 1549177 | CIF HKL Paper | C21 H14 N6 | P 1 21/c 1 | 8.556; 8.982; 22.13 90; 98.28; 90 | 1683 | Wang, Jianwei; Yuan, Caixia 4-(1<i>H</i>-Indol-3-yl)-2,6-bis(pyrazin-2-yl)pyridine IUCrData, 2018, 3, x180492 |
| 1549178 | CIF HKL Paper | C17 H41 B Co N O P2 | P 1 21/n 1 | 8.0249; 27.32; 10.3546 90; 97.101; 90 | 2252.73 | Junge, Kathrin; Cingolani, Andrea; Spannenberg, Anke; Beller, Matthias {Bis[2-(diisopropylphosphanyl)ethyl]amine}carbonyl(tetrahydroborato)cobalt(I) IUCrData, 2018, 3, x180471 |
| 1549179 | CIF | C29 H17 Eu Na2 O14 S2 | P n m a | 26.6907; 22.7441; 5.7141 90; 90; 90 | 3468.8 | Wang, Xia; Wang, Yanlong; Silver, Mark A.; Gui, Daxiang; Bai, Zhuanling; Wang, Yaxing; Liu, Wei; Chen, Lanhua; Diwu, Juan; Chai, Zhifang; Wang, Shuao Superprotonic conduction through one-dimensional ordered alkali metal ion chains in a lanthanide-organic framework. Chemical communications (Cambridge, England), 2018, 54, 4429-4432 |
| 1549180 | CIF | C28 H24 N8 O6 Pb2 | P 1 21/c 1 | 7.4785; 21.4405; 9.022 90; 94.218; 90 | 1442.69 | Mahmoudi, Ghodrat; Seth, Saikat Kumar; Bauzá, Antonio; Zubkov, Fedor I.; Gurbanov, Atash V.; White, Jonathan; Stilinović, Vladimir; Doert, Thomas; Frontera, Antonio Pb⋯X (X = N, S, I) tetrel bonding interactions in Pb(ii) complexes: X-ray characterization, Hirshfeld surfaces and DFT calculations CrystEngComm, 2018, 20, 2812 |
| 1549181 | CIF | C16 H12 N6 O3 Pb2 S2 | P -1 | 8.5997; 10.9376; 11.7938 72.684; 80.451; 82.758 | 1040.9 | Mahmoudi, Ghodrat; Seth, Saikat Kumar; Bauzá, Antonio; Zubkov, Fedor I.; Gurbanov, Atash V.; White, Jonathan; Stilinović, Vladimir; Doert, Thomas; Frontera, Antonio Pb⋯X (X = N, S, I) tetrel bonding interactions in Pb(ii) complexes: X-ray characterization, Hirshfeld surfaces and DFT calculations CrystEngComm, 2018, 20, 2812 |
| 1549182 | CIF | C12 H10 I2 N4 O Pb | P -1 | 6.6742; 7.8985; 16.794 82.614; 81.44; 65.269 | 792.99 | Mahmoudi, Ghodrat; Seth, Saikat Kumar; Bauzá, Antonio; Zubkov, Fedor I.; Gurbanov, Atash V.; White, Jonathan; Stilinović, Vladimir; Doert, Thomas; Frontera, Antonio Pb⋯X (X = N, S, I) tetrel bonding interactions in Pb(ii) complexes: X-ray characterization, Hirshfeld surfaces and DFT calculations CrystEngComm, 2018, 20, 2812 |
| 1549183 | CIF | C28 H26 N10 O3 Pb S2 | P 1 21/c 1 | 15.4161; 13.7171; 14.9481 90; 94.944; 90 | 3149.23 | Mahmoudi, Ghodrat; Seth, Saikat Kumar; Bauzá, Antonio; Zubkov, Fedor I.; Gurbanov, Atash V.; White, Jonathan; Stilinović, Vladimir; Doert, Thomas; Frontera, Antonio Pb⋯X (X = N, S, I) tetrel bonding interactions in Pb(ii) complexes: X-ray characterization, Hirshfeld surfaces and DFT calculations CrystEngComm, 2018, 20, 2812 |
| 1549184 | CIF | C7 H15 I3 N2 Pb | P 63/m m c | 10.4821; 10.4821; 8.1053 90; 90; 120 | 771.25 | Xue, Chen; Yao, Zhi-Yuan; Zhang, Jin; Liu, Wen-Long; Liu, Jian-Lan; Ren, Xiao-Ming Extra thermo- and water-stable one-dimensional organic-inorganic hybrid perovskite [N-methyldabconium]PbI<sub>3</sub> showing switchable dielectric behaviour, conductivity and bright yellow-green emission. Chemical communications (Cambridge, England), 2018, 54, 4321-4324 |
| 1549185 | CIF | C7 H15 I3 N2 Pb | P b c a | 18.6221; 8.0211; 20.4046 90; 90; 90 | 3047.83 | Xue, Chen; Yao, Zhi-Yuan; Zhang, Jin; Liu, Wen-Long; Liu, Jian-Lan; Ren, Xiao-Ming Extra thermo- and water-stable one-dimensional organic-inorganic hybrid perovskite [N-methyldabconium]PbI<sub>3</sub> showing switchable dielectric behaviour, conductivity and bright yellow-green emission. Chemical communications (Cambridge, England), 2018, 54, 4321-4324 |
| 1549186 | CIF | C25 H20 F3 I2 N7 O3 S | P 1 21/c 1 | 14.2649; 8.5985; 22.85 90; 95.1; 90 | 2791.6 | Dreger, Alexander; Engelage, Elric; Mallick, Bert; Beer, Paul D.; Huber, Stefan M. The role of charge in 1,2,3-triazol(ium)-based halogen bonding activators. Chemical communications (Cambridge, England), 2018, 54, 4013-4016 |
| 1549187 | CIF | C33 H37 Br I2 N8 | P 1 21/c 1 | 15.479; 16.978; 13.102 90; 99.204; 90 | 3399 | Dreger, Alexander; Engelage, Elric; Mallick, Bert; Beer, Paul D.; Huber, Stefan M. The role of charge in 1,2,3-triazol(ium)-based halogen bonding activators. Chemical communications (Cambridge, England), 2018, 54, 4013-4016 |
| 1549188 | CIF | C62 H4 Br2 Cl2 | P 6/m m m | 10.056; 10.056; 10.07 90; 90; 120 | 881.9 | Ye, Jin; Barrio, Maria; Céolin, René; Qureshi, Navid; Negrier, Philippe; Rietveld, Ivo B.; Tamarit, Josep Lluís An order‒disorder phase transition in the van der Waals based solvate of C60 and CClBrH2 CrystEngComm, 2018, 20, 2729 |
| 1549189 | CIF | C62 H4 Br2 Cl2 | C 1 2/m 1 | 9.9153; 17.412; 10.0478 90; 101.966; 90 | 1697 | Ye, Jin; Barrio, Maria; Céolin, René; Qureshi, Navid; Negrier, Philippe; Rietveld, Ivo B.; Tamarit, Josep Lluís An order‒disorder phase transition in the van der Waals based solvate of C60 and CClBrH2 CrystEngComm, 2018, 20, 2729 |
| 1549190 | CIF | C8 H6 N2 Ni S8 | P 1 21/n 1 | 5.0234; 21.36; 7.1729 90; 106.652; 90 | 737.4 | Hachem, Hadi; Xu, Zijun; Bellec, Nathalie; Jeannin, Olivier; Auban-Senzier, Pascale; Guizouarn, Thierry; Fourmigué, Marc; Lorcy, Dominique Neutral, closed-shell nickel bis(2-alkylthio-thiazole-4,5-dithiolate) complexes as single component molecular conductors. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6580-6589 |
| 1549191 | CIF | C10 H10 N2 Ni S8 | P -1 | 6.6193; 4.0075; 15.4038 101.262; 87.941; 91.618 | 400.39 | Hachem, Hadi; Xu, Zijun; Bellec, Nathalie; Jeannin, Olivier; Auban-Senzier, Pascale; Guizouarn, Thierry; Fourmigué, Marc; Lorcy, Dominique Neutral, closed-shell nickel bis(2-alkylthio-thiazole-4,5-dithiolate) complexes as single component molecular conductors. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6580-6589 |
| 1549192 | CIF | C32 H26 N2 Ni P S8 | C 1 2/c 1 | 16.777; 7.5023; 27.66 90; 105.497; 90 | 3354.9 | Hachem, Hadi; Xu, Zijun; Bellec, Nathalie; Jeannin, Olivier; Auban-Senzier, Pascale; Guizouarn, Thierry; Fourmigué, Marc; Lorcy, Dominique Neutral, closed-shell nickel bis(2-alkylthio-thiazole-4,5-dithiolate) complexes as single component molecular conductors. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6580-6589 |
| 1549193 | CIF | C45 H46 N2 Ni P S8 | C 1 2/c 1 | 26.0877; 7.5048; 24.938 90; 113.474; 90 | 4478.4 | Hachem, Hadi; Xu, Zijun; Bellec, Nathalie; Jeannin, Olivier; Auban-Senzier, Pascale; Guizouarn, Thierry; Fourmigué, Marc; Lorcy, Dominique Neutral, closed-shell nickel bis(2-alkylthio-thiazole-4,5-dithiolate) complexes as single component molecular conductors. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6580-6589 |
| 1549194 | CIF | C38 H38 N2 Ni P S8 | C 1 2/c 1 | 28.7636; 7.3314; 23.4795 90; 124.372; 90 | 4086.7 | Hachem, Hadi; Xu, Zijun; Bellec, Nathalie; Jeannin, Olivier; Auban-Senzier, Pascale; Guizouarn, Thierry; Fourmigué, Marc; Lorcy, Dominique Neutral, closed-shell nickel bis(2-alkylthio-thiazole-4,5-dithiolate) complexes as single component molecular conductors. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6580-6589 |
| 1549195 | CIF | C34 H30 N2 Ni P S8 | C 1 2/c 1 | 19.574; 18.701; 9.943 90; 103.08; 90 | 3545.2 | Hachem, Hadi; Xu, Zijun; Bellec, Nathalie; Jeannin, Olivier; Auban-Senzier, Pascale; Guizouarn, Thierry; Fourmigué, Marc; Lorcy, Dominique Neutral, closed-shell nickel bis(2-alkylthio-thiazole-4,5-dithiolate) complexes as single component molecular conductors. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6580-6589 |
| 1549196 | CIF | C46 H42 N2 O6 | P -1 | 9.825; 14.738; 15.021 62.73; 78.35; 79.95 | 1885.1 | Ullmann, Steve; Schnorr, René; Laube, Christian; Abel, Bernd; Kersting, Berthold Photoluminescence properties of tetrahedral zinc(ii) complexes supported by calix[4]arene-based salicylaldiminato ligands. Dalton transactions (Cambridge, England : 2003), 2018, 47, 5801-5811 |
| 1549197 | CIF | C57 H74 N2 O8 Zn | P b c a | 13.9091; 26.4208; 28.6342 90; 90; 90 | 10522.8 | Ullmann, Steve; Schnorr, René; Laube, Christian; Abel, Bernd; Kersting, Berthold Photoluminescence properties of tetrahedral zinc(ii) complexes supported by calix[4]arene-based salicylaldiminato ligands. Dalton transactions (Cambridge, England : 2003), 2018, 47, 5801-5811 |
| 1549198 | CIF | C54 H48 N18 O15 Zn3 | C 1 2/c 1 | 16.1735; 12.0443; 31.096 90; 100.881; 90 | 5948.5 | Zhang, Ya-Qian; Blatov, Vladislav A.; Zheng, Tian-Rui; Yang, Chang-Hao; Qian, Lin-Lu; Li, Ke; Li, Bao-Long; Wu, Bing A luminescent zinc(ii) coordination polymer with unusual (3,4,4)-coordinated self-catenated 3D network for selective detection of nitroaromatics and ferric and chromate ions: a versatile luminescent sensor. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6189-6198 |
| 1549199 | CIF | C96 H76 Fe4 K4 N24 O11 | P 1 21 1 | 13.003; 26.767; 14.013 90; 103.41; 90 | 4744.3 | Singh, Alok Kumar; Pandey, Gajanan; Singh, Kaman; Kumar, Abhinav; Trivedi, Manoj; Singh, Vikram A ternary Fe(ii)-terpyridyl complex-based single platform for reversible multiple-ion recognition. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6386-6393 |
| 1549200 | CIF | C48 H40 B Cl N4 O Pt | P -1 | 7.8085; 15.6671; 17.1368 77.338; 89.736; 76.579 | 1987.25 | Maroń, Anna; Czerwińska, Katarzyna; Machura, Barbara; Raposo, Luis; Roma-Rodrigues, Catarina; Fernandes, Alexandra R.; Małecki, Jan G; Szlapa-Kula, Agata; Kula, Slawomir; Krompiec, Stanisław Spectroscopy, electrochemistry and antiproliferative properties of Au(iii), Pt(ii) and Cu(ii) complexes bearing modified 2,2':6',2''-terpyridine ligands. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6444-6463 |
| 1549201 | CIF | C26 H19 Au Cl F12 N3 O P2 | P 1 21/c 1 | 8.075; 21.7655; 17.4149 90; 93.847; 90 | 3053.9 | Maroń, Anna; Czerwińska, Katarzyna; Machura, Barbara; Raposo, Luis; Roma-Rodrigues, Catarina; Fernandes, Alexandra R.; Małecki, Jan G; Szlapa-Kula, Agata; Kula, Slawomir; Krompiec, Stanisław Spectroscopy, electrochemistry and antiproliferative properties of Au(iii), Pt(ii) and Cu(ii) complexes bearing modified 2,2':6',2''-terpyridine ligands. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6444-6463 |
| 1549202 | CIF | C27 H19 Cl F3 N3 O4 Pt S | P 1 21/c 1 | 11.8647; 14.5225; 15.1167 90; 94.526; 90 | 2596.6 | Maroń, Anna; Czerwińska, Katarzyna; Machura, Barbara; Raposo, Luis; Roma-Rodrigues, Catarina; Fernandes, Alexandra R.; Małecki, Jan G; Szlapa-Kula, Agata; Kula, Slawomir; Krompiec, Stanisław Spectroscopy, electrochemistry and antiproliferative properties of Au(iii), Pt(ii) and Cu(ii) complexes bearing modified 2,2':6',2''-terpyridine ligands. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6444-6463 |
| 1549203 | CIF | C24 H20 Au Cl F12 N4 O P2 | P 1 21/c 1 | 15.2102; 12.3174; 17.3958 90; 109.289; 90 | 3076.2 | Maroń, Anna; Czerwińska, Katarzyna; Machura, Barbara; Raposo, Luis; Roma-Rodrigues, Catarina; Fernandes, Alexandra R.; Małecki, Jan G; Szlapa-Kula, Agata; Kula, Slawomir; Krompiec, Stanisław Spectroscopy, electrochemistry and antiproliferative properties of Au(iii), Pt(ii) and Cu(ii) complexes bearing modified 2,2':6',2''-terpyridine ligands. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6444-6463 |
| 1549204 | CIF | C64 H50 Cl2 N13 O10 Zn2 | C 1 2/c 1 | 31.3887; 13.1644; 31.1914 90; 90.956; 90 | 12886.9 | Mawai, Kiran; Nathani, Sandip; Roy, Partha; Singh, U. P.; Ghosh, Kaushik Combined experimental and theoretical studies on selective sensing of zinc and pyrophosphate ions by rational design of compartmental chemosensor probe: Dual sensing behaviour via secondary recognition approach and cell imaging studies. Dalton transactions (Cambridge, England : 2003), 2018, 47, 6421-6434 |
| 1549205 | CIF | C26 H21 Cl N P Pt | P 1 21/c 1 | 16.0265; 18.9031; 14.5969 90; 107.211; 90 | 4224.1 | Samandar Sangari, Mozhgan; Golbon Haghighi, Mohsen; Nabavizadeh, S. Masoud; Pfitzner, Arno; Rashidi, Mehdi Influence of ancillary ligands on the photophysical properties of cyclometalated organoplatinum(ii) complexes New Journal of Chemistry, 2018, 42, 8661 |
| 1549206 | CIF | C28 H26 N P Pt | P 1 21/c 1 | 10.8604; 9.7288; 21.8042 90; 92.492; 90 | 2301.62 | Samandar Sangari, Mozhgan; Golbon Haghighi, Mohsen; Nabavizadeh, S. Masoud; Pfitzner, Arno; Rashidi, Mehdi Influence of ancillary ligands on the photophysical properties of cyclometalated organoplatinum(ii) complexes New Journal of Chemistry, 2018, 42, 8661 |
| 1549207 | CIF | C33 H28 N P Pt | P -1 | 10.8827; 11.0853; 11.3916 95.334; 100.076; 99.549 | 1323.75 | Samandar Sangari, Mozhgan; Golbon Haghighi, Mohsen; Nabavizadeh, S. Masoud; Pfitzner, Arno; Rashidi, Mehdi Influence of ancillary ligands on the photophysical properties of cyclometalated organoplatinum(ii) complexes New Journal of Chemistry, 2018, 42, 8661 |
| 1549208 | CIF | C9 H16 O5 S | P 1 21 1 | 7.7445; 7.536; 9.9477 90; 92.123; 90 | 580.17 | Pisareva, A. V.; Shilov, G. V.; Karelin, A. I.; Pisarev, R. V.; Shilova, I. A.; Dobrovolsky, Yu A.; Aldoshin, S. M. Synthesis, structure and proton conductivity of 2,4,5-trimethylbenzenesulfonic acid dihydrate New Journal of Chemistry, 2018, 42, 7428 |
| 1549209 | CIF | C56 H66 Fe2 N6 O5 | C 1 2/c 1 | 25.144; 13.56; 17.3063 90; 112.785; 90 | 5440.2 | Safaei, Elham; Alaji, Zahra; Panahi, Farhad; Wojtczak, Andrzej; Jagličić, Janez Zvonko Synthesis and characterization of a novel oxo-bridged binuclear iron(iii) complex: its catalytic application in the synthesis of benzoxazoles using benzyl alcohol in water New Journal of Chemistry, 2018, 42, 7230 |
| 1549210 | CIF | C30 H28 N2 Pt | P -1 | 9.994; 10.991; 13.402 94.44; 111.73; 106.35 | 1284.7 | Fereidoonnezhad, Masood; Shahsavari, Hamid R.; Abedanzadeh, Sedigheh; Nezafati, Ali; Khazali, Ali; Mastrorilli, Piero; Babaghasabha, Mojgan; Webb, James; Faghih, Zeinab; Faghih, Zahra; Bahemmat, Samira; Beyzavi, M. Hassan Synthesis, structural characterization, biological evaluation and molecular docking studies of new platinum(ii) complexes containing isocyanides New Journal of Chemistry, 2018, 42, 8681 |
| 1549211 | CIF | C27 H38 Al N O3 | P 1 21/n 1 | 21.288; 10.071; 26.44 90; 112.811; 90 | 5225 | Kiriratnikom, Jiraya; Chotchatchawankul, Sucheewin; Haesuwannakij, Setsiri; Kiatisevi, Supavadee; Phomphrai, Khamphee Synthesis and characterization of neutral and cationic aluminum complexes supported by a furfuryl-containing aminophenolate ligand for ring-opening polymerization of ε-caprolactone New Journal of Chemistry, 2018, 42, 8374 |
| 1549212 | CIF | C25 H33 N O3 | C 1 2/c 1 | 18.3409; 6.4457; 38.253 90; 95.468; 90 | 4501.7 | Kiriratnikom, Jiraya; Chotchatchawankul, Sucheewin; Haesuwannakij, Setsiri; Kiatisevi, Supavadee; Phomphrai, Khamphee Synthesis and characterization of neutral and cationic aluminum complexes supported by a furfuryl-containing aminophenolate ligand for ring-opening polymerization of ε-caprolactone New Journal of Chemistry, 2018, 42, 8374 |
| 1549213 | CIF | C26 H35 Al Cl N O3 | P 1 21/n 1 | 21.164; 10.0463; 26.332 90; 112.398; 90 | 5176.3 | Kiriratnikom, Jiraya; Chotchatchawankul, Sucheewin; Haesuwannakij, Setsiri; Kiatisevi, Supavadee; Phomphrai, Khamphee Synthesis and characterization of neutral and cationic aluminum complexes supported by a furfuryl-containing aminophenolate ligand for ring-opening polymerization of ε-caprolactone New Journal of Chemistry, 2018, 42, 8374 |
| 1549214 | CIF | C30 H44 Al N O4 | P -1 | 10.098; 10.771; 14.599 105.627; 97.16; 96.551 | 1499 | Kiriratnikom, Jiraya; Chotchatchawankul, Sucheewin; Haesuwannakij, Setsiri; Kiatisevi, Supavadee; Phomphrai, Khamphee Synthesis and characterization of neutral and cationic aluminum complexes supported by a furfuryl-containing aminophenolate ligand for ring-opening polymerization of ε-caprolactone New Journal of Chemistry, 2018, 42, 8374 |
| 1549215 | CIF | C24 H33 N O4 | P 1 21/n 1 | 18.3692; 13.9179; 18.6682 90; 107.269; 90 | 4557.6 | Shehzadi, Syeda Aaliya; Vande Velde, Christophe M. L.; Saeed, Aamer; Abbaspour Tehrani, Kourosch Synthesis of highly functionalized 1,6-dihydropyridines via the Zn(OTf)<sub>2</sub>-catalyzed three-component cascade reaction of aldimines and two alkynes (IA<sup>2</sup>-coupling). Organic & biomolecular chemistry, 2018, 16, 3241-3247 |
| 1549216 | CIF | C20 H27 N O2 | P -1 | 11.9792; 12.1131; 13.4962 94.97; 103.881; 109.494 | 1762.21 | Shehzadi, Syeda Aaliya; Vande Velde, Christophe M. L.; Saeed, Aamer; Abbaspour Tehrani, Kourosch Synthesis of highly functionalized 1,6-dihydropyridines via the Zn(OTf)<sub>2</sub>-catalyzed three-component cascade reaction of aldimines and two alkynes (IA<sup>2</sup>-coupling). Organic & biomolecular chemistry, 2018, 16, 3241-3247 |
| 1549217 | CIF | C32 H27 Cl N2 O2 S | C 1 2/c 1 | 17.6414; 17.596; 17.5732 90; 103.004; 90 | 5315.1 | Bao, Ming; Lu, Wei; Su, Han; Qiu, Lihua; Xu, Xinfang A convergent formal [4 + 2] cycloaddition of 1,6-diynes and benzyl azides: construction of spiro-polyheterocycles. Organic & biomolecular chemistry, 2018, 16, 3258-3265 |
| 1549218 | CIF | C55 H49 B Cl Ir N2 | P 1 21/n 1 | 20.4266; 9.3782; 24.537 90; 108.456; 90 | 4458.7 | Zhang, Hairong; Guo, Lihua; Tian, Zhenzhen; Tian, Meng; Zhang, Shumiao; Xu, Zhishan; Gong, Peiwei; Zheng, Xiaofeng; Zhao, Jia; Liu, Zhe Significant effects of counteranions on the anticancer activity of iridium(iii) complexes. Chemical communications (Cambridge, England), 2018, 54, 4421-4424 |
| 1549219 | CIF | C30 H28 Cl F6 O P | P -1 | 7.1352; 13.528; 14.6245 70.019; 86.507; 89.808 | 1323.96 | Shyshov, Oleksandr; Siewerth, Kevin Andre; von Delius, Max Evidence for anion-binding of all-cis hexafluorocyclohexane in solution and solid state. Chemical communications (Cambridge, England), 2018, 54, 4353-4355 |
| 1549220 | CIF | C25 H18 N S | P 1 21/n 1 | 9.6247; 15.2549; 12.526 90; 95.154; 90 | 1831.68 | Ponram, Marimuthu; Balijapalli, Umamahesh; Sambath, Baskaran; Iyer, Sathiyanarayanan Kulathu; B, Venkatachalapathy; Cingaram, Ravichandran; Natesan Sundaramurthy, Karthikeyan Development of paper-based chemosensor for the detection of mercury ions using mono- and tetra-sulfur bearing phenanthridines New Journal of Chemistry, 2018, 42, 8530 |
| 1549221 | CIF | C24 H18 N2 O2 | C 1 2/c 1 | 21.348; 9.871; 17.745 90; 92.423; 90 | 3736 | Kumari, Santosh; Shakoor, S. M. Abdul; Khullar, Sadhika; Mandal, Sanjay K.; Sakhuja, Rajeev An unprecedented tandem synthesis of fluorescent coumarin-fused pyrimidines via copper-catalyzed cross-dehydrogenative C(sp<sup>3</sup>)-N bond coupling. Organic & biomolecular chemistry, 2018, 16, 3220-3228 |
| 1549222 | CIF | C24 H37 N2 O2 P | C 1 2/c 1 | 19.931; 12.616; 21.565 90; 109.346; 90 | 5116 | Lin, Yi-Chun; Gilhula, James C.; Radosevich, Alexander T. Nontrigonal constraint enhances 1,2-addition reactivity of phosphazenes. Chemical science, 2018, 9, 4338-4347 |
| 1549223 | CIF | C24 H41 N4 P | P 1 21/c 1 | 8.3589; 16.491; 18.049 90; 93.77; 90 | 2482.6 | Lin, Yi-Chun; Gilhula, James C.; Radosevich, Alexander T. Nontrigonal constraint enhances 1,2-addition reactivity of phosphazenes. Chemical science, 2018, 9, 4338-4347 |
| 1549224 | CIF | C26 H33 N2 O2 P | P 1 21/n 1 | 8.587; 17.687; 16.43 90; 99.539; 90 | 2460.9 | Lin, Yi-Chun; Gilhula, James C.; Radosevich, Alexander T. Nontrigonal constraint enhances 1,2-addition reactivity of phosphazenes. Chemical science, 2018, 9, 4338-4347 |
| 1549225 | CIF | C26 H31 N4 P | P 1 21/n 1 | 12.8565; 9.4531; 19.152 90; 96.382; 90 | 2313.2 | Lin, Yi-Chun; Gilhula, James C.; Radosevich, Alexander T. Nontrigonal constraint enhances 1,2-addition reactivity of phosphazenes. Chemical science, 2018, 9, 4338-4347 |
| 1549226 | CIF | C48 H74 N4 O4 P2 | C 1 2/c 1 | 27.535; 11.39; 20.157 90; 129.45; 90 | 4881 | Lin, Yi-Chun; Gilhula, James C.; Radosevich, Alexander T. Nontrigonal constraint enhances 1,2-addition reactivity of phosphazenes. Chemical science, 2018, 9, 4338-4347 |
| 1549227 | CIF | C38 H54 N4 O4 P2 | P 1 21/n 1 | 9.2449; 21.052; 20.977 90; 94.271; 90 | 4071.3 | Lin, Yi-Chun; Gilhula, James C.; Radosevich, Alexander T. Nontrigonal constraint enhances 1,2-addition reactivity of phosphazenes. Chemical science, 2018, 9, 4338-4347 |
| 1549228 | CIF | C34 H50 B N2 O5 P | P b c a | 19.707; 17.611; 20.439 90; 90; 90 | 7094 | Lin, Yi-Chun; Gilhula, James C.; Radosevich, Alexander T. Nontrigonal constraint enhances 1,2-addition reactivity of phosphazenes. Chemical science, 2018, 9, 4338-4347 |
| 1549229 | CIF | C16 H21 N7 O3 S | P -1 | 10.8022; 13.9084; 14.6076 115.284; 109.088; 90.525 | 1846.65 | Rehman, Abida; Delori, Amit; Hughes, David S.; Jones, William Structural studies of crystalline forms of triamterene with carboxylic acid, GRAS and API molecules IUCrJ, 2018, 5 |
| 1549230 | CIF | C18 H23 N7 O5 S | P 1 21/c 1 | 13.5226; 14.9966; 10.6958 90; 104.179; 90 | 2102.95 | Rehman, Abida; Delori, Amit; Hughes, David S.; Jones, William Structural studies of crystalline forms of triamterene with carboxylic acid, GRAS and API molecules IUCrJ, 2018, 5 |
| 1549231 | CIF | C34 H44 N14 O6 S2 | P -1 | 11.0286; 13.7429; 14.9742 115.247; 109.951; 90.122 | 1900.25 | Rehman, Abida; Delori, Amit; Hughes, David S.; Jones, William Structural studies of crystalline forms of triamterene with carboxylic acid, GRAS and API molecules IUCrJ, 2018, 5 |
| 1549232 | CIF | C35 H46 N14 O6 S2 | P -1 | 14.075; 14.8889; 19.635 86.408; 88.142; 71.702 | 3898.7 | Rehman, Abida; Delori, Amit; Hughes, David S.; Jones, William Structural studies of crystalline forms of triamterene with carboxylic acid, GRAS and API molecules IUCrJ, 2018, 5 |
| 1549233 | CIF | C37 H50 N14 O6 S2 | P 1 21/n 1 | 15.0338; 11.5004; 24.396 90; 104.539; 90 | 4082.87 | Rehman, Abida; Delori, Amit; Hughes, David S.; Jones, William Structural studies of crystalline forms of triamterene with carboxylic acid, GRAS and API molecules IUCrJ, 2018, 5 |
| 1549234 | CIF | C34 H39 N15 O4 S2 | P 1 21/n 1 | 14.8461; 12.3081; 21.285 90; 105.176; 90 | 3753.71 | Rehman, Abida; Delori, Amit; Hughes, David S.; Jones, William Structural studies of crystalline forms of triamterene with carboxylic acid, GRAS and API molecules IUCrJ, 2018, 5 |
| 1549235 | CIF | C39 H46 N14 O3 S | P -1 | 11.2398; 13.2439; 15.4624 113.595; 103.527; 91.977 | 2029.46 | Rehman, Abida; Delori, Amit; Hughes, David S.; Jones, William Structural studies of crystalline forms of triamterene with carboxylic acid, GRAS and API molecules IUCrJ, 2018, 5 |
| 1549236 | CIF | C27 H22 B Br2 N | P 1 21 1 | 11.269; 7.3358; 14.2605 90; 101.418; 90 | 1155.54 | Zhang, Weidong; Li, Guoping; Xu, Letian; Zhuo, Yue; Wan, Wenming; Yan, Ni; He, Gang 9,10-Azaboraphenanthrene-containing small molecules and conjugated polymers: synthesis and their application in chemodosimeters for the ratiometric detection of fluoride ions. Chemical science, 2018, 9, 4444-4450 |
| 1549237 | CIF | C22 H30 Cl N O4 S | P 1 21/n 1 | 12.0663; 10.1526; 18.2867 90; 103.196; 90 | 2181.05 | Maryasin, Boris; Kaldre, Dainis; Galaverna, Renan; Klose, Immo; Ruider, Stefan; Drescher, Martina; Kählig, Hanspeter; González, Leticia; Eberlin, Marcos N.; Jurberg, Igor D.; Maulide, Nuno Unusual mechanisms in Claisen rearrangements: an ionic fragmentation leading to a <i>meta</i>-selective rearrangement. Chemical science, 2018, 9, 4124-4131 |
| 1549238 | CIF | C23 H19 N O3 S | F d d 2 | 22.362; 58.28; 5.779 90; 90; 90 | 7532 | Maryasin, Boris; Kaldre, Dainis; Galaverna, Renan; Klose, Immo; Ruider, Stefan; Drescher, Martina; Kählig, Hanspeter; González, Leticia; Eberlin, Marcos N.; Jurberg, Igor D.; Maulide, Nuno Unusual mechanisms in Claisen rearrangements: an ionic fragmentation leading to a <i>meta</i>-selective rearrangement. Chemical science, 2018, 9, 4124-4131 |
| 1549239 | CIF | C20 H25 N O5 S | P c a 21 | 11.7592; 10.1198; 32.161 90; 90; 90 | 3827.2 | Maryasin, Boris; Kaldre, Dainis; Galaverna, Renan; Klose, Immo; Ruider, Stefan; Drescher, Martina; Kählig, Hanspeter; González, Leticia; Eberlin, Marcos N.; Jurberg, Igor D.; Maulide, Nuno Unusual mechanisms in Claisen rearrangements: an ionic fragmentation leading to a <i>meta</i>-selective rearrangement. Chemical science, 2018, 9, 4124-4131 |
| 1549240 | CIF | F281.16 Sr68.58 Zr36 | P n m a | 28.985; 16.557; 11.389 90; 90; 90 | 5466 | Jean-Paul Laval; Hamid Rafik; Gilles Trolliard Microphases deriving from Ba2ZrF8 structure type: II: Crystal structure of Sr17Zr9F70 and Sr17.145Zr9F70.29 Journal of Solid State Chemistry, 2018, 260, 151-158 |
| 1549241 | CIF | F280 Sr68 Zr36 | P n m a | 28.812; 16.566; 11.433 90; 90; 90 | 5457 | Jean-Paul Laval; Hamid Rafik; Gilles Trolliard Microphases deriving from Ba2ZrF8 structure type: II: Crystal structure of Sr17Zr9F70 and Sr17.145Zr9F70.29 Journal of Solid State Chemistry, 2018, 260, 151-158 |
| 1549242 | CIF | C18 H32 F3 Mn O6 P2 S | P 21 21 21 | 8.6949; 13.9549; 19.9508 90; 90; 90 | 2420.8 | Garduño, Jorge A.; Arévalo, Alma; Flores-Alamo, Marcos; García, Juventino J. Mn(i) organometallics containing the iPr2P(CH2)2PiPr2 ligand for the catalytic hydration of aromatic nitriles Catalysis Science & Technology, 2018, 8, 2606 |
| 1549243 | CIF | Co H12 Mo6 N4 O30 | P 1 21/c 1 | 11.403; 10.995; 11.715 90; 100.143; 90 | 1446 | Tang, Yu-Jia; Zhang, A-Man; Zhu, Hong-Jing; Dong, Long-Zhang; Wang, Xiao-Li; Li, Shun-Li; Han, Min; Xu, Xiang-Xin; Lan, Ya-Qian Polyoxometalate precursors for precisely controlled synthesis of bimetallic sulfide heterostructure through nucleation-doping competition. Nanoscale, 2018, 10, 8404-8412 |
| 1549244 | CIF | C36 H56 Cu F6 N3 Sb Si3 | P 1 21/n 1 | 14.617; 14.759; 21.243 90; 107.874; 90 | 4362 | Parvin, Nasrina; Pal, Shiv; Echeverría, Jorge; Alvarez, Santiago; Khan, Shabana Taming a monomeric [Cu(η<sup>6</sup>-C<sub>6</sub>H<sub>6</sub>)]<sup>+</sup> complex with silylene. Chemical science, 2018, 9, 4333-4337 |
| 1549245 | CIF | C33 H42 Cu F6 N2 Sb | P 1 21/c 1 | 13.3555; 13.9173; 18.181 90; 102.245; 90 | 3302.5 | Parvin, Nasrina; Pal, Shiv; Echeverría, Jorge; Alvarez, Santiago; Khan, Shabana Taming a monomeric [Cu(η<sup>6</sup>-C<sub>6</sub>H<sub>6</sub>)]<sup>+</sup> complex with silylene. Chemical science, 2018, 9, 4333-4337 |
| 1549246 | CIF | C40 H56 Cl2 Cu F6 N2 Sb | P 1 21/n 1 | 10.506; 20.813; 20.435 90; 104.638; 90 | 4323 | Parvin, Nasrina; Pal, Shiv; Echeverría, Jorge; Alvarez, Santiago; Khan, Shabana Taming a monomeric [Cu(η<sup>6</sup>-C<sub>6</sub>H<sub>6</sub>)]<sup>+</sup> complex with silylene. Chemical science, 2018, 9, 4333-4337 |
| 1549247 | CIF | C33 H59 Cu F6 N3 Sb Si3 | P 1 21/c 1 | 13.605; 14.057; 21.79 90; 107.833; 90 | 3967 | Parvin, Nasrina; Pal, Shiv; Echeverría, Jorge; Alvarez, Santiago; Khan, Shabana Taming a monomeric [Cu(η<sup>6</sup>-C<sub>6</sub>H<sub>6</sub>)]<sup>+</sup> complex with silylene. Chemical science, 2018, 9, 4333-4337 |
| 1549248 | CIF | C57 H60 Cl2 N12 | P 1 21/n 1 | 16.565; 10.745; 31.067 90; 92.088; 90 | 5526 | McMahon, David P.; Stephenson, Andrew; Chong, Samantha Y.; Little, Marc; Jones, James T. A.; Cooper, Andrew I.; Day, Graeme Matthew Computational Modelling of Solvent Effects in a Prolific Solvatomorphic Porous Organic Cage Faraday Discussions, 2018 |
| 1549249 | CIF | C65 H69 Cl3 N12 | P 21 21 21 | 10.654; 23.151; 25.363 90; 90; 90 | 6256 | McMahon, David P.; Stephenson, Andrew; Chong, Samantha Y.; Little, Marc; Jones, James T. A.; Cooper, Andrew I.; Day, Graeme Matthew Computational Modelling of Solvent Effects in a Prolific Solvatomorphic Porous Organic Cage Faraday Discussions, 2018 |
| 1549250 | CIF | C103.75 H111.5 Cl15.5 N24 | R 3 | 21.3987; 21.3987; 21.3164 90; 90; 120 | 8453.2 | McMahon, David P.; Stephenson, Andrew; Chong, Samantha Y.; Little, Marc; Jones, James T. A.; Cooper, Andrew I.; Day, Graeme Matthew Computational Modelling of Solvent Effects in a Prolific Solvatomorphic Porous Organic Cage Faraday Discussions, 2018 |
| 1549251 | CIF | C106 H96 Cl40 N24 | F 2 3 | 24.3478; 24.3478; 24.3478 90; 90; 90 | 14433.7 | McMahon, David P.; Stephenson, Andrew; Chong, Samantha Y.; Little, Marc; Jones, James T. A.; Cooper, Andrew I.; Day, Graeme Matthew Computational Modelling of Solvent Effects in a Prolific Solvatomorphic Porous Organic Cage Faraday Discussions, 2018 |
| 1549252 | CIF | C107.33 H107.33 Cl33.97 N24 | P -1 | 17.1487; 18.3913; 24.7171 73.378; 72.98; 76.7 | 7050.9 | McMahon, David P.; Stephenson, Andrew; Chong, Samantha Y.; Little, Marc; Jones, James T. A.; Cooper, Andrew I.; Day, Graeme Matthew Computational Modelling of Solvent Effects in a Prolific Solvatomorphic Porous Organic Cage Faraday Discussions, 2018 |
| 1549253 | CIF | C26 H49 F3 Ir N2 O2 P2 | P b c a | 14.6519; 15.5746; 27.2406 90; 90; 90 | 6216.2 | Kinauer, Markus; Diefenbach, Martin; Bamberger, Heiko; Demeshko, Serhiy; Reijerse, Edward J.; Volkmann, Christian; Würtele, Christian; van Slageren, Joris; de Bruin, Bas; Holthausen, Max C.; Schneider, Sven An iridium(iii/iv/v) redox series featuring a terminal imido complex with triplet ground state. Chemical science, 2018, 9, 4325-4332 |
| 1549254 | CIF | C31 H55 Ir N2 O2 P2 | P 1 21/c 1 | 11.2846; 14.9634; 19.8058 90; 92.013; 90 | 3342.3 | Kinauer, Markus; Diefenbach, Martin; Bamberger, Heiko; Demeshko, Serhiy; Reijerse, Edward J.; Volkmann, Christian; Würtele, Christian; van Slageren, Joris; de Bruin, Bas; Holthausen, Max C.; Schneider, Sven An iridium(iii/iv/v) redox series featuring a terminal imido complex with triplet ground state. Chemical science, 2018, 9, 4325-4332 |
| 1549255 | CIF | C24 H49 Ir N2 P2 | P 1 21/c 1 | 11.0958; 15.4511; 16.0856 90; 100.56; 90 | 2711 | Kinauer, Markus; Diefenbach, Martin; Bamberger, Heiko; Demeshko, Serhiy; Reijerse, Edward J.; Volkmann, Christian; Würtele, Christian; van Slageren, Joris; de Bruin, Bas; Holthausen, Max C.; Schneider, Sven An iridium(iii/iv/v) redox series featuring a terminal imido complex with triplet ground state. Chemical science, 2018, 9, 4325-4332 |
| 1549256 | CIF | C25 H49 Ir N2 O2 P2 | P 1 21/m 1 | 7.9728; 21.7175; 8.7383 90; 113.559; 90 | 1386.92 | Kinauer, Markus; Diefenbach, Martin; Bamberger, Heiko; Demeshko, Serhiy; Reijerse, Edward J.; Volkmann, Christian; Würtele, Christian; van Slageren, Joris; de Bruin, Bas; Holthausen, Max C.; Schneider, Sven An iridium(iii/iv/v) redox series featuring a terminal imido complex with triplet ground state. Chemical science, 2018, 9, 4325-4332 |
| 1549257 | CIF | C28 H76 B2 O2 Pb Si8 | C 1 2/c 1 | 25.147; 18.137; 23.271 90; 118.845; 90 | 9297 | Someşan, Adrian-Alexandru; Le Coz, Erwann; Roisnel, Thierry; Silvestru, Cristian; Sarazin, Yann Stable lead(ii) boroxides. Chemical communications (Cambridge, England), 2018, 54, 5299-5302 |
| 1549258 | CIF | C28 H76 B2 O2 Si8 Sn | C 1 2/c 1 | 25.1738; 18.1907; 24.6824 90; 123.917; 90 | 9379.6 | Someşan, Adrian-Alexandru; Le Coz, Erwann; Roisnel, Thierry; Silvestru, Cristian; Sarazin, Yann Stable lead(ii) boroxides. Chemical communications (Cambridge, England), 2018, 54, 5299-5302 |
| 1549259 | CIF | C18 H6 F36 O7 Pb4 | P 1 21/c 1 | 18.87; 10.1801; 19.4987 90; 90.176; 90 | 3745.7 | Someşan, Adrian-Alexandru; Le Coz, Erwann; Roisnel, Thierry; Silvestru, Cristian; Sarazin, Yann Stable lead(ii) boroxides. Chemical communications (Cambridge, England), 2018, 54, 5299-5302 |
| 1549260 | CIF | C15 H30 N2 Pb Si2 | P -1 | 8.9054; 10.6022; 12.4223 103.574; 110.985; 103.843 | 994.7 | Someşan, Adrian-Alexandru; Le Coz, Erwann; Roisnel, Thierry; Silvestru, Cristian; Sarazin, Yann Stable lead(ii) boroxides. Chemical communications (Cambridge, England), 2018, 54, 5299-5302 |
| 1549261 | CIF | C23 H50 B N O Pb Si4 | P 1 21/n 1 | 9.1319; 18.6282; 18.929 90; 102.613; 90 | 3142.3 | Someşan, Adrian-Alexandru; Le Coz, Erwann; Roisnel, Thierry; Silvestru, Cristian; Sarazin, Yann Stable lead(ii) boroxides. Chemical communications (Cambridge, England), 2018, 54, 5299-5302 |
| 1549262 | CIF | C24 H106 Ca Cu6 N6 O66 | P 63 | 17.8904; 17.8904; 12.7999 90; 90; 120 | 3547.9 | Mon, Marta; Bruno, Rosaria; Ferrando-Soria, Jesús; Bartella, Lucia; Di Donna, Leonardo; Talia, Marianna; Lappano, Rosamaria; Maggiolini, Marcello; Armentano, Donatella; Pardo, Emilio Crystallographic snapshots of host‒guest interactions in drugs@metal‒organic frameworks: towards mimicking molecular recognition processes Materials Horizons, 2018, 5, 683 |
| 1549263 | CIF | C48.4 H80.2 Ca Cu6 N11 O37.6 | P 63 | 17.9504; 17.9504; 12.5603 90; 90; 120 | 3504.9 | Mon, Marta; Bruno, Rosaria; Ferrando-Soria, Jesús; Bartella, Lucia; Di Donna, Leonardo; Talia, Marianna; Lappano, Rosamaria; Maggiolini, Marcello; Armentano, Donatella; Pardo, Emilio Crystallographic snapshots of host‒guest interactions in drugs@metal‒organic frameworks: towards mimicking molecular recognition processes Materials Horizons, 2018, 5, 683 |
| 1549264 | CIF | C42 H83 Ca Cu6 N9 O54 | P 63 | 17.9607; 17.9607; 12.6765 90; 90; 120 | 3541.4 | Mon, Marta; Bruno, Rosaria; Ferrando-Soria, Jesús; Bartella, Lucia; Di Donna, Leonardo; Talia, Marianna; Lappano, Rosamaria; Maggiolini, Marcello; Armentano, Donatella; Pardo, Emilio Crystallographic snapshots of host‒guest interactions in drugs@metal‒organic frameworks: towards mimicking molecular recognition processes Materials Horizons, 2018, 5, 683 |
| 1549265 | CIF | C42 H89 Ca Cu6 N9 O51 | P 63 | 17.9035; 17.9035; 12.6421 90; 90; 120 | 3509.3 | Mon, Marta; Bruno, Rosaria; Ferrando-Soria, Jesús; Bartella, Lucia; Di Donna, Leonardo; Talia, Marianna; Lappano, Rosamaria; Maggiolini, Marcello; Armentano, Donatella; Pardo, Emilio Crystallographic snapshots of host‒guest interactions in drugs@metal‒organic frameworks: towards mimicking molecular recognition processes Materials Horizons, 2018, 5, 683 |
| 1549266 | CIF | C37 H90 Ca Cl Cu6 N7 O50 | P 63 | 17.997; 17.997; 12.861 90; 90; 120 | 3607.5 | Mon, Marta; Bruno, Rosaria; Ferrando-Soria, Jesús; Bartella, Lucia; Di Donna, Leonardo; Talia, Marianna; Lappano, Rosamaria; Maggiolini, Marcello; Armentano, Donatella; Pardo, Emilio Crystallographic snapshots of host‒guest interactions in drugs@metal‒organic frameworks: towards mimicking molecular recognition processes Materials Horizons, 2018, 5, 683 |
| 1549267 | CIF | C26 H15 N5 O | P -1 | 9.3241; 9.5329; 12.0593 83.218; 66.653; 80.098 | 967.99 | Ostrowska, Katarzyna; Ceresoli, Davide; Stadnicka, Katarzyna; Gryl, Marlena; Cazzaniga, Marco; Soave, Raffaella; Musielak, Bogdan; Witek, Łukasz J.; Goszczycki, Piotr; Grolik, Jarosław; Turek, Andrzej M. π‒π-Induced aggregation and single-crystal fluorescence anisotropy of 5,6,10b-triazaacephenanthrylene IUCrJ, 2018, 5 |
| 1549268 | CIF | C26 H15 N5 O | P -1 | 9.2504; 9.4009; 11.9245 84.147; 67.347; 81.113 | 944.47 | Ostrowska, Katarzyna; Ceresoli, Davide; Stadnicka, Katarzyna; Gryl, Marlena; Cazzaniga, Marco; Soave, Raffaella; Musielak, Bogdan; Witek, Łukasz J.; Goszczycki, Piotr; Grolik, Jarosław; Turek, Andrzej M. π‒π-Induced aggregation and single-crystal fluorescence anisotropy of 5,6,10b-triazaacephenanthrylene IUCrJ, 2018, 5 |
| 1549269 | CIF | C28 H33 Br N2 O3 | P 1 21 1 | 5.4738; 16.81; 14.183 90; 95.627; 90 | 1298.8 | Hu, Qiupeng; Kondoh, Azusa; Terada, Masahiro Enantioselective direct Mannich-type reactions of 2-benzylpyridine N-oxides catalyzed by chiral bis(guanidino)iminophosphorane organosuperbase. Chemical science, 2018, 9, 4348-4351 |
| 1549270 | CIF | C32 H33 N O3 | P 31 2 1 | 12.0961; 12.0961; 30.6664 90; 90; 120 | 3885.8 | Volpe, Rohan; Lepage, Romain J.; White, Jonathan M.; Krenske, Elizabeth H.; Flynn, Bernard L. Asymmetric synthesis of multiple quaternary stereocentre-containing cyclopentyls by oxazolidinone-promoted Nazarov cyclizations. Chemical science, 2018, 9, 4644-4649 |
| 1549271 | CIF | C32 H33 N O3 | P 1 21 1 | 10.2041; 12.0967; 10.8841 90; 109.609; 90 | 1265.57 | Volpe, Rohan; Lepage, Romain J.; White, Jonathan M.; Krenske, Elizabeth H.; Flynn, Bernard L. Asymmetric synthesis of multiple quaternary stereocentre-containing cyclopentyls by oxazolidinone-promoted Nazarov cyclizations. Chemical science, 2018, 9, 4644-4649 |
| 1549273 | CIF | C45 H58 Cl4 Cu2 O4 P4 | P 21 21 21 | 10.5101; 20.6596; 22.4637 90; 90; 90 | 4877.6 | Zatolochnaya, Olga V.; Rodríguez, Sonia; Zhang, Yongda; Lao, Kendricks S.; Tcyrulnikov, Sergei; Li, Guisheng; Wang, Xiao-Jun; Qu, Bo; Biswas, Soumik; Mangunuru, Hari P. R.; Rivalti, Daniel; Sieber, Joshua D.; Desrosiers, Jean-Nicolas; Leung, Joyce C.; Grinberg, Nelu; Lee, Heewon; Haddad, Nizar; Yee, Nathan K.; Song, Jinhua J.; Kozlowski, Marisa C.; Senanayake, Chris H. Copper-catalyzed asymmetric hydrogenation of 2-substituted ketones <i>via</i> dynamic kinetic resolution. Chemical science, 2018, 9, 4505-4510 |
| 1549274 | CIF | C64 H92 Cl2 Cu2 N4 O4 P4 | P 21 21 21 | 13.69; 16.8264; 30.4315 90; 90; 90 | 7010 | Zatolochnaya, Olga V.; Rodríguez, Sonia; Zhang, Yongda; Lao, Kendricks S.; Tcyrulnikov, Sergei; Li, Guisheng; Wang, Xiao-Jun; Qu, Bo; Biswas, Soumik; Mangunuru, Hari P. R.; Rivalti, Daniel; Sieber, Joshua D.; Desrosiers, Jean-Nicolas; Leung, Joyce C.; Grinberg, Nelu; Lee, Heewon; Haddad, Nizar; Yee, Nathan K.; Song, Jinhua J.; Kozlowski, Marisa C.; Senanayake, Chris H. Copper-catalyzed asymmetric hydrogenation of 2-substituted ketones <i>via</i> dynamic kinetic resolution. Chemical science, 2018, 9, 4505-4510 |
| 1549275 | CIF | C36 H35 B F15 P | C 1 2/c 1 | 28.898; 11.2532; 21.7565 90; 105.318; 90 | 6823.8 | Wang, Long; Kehr, Gerald; Daniliuc, Constantin G.; Brinkkötter, Melanie; Wiegand, Thomas; Wübker, Anna-Lena; Eckert, Hellmut; Liu, Lei; Brandenburg, Jan Gerit; Grimme, Stefan; Erker, Gerhard Solid state frustrated Lewis pair chemistry. Chemical science, 2018, 9, 4859-4865 |
| 1549276 | CIF | C36 H33 B F15 O2 P S | P -1 | 10.9369; 12.602; 15.7611 90.384; 97.992; 111.759 | 1993.92 | Wang, Long; Kehr, Gerald; Daniliuc, Constantin G.; Brinkkötter, Melanie; Wiegand, Thomas; Wübker, Anna-Lena; Eckert, Hellmut; Liu, Lei; Brandenburg, Jan Gerit; Grimme, Stefan; Erker, Gerhard Solid state frustrated Lewis pair chemistry. Chemical science, 2018, 9, 4859-4865 |
| 1549277 | CIF | C38 H37 B Cl4 F15 P | P b c a | 20.8497; 16.0333; 23.8954 90; 90; 90 | 7988 | Wang, Long; Kehr, Gerald; Daniliuc, Constantin G.; Brinkkötter, Melanie; Wiegand, Thomas; Wübker, Anna-Lena; Eckert, Hellmut; Liu, Lei; Brandenburg, Jan Gerit; Grimme, Stefan; Erker, Gerhard Solid state frustrated Lewis pair chemistry. Chemical science, 2018, 9, 4859-4865 |
| 1549278 | CIF | C20 H19 N O | P 1 21/c 1 | 9.5578; 20.653; 8.4644 90; 108.514; 90 | 1584.4 | Mokar, Bhanudas Dattatray; Jadhav, Prakash D.; Pandit, Y. B.; Liu, Rai-Shung Gold-catalyzed (4 + 2)-annulations between α-alkyl alkenylgold carbenes and benzisoxazoles with reactive alkyl groups. Chemical science, 2018, 9, 4488-4492 |
| 1549279 | CIF | C18 H20 Br N O | P -1 | 7.6388; 11.2206; 11.3511 116.079; 109.218; 91.505 | 808.23 | Mokar, Bhanudas Dattatray; Jadhav, Prakash D.; Pandit, Y. B.; Liu, Rai-Shung Gold-catalyzed (4 + 2)-annulations between α-alkyl alkenylgold carbenes and benzisoxazoles with reactive alkyl groups. Chemical science, 2018, 9, 4488-4492 |
| 1549280 | CIF | C21.5 H19.5 Cl1.5 N O3 | P -1 | 11.282; 11.457; 14.934 84.071; 88.539; 84.074 | 1910 | Mokar, Bhanudas Dattatray; Jadhav, Prakash D.; Pandit, Y. B.; Liu, Rai-Shung Gold-catalyzed (4 + 2)-annulations between α-alkyl alkenylgold carbenes and benzisoxazoles with reactive alkyl groups. Chemical science, 2018, 9, 4488-4492 |
| 1549281 | CIF | C22 H21 N O5 | P 1 21/c 1 | 11.8837; 10.0611; 19.6889 90; 107.518; 90 | 2244.9 | Mokar, Bhanudas Dattatray; Jadhav, Prakash D.; Pandit, Y. B.; Liu, Rai-Shung Gold-catalyzed (4 + 2)-annulations between α-alkyl alkenylgold carbenes and benzisoxazoles with reactive alkyl groups. Chemical science, 2018, 9, 4488-4492 |
| 1549282 | CIF | C43 H58 B Co F3 N6 O3 S | P -1 | 11.3925; 16.9868; 21.7195 94.871; 98.674; 92.305 | 4134.1 | Hill, Ethan A.; Kelty, Margaret L.; Filatov, Alexander S.; Anderson, John S. Isolable iodosylarene and iodoxyarene adducts of Co and their O-atom transfer and C-H activation reactivity. Chemical science, 2018, 9, 4493-4499 |
| 1549283 | CIF | C63 H59 B2 Co F24 I N6 O3 S | P 1 | 10.4248; 12.9027; 15.4799 101.302; 105.089; 113.446 | 1735.7 | Hill, Ethan A.; Kelty, Margaret L.; Filatov, Alexander S.; Anderson, John S. Isolable iodosylarene and iodoxyarene adducts of Co and their O-atom transfer and C-H activation reactivity. Chemical science, 2018, 9, 4493-4499 |
| 1549284 | CIF | C26 H44 B Co F3 N6 O4 S | P 1 21/n 1 | 10.4361; 20.2414; 15.3862 90; 91.209; 90 | 3249.5 | Hill, Ethan A.; Kelty, Margaret L.; Filatov, Alexander S.; Anderson, John S. Isolable iodosylarene and iodoxyarene adducts of Co and their O-atom transfer and C-H activation reactivity. Chemical science, 2018, 9, 4493-4499 |
| 1549285 | CIF | C84.5 H84 B2 Cl Co F24 I N6 O3 S | P -1 | 14.2995; 16.0821; 38.551 95.079; 97.357; 97.863 | 8658.9 | Hill, Ethan A.; Kelty, Margaret L.; Filatov, Alexander S.; Anderson, John S. Isolable iodosylarene and iodoxyarene adducts of Co and their O-atom transfer and C-H activation reactivity. Chemical science, 2018, 9, 4493-4499 |
| 1549286 | CIF | C71 H77 B2 Co F24 I N6 O6 S | P -1 | 13.018; 17.299; 19.933 69.338; 77.588; 78.279 | 4062 | Hill, Ethan A.; Kelty, Margaret L.; Filatov, Alexander S.; Anderson, John S. Isolable iodosylarene and iodoxyarene adducts of Co and their O-atom transfer and C-H activation reactivity. Chemical science, 2018, 9, 4493-4499 |
| 1549287 | CIF | C93 H100 B2 Co F27 N8 O4 S | P b c a | 21.493; 22.3378; 38.715 90; 90; 90 | 18587 | Hill, Ethan A.; Kelty, Margaret L.; Filatov, Alexander S.; Anderson, John S. Isolable iodosylarene and iodoxyarene adducts of Co and their O-atom transfer and C-H activation reactivity. Chemical science, 2018, 9, 4493-4499 |
| 1549288 | CIF | C28 H20 | P 21 21 21 | 8.3475; 10.314; 21.0732 90; 90; 90 | 1814.32 | Cai, Yuanjing; Du, Lili; Samedov, Kerim; Gu, Xinggui; Qi, Fei; Sung, Herman H. Y.; Patrick, Brian O.; Yan, Zhiping; Jiang, Xiaofang; Zhang, Haoke; Lam, Jacky W. Y.; Williams, Ian D.; Lee Phillips, David; Qin, Anjun; Tang, Ben Zhong Deciphering the working mechanism of aggregation-induced emission of tetraphenylethylene derivatives by ultrafast spectroscopy. Chemical science, 2018, 9, 4662-4670 |
| 1549289 | CIF | C30 H28 | P 1 21/c 1 | 18.1203; 6.99093; 19.2375 90; 112.45; 90 | 2252.27 | Cai, Yuanjing; Du, Lili; Samedov, Kerim; Gu, Xinggui; Qi, Fei; Sung, Herman H. Y.; Patrick, Brian O.; Yan, Zhiping; Jiang, Xiaofang; Zhang, Haoke; Lam, Jacky W. Y.; Williams, Ian D.; Lee Phillips, David; Qin, Anjun; Tang, Ben Zhong Deciphering the working mechanism of aggregation-induced emission of tetraphenylethylene derivatives by ultrafast spectroscopy. Chemical science, 2018, 9, 4662-4670 |
| 1549290 | CIF | C30 H24 | P 1 21/c 1 | 11.90924; 17.5617; 9.90343 90; 101.393; 90 | 2030.45 | Cai, Yuanjing; Du, Lili; Samedov, Kerim; Gu, Xinggui; Qi, Fei; Sung, Herman H. Y.; Patrick, Brian O.; Yan, Zhiping; Jiang, Xiaofang; Zhang, Haoke; Lam, Jacky W. Y.; Williams, Ian D.; Lee Phillips, David; Qin, Anjun; Tang, Ben Zhong Deciphering the working mechanism of aggregation-induced emission of tetraphenylethylene derivatives by ultrafast spectroscopy. Chemical science, 2018, 9, 4662-4670 |
| 1549291 | CIF | C30 H28 | P 1 21/n 1 | 14.1772; 10.8633; 14.2137 90; 95.1137; 90 | 2180.36 | Cai, Yuanjing; Du, Lili; Samedov, Kerim; Gu, Xinggui; Qi, Fei; Sung, Herman H. Y.; Patrick, Brian O.; Yan, Zhiping; Jiang, Xiaofang; Zhang, Haoke; Lam, Jacky W. Y.; Williams, Ian D.; Lee Phillips, David; Qin, Anjun; Tang, Ben Zhong Deciphering the working mechanism of aggregation-induced emission of tetraphenylethylene derivatives by ultrafast spectroscopy. Chemical science, 2018, 9, 4662-4670 |
| 1549292 | CIF | C30 H26 | P 1 21/c 1 | 17.4337; 6.9903; 17.935 90; 103.64; 90 | 2124 | Cai, Yuanjing; Du, Lili; Samedov, Kerim; Gu, Xinggui; Qi, Fei; Sung, Herman H. Y.; Patrick, Brian O.; Yan, Zhiping; Jiang, Xiaofang; Zhang, Haoke; Lam, Jacky W. Y.; Williams, Ian D.; Lee Phillips, David; Qin, Anjun; Tang, Ben Zhong Deciphering the working mechanism of aggregation-induced emission of tetraphenylethylene derivatives by ultrafast spectroscopy. Chemical science, 2018, 9, 4662-4670 |
| 1549293 | CIF | C30 H22 | C 1 2/c 1 | 18.2724; 19.5178; 18.301 90; 113.791; 90 | 5972.2 | Cai, Yuanjing; Du, Lili; Samedov, Kerim; Gu, Xinggui; Qi, Fei; Sung, Herman H. Y.; Patrick, Brian O.; Yan, Zhiping; Jiang, Xiaofang; Zhang, Haoke; Lam, Jacky W. Y.; Williams, Ian D.; Lee Phillips, David; Qin, Anjun; Tang, Ben Zhong Deciphering the working mechanism of aggregation-induced emission of tetraphenylethylene derivatives by ultrafast spectroscopy. Chemical science, 2018, 9, 4662-4670 |
| 1549294 | CIF | C29 H24 | P 1 21/c 1 | 7.396; 30.1314; 18.311 90; 91.801; 90 | 4078.6 | Cai, Yuanjing; Du, Lili; Samedov, Kerim; Gu, Xinggui; Qi, Fei; Sung, Herman H. Y.; Patrick, Brian O.; Yan, Zhiping; Jiang, Xiaofang; Zhang, Haoke; Lam, Jacky W. Y.; Williams, Ian D.; Lee Phillips, David; Qin, Anjun; Tang, Ben Zhong Deciphering the working mechanism of aggregation-induced emission of tetraphenylethylene derivatives by ultrafast spectroscopy. Chemical science, 2018, 9, 4662-4670 |
| 1549295 | CIF | C28 H22 | P -1 | 11.9827; 13.0612; 14.0684 117.413; 92.608; 90.268 | 1951.7 | Cai, Yuanjing; Du, Lili; Samedov, Kerim; Gu, Xinggui; Qi, Fei; Sung, Herman H. Y.; Patrick, Brian O.; Yan, Zhiping; Jiang, Xiaofang; Zhang, Haoke; Lam, Jacky W. Y.; Williams, Ian D.; Lee Phillips, David; Qin, Anjun; Tang, Ben Zhong Deciphering the working mechanism of aggregation-induced emission of tetraphenylethylene derivatives by ultrafast spectroscopy. Chemical science, 2018, 9, 4662-4670 |
| 1549296 | CIF | C36 H72 Al Cl Si3 Th | P 1 21/n 1 | 14.6013; 16.3421; 18.0401 90; 93.323; 90 | 4297.4 | Altman, Alison B.; Brown, Alexandra C.; Rao, Guodong; Lohrey, Trevor D.; Britt, R. David; Maron, Laurent; Minasian, Stefan G.; Shuh, David K.; Arnold, John Chemical structure and bonding in a thorium(iii)-aluminum heterobimetallic complex. Chemical science, 2018, 9, 4317-4324 |
| 1549297 | CIF | C36 H72 Al Si3 U | P -1 | 10.4534; 12.854; 17.8476 72.09; 79.893; 66.898 | 2094.82 | Altman, Alison B.; Brown, Alexandra C.; Rao, Guodong; Lohrey, Trevor D.; Britt, R. David; Maron, Laurent; Minasian, Stefan G.; Shuh, David K.; Arnold, John Chemical structure and bonding in a thorium(iii)-aluminum heterobimetallic complex. Chemical science, 2018, 9, 4317-4324 |
| 1549298 | CIF | C36 H73 Al Si3 Th | P 1 21/c 1 | 18.541; 12.528; 18.971 90; 105.644; 90 | 4243 | Altman, Alison B.; Brown, Alexandra C.; Rao, Guodong; Lohrey, Trevor D.; Britt, R. David; Maron, Laurent; Minasian, Stefan G.; Shuh, David K.; Arnold, John Chemical structure and bonding in a thorium(iii)-aluminum heterobimetallic complex. Chemical science, 2018, 9, 4317-4324 |
| 1549299 | CIF | C36 H72 Al Si3 Th | P 1 21/m 1 | 12.933; 12.816; 13.179 90; 94.46; 90 | 2178 | Altman, Alison B.; Brown, Alexandra C.; Rao, Guodong; Lohrey, Trevor D.; Britt, R. David; Maron, Laurent; Minasian, Stefan G.; Shuh, David K.; Arnold, John Chemical structure and bonding in a thorium(iii)-aluminum heterobimetallic complex. Chemical science, 2018, 9, 4317-4324 |
| 1549300 | CIF | C62 H88 I2 N4 O2 | P 1 21/n 1 | 14.01776; 11.68842; 18.61137 90; 97.6225; 90 | 3022.44 | Rottschäfer, Dennis; Neumann, Beate; Stammler, Hans-Georg; Andrada, Diego M.; Ghadwal, Rajendra S. Kekulé diradicaloids derived from a classical N-heterocyclic carbene. Chemical science, 2018, 9, 4970-4976 |
| 1549301 | CIF | C60 H80 N4 | P -1 | 10.4185; 10.5244; 25.1966 97.968; 90.283; 110.092 | 2565.5 | Rottschäfer, Dennis; Neumann, Beate; Stammler, Hans-Georg; Andrada, Diego M.; Ghadwal, Rajendra S. Kekulé diradicaloids derived from a classical N-heterocyclic carbene. Chemical science, 2018, 9, 4970-4976 |
| 1549302 | CIF | C70 H92 N4 O | P -1 | 9.397; 11.5574; 15.1108 70.87; 84.424; 76.36 | 1506.4 | Rottschäfer, Dennis; Neumann, Beate; Stammler, Hans-Georg; Andrada, Diego M.; Ghadwal, Rajendra S. Kekulé diradicaloids derived from a classical N-heterocyclic carbene. Chemical science, 2018, 9, 4970-4976 |
| 1549303 | CIF | C69.21 H96.87 Br2 N4 O3.22 | P 1 21/n 1 | 9.3343; 17.7848; 20.1423 90; 95.674; 90 | 3327.41 | Rottschäfer, Dennis; Neumann, Beate; Stammler, Hans-Georg; Andrada, Diego M.; Ghadwal, Rajendra S. Kekulé diradicaloids derived from a classical N-heterocyclic carbene. Chemical science, 2018, 9, 4970-4976 |
| 1549304 | CIF | C28 H18 N2 O | P 1 21/c 1 | 7.463; 23.83; 11.556 90; 101.301; 90 | 2015.3 | Zang, Qiguang; Yu, Jiayi; Yu, Wenbin; Qian, Jun; Hu, Rongrong; Tang, Ben Zhong Red-emissive azabenzanthrone derivatives for photodynamic therapy irradiated with ultralow light power density and two-photon imaging. Chemical science, 2018, 9, 5165-5171 |
| 1549305 | CIF | C28 H18 N2 O | P -1 | 7.1516; 8.5555; 16.6112 100.052; 95.016; 90.498 | 996.63 | Zang, Qiguang; Yu, Jiayi; Yu, Wenbin; Qian, Jun; Hu, Rongrong; Tang, Ben Zhong Red-emissive azabenzanthrone derivatives for photodynamic therapy irradiated with ultralow light power density and two-photon imaging. Chemical science, 2018, 9, 5165-5171 |
| 1549306 | CIF | C366 H508 Cd24 N24 O178 Tb8 | P 4/n :2 | 30.0936; 30.0936; 39.3554 90; 90; 90 | 35641.2 | Yang, Xiaoping; Wang, Shiqing; Zhang, Yali; Liang, Guang; Zhu, Ting; Zhang, Lijie; Huang, Shaoming; Schipper, Desmond; Jones, Richard A. A self-assembling luminescent lanthanide molecular nanoparticle with potential for live cell imaging. Chemical science, 2018, 9, 4630-4637 |
| 1549307 | CIF | C386 H560 Cd24 N24 O190 Tb8 | F d d d :2 | 54.777; 61.944; 79.935 90; 90; 90 | 271228 | Yang, Xiaoping; Wang, Shiqing; Zhang, Yali; Liang, Guang; Zhu, Ting; Zhang, Lijie; Huang, Shaoming; Schipper, Desmond; Jones, Richard A. A self-assembling luminescent lanthanide molecular nanoparticle with potential for live cell imaging. Chemical science, 2018, 9, 4630-4637 |
| 1549308 | CIF | C1714.04 H2526.4 Cd96 N96 O683.24 Tb32 | F d d d :2 | 54.621; 61.479; 100.21 90; 90; 90 | 336510 | Yang, Xiaoping; Wang, Shiqing; Zhang, Yali; Liang, Guang; Zhu, Ting; Zhang, Lijie; Huang, Shaoming; Schipper, Desmond; Jones, Richard A. A self-assembling luminescent lanthanide molecular nanoparticle with potential for live cell imaging. Chemical science, 2018, 9, 4630-4637 |
| 1549309 | CIF | C386 H500 Cd24 N24 O177 Tb8 | P -4 n 2 | 42.806; 42.806; 37.886 90; 90; 90 | 69421 | Yang, Xiaoping; Wang, Shiqing; Zhang, Yali; Liang, Guang; Zhu, Ting; Zhang, Lijie; Huang, Shaoming; Schipper, Desmond; Jones, Richard A. A self-assembling luminescent lanthanide molecular nanoparticle with potential for live cell imaging. Chemical science, 2018, 9, 4630-4637 |
| 1549310 | CIF | C50 H103 K Mn O14 | P -1 | 11.5253; 16.1662; 16.7311 81.943; 88.463; 69.635 | 2892.8 | Halbach, Robert L.; Gygi, David; Bloch, Eric D.; Anderson, Bryce L.; Nocera, Daniel G. Structurally characterized terminal manganese(iv) oxo tris(alkoxide) complex. Chemical science, 2018, 9, 4524-4528 |
| 1549311 | CIF | C50 H103 K Mn O13 | P 1 21/n 1 | 11.3584; 17.2479; 29.111 90; 91.552; 90 | 5701 | Halbach, Robert L.; Gygi, David; Bloch, Eric D.; Anderson, Bryce L.; Nocera, Daniel G. Structurally characterized terminal manganese(iv) oxo tris(alkoxide) complex. Chemical science, 2018, 9, 4524-4528 |
| 1549312 | CIF | C38 H79 K Mn O5 | C 1 2/c 1 | 18.3234; 15.9361; 16.771 90; 122.093; 90 | 4148.8 | Halbach, Robert L.; Gygi, David; Bloch, Eric D.; Anderson, Bryce L.; Nocera, Daniel G. Structurally characterized terminal manganese(iv) oxo tris(alkoxide) complex. Chemical science, 2018, 9, 4524-4528 |
| 1549313 | CIF | C62 H46 B F24 Na O9 | P -1 | 14.295; 14.544; 17.347 100.67; 107.46; 105.51 | 3174 | Löw, Henrik; Mena-Osteritz, Elena; von Delius, Max Self-assembled orthoester cryptands: orthoester scope, post-functionalization, kinetic locking and tunable degradation kinetics. Chemical science, 2018, 9, 4785-4793 |
| 1549314 | CIF | C58 H46 B F24 Na O9 | P b c a | 19.142; 24.665; 26.029 90; 90; 90 | 12289 | Löw, Henrik; Mena-Osteritz, Elena; von Delius, Max Self-assembled orthoester cryptands: orthoester scope, post-functionalization, kinetic locking and tunable degradation kinetics. Chemical science, 2018, 9, 4785-4793 |
| 1549315 | CIF | C62 H52 B F30 Na O9 | P 1 21/n 1 | 20.158; 17.085; 20.698 90; 101.158; 90 | 6994 | Löw, Henrik; Mena-Osteritz, Elena; von Delius, Max Self-assembled orthoester cryptands: orthoester scope, post-functionalization, kinetic locking and tunable degradation kinetics. Chemical science, 2018, 9, 4785-4793 |
| 1549316 | CIF | C65 H75 B F24 Na O9 Si2 | P -1 | 13.9002; 14.0497; 21.1609 101.417; 103.6; 101.486 | 3804.07 | Löw, Henrik; Mena-Osteritz, Elena; von Delius, Max Self-assembled orthoester cryptands: orthoester scope, post-functionalization, kinetic locking and tunable degradation kinetics. Chemical science, 2018, 9, 4785-4793 |
| 1549317 | CIF | C46 H38 B F24 Li O9 | P 21 21 21 | 12.8768; 17.6754; 22.1097 90; 90; 90 | 5032.2 | Löw, Henrik; Mena-Osteritz, Elena; von Delius, Max Self-assembled orthoester cryptands: orthoester scope, post-functionalization, kinetic locking and tunable degradation kinetics. Chemical science, 2018, 9, 4785-4793 |
| 1549318 | CIF | C102 H78 B2 Cl6 F48 Na2 O18 | P -1 | 16.654; 18.497; 20.536 70.108; 83.341; 89.951 | 5903 | Löw, Henrik; Mena-Osteritz, Elena; von Delius, Max Self-assembled orthoester cryptands: orthoester scope, post-functionalization, kinetic locking and tunable degradation kinetics. Chemical science, 2018, 9, 4785-4793 |
| 1549319 | CIF | C50 H41.87 B Cl8 F24 Na O9 | P 1 21/c 1 | 13.0127; 19.6275; 25.4722 90; 96.246; 90 | 6467.2 | Löw, Henrik; Mena-Osteritz, Elena; von Delius, Max Self-assembled orthoester cryptands: orthoester scope, post-functionalization, kinetic locking and tunable degradation kinetics. Chemical science, 2018, 9, 4785-4793 |
| 1549320 | CIF | C54 H54 B F24 Na O9 | P -1 | 12.434; 12.984; 20.025 93.798; 107.54; 104.457 | 2949.7 | Löw, Henrik; Mena-Osteritz, Elena; von Delius, Max Self-assembled orthoester cryptands: orthoester scope, post-functionalization, kinetic locking and tunable degradation kinetics. Chemical science, 2018, 9, 4785-4793 |
| 1549321 | CIF | C36 H26 Cl2 N2 O8 | P -1 | 7.4655; 10.993; 11.026 111.9; 95.16; 108.53 | 773.4 | Ortega, Gabriela; Hernández, Jesús; González, Teresa; Dorta, Romano; Briceño, Alexander 1,2,4,5-Benzenetetracarboxylic acid: a versatile hydrogen bonding template for controlling the regioselective topochemical synthesis of head-to-tail photodimers from stilbazole derivatives. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 670-680 |
| 1549322 | CIF | C36 H24 Cl4 N2 O8 | P -1 | 7.5046; 9.6822; 12.452 69.07; 79.63; 77.91 | 820.8 | Ortega, Gabriela; Hernández, Jesús; González, Teresa; Dorta, Romano; Briceño, Alexander 1,2,4,5-Benzenetetracarboxylic acid: a versatile hydrogen bonding template for controlling the regioselective topochemical synthesis of head-to-tail photodimers from stilbazole derivatives. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 670-680 |
| 1549323 | CIF | C36 H26 Br2 N2 O8 | P -1 | 7.4131; 10.094; 12.181 113.45; 99.1; 101 | 792.6 | Ortega, Gabriela; Hernández, Jesús; González, Teresa; Dorta, Romano; Briceño, Alexander 1,2,4,5-Benzenetetracarboxylic acid: a versatile hydrogen bonding template for controlling the regioselective topochemical synthesis of head-to-tail photodimers from stilbazole derivatives. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 670-680 |
| 1549324 | CIF | C38 H26 N4 O8 | P -1 | 7.9462; 9.1625; 11.719 101.68; 102.13; 97.57 | 803.3 | Ortega, Gabriela; Hernández, Jesús; González, Teresa; Dorta, Romano; Briceño, Alexander 1,2,4,5-Benzenetetracarboxylic acid: a versatile hydrogen bonding template for controlling the regioselective topochemical synthesis of head-to-tail photodimers from stilbazole derivatives. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 670-680 |
| 1549325 | CIF | C36 H26 Br2 N2 O8 | P -1 | 7.8733; 9.936; 11.49 106.03; 108.74; 96.25 | 798.6 | Ortega, Gabriela; Hernández, Jesús; González, Teresa; Dorta, Romano; Briceño, Alexander 1,2,4,5-Benzenetetracarboxylic acid: a versatile hydrogen bonding template for controlling the regioselective topochemical synthesis of head-to-tail photodimers from stilbazole derivatives. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 670-680 |
| 1549326 | CIF | C38 H26 N4 O8 | P 1 21/c 1 | 13.513; 6.434; 18.566 90; 101.85; 90 | 1579.8 | Ortega, Gabriela; Hernández, Jesús; González, Teresa; Dorta, Romano; Briceño, Alexander 1,2,4,5-Benzenetetracarboxylic acid: a versatile hydrogen bonding template for controlling the regioselective topochemical synthesis of head-to-tail photodimers from stilbazole derivatives. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 670-680 |
| 1549327 | CIF | C36 H26 Cl2 N2 O8 | P -1 | 8.9176; 9.7483; 10.094 64.4; 89.6; 88.69 | 791.1 | Ortega, Gabriela; Hernández, Jesús; González, Teresa; Dorta, Romano; Briceño, Alexander 1,2,4,5-Benzenetetracarboxylic acid: a versatile hydrogen bonding template for controlling the regioselective topochemical synthesis of head-to-tail photodimers from stilbazole derivatives. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 670-680 |
| 1549328 | CIF | C38 H26 N4 O8 | P 1 21/c 1 | 8.8116; 11.811; 15.299 90; 107.37; 90 | 1519.6 | Ortega, Gabriela; Hernández, Jesús; González, Teresa; Dorta, Romano; Briceño, Alexander 1,2,4,5-Benzenetetracarboxylic acid: a versatile hydrogen bonding template for controlling the regioselective topochemical synthesis of head-to-tail photodimers from stilbazole derivatives. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 670-680 |
| 1549329 | CIF | C28 H20 N4 | P 1 21/c 1 | 8.1413; 11.929; 11.41 90; 107.94; 90 | 1054.2 | Ortega, Gabriela; Hernández, Jesús; González, Teresa; Dorta, Romano; Briceño, Alexander 1,2,4,5-Benzenetetracarboxylic acid: a versatile hydrogen bonding template for controlling the regioselective topochemical synthesis of head-to-tail photodimers from stilbazole derivatives. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 670-680 |
| 1549330 | CIF | C36 H26 Cl2 N2 O8 | P 1 21/c 1 | 9.773; 10.033; 16.112 90; 97.83; 90 | 1565.1 | Ortega, Gabriela; Hernández, Jesús; González, Teresa; Dorta, Romano; Briceño, Alexander 1,2,4,5-Benzenetetracarboxylic acid: a versatile hydrogen bonding template for controlling the regioselective topochemical synthesis of head-to-tail photodimers from stilbazole derivatives. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 670-680 |
| 1549331 | CIF | C18 H13 Cl N O4 | P 1 21/c 1 | 9.6552; 12.927; 13.746 90; 114.53; 90 | 1560.8 | Ortega, Gabriela; Hernández, Jesús; González, Teresa; Dorta, Romano; Briceño, Alexander 1,2,4,5-Benzenetetracarboxylic acid: a versatile hydrogen bonding template for controlling the regioselective topochemical synthesis of head-to-tail photodimers from stilbazole derivatives. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 670-680 |
| 1549332 | CIF | C8 H12 Br2 Cl3 N O | C 1 2/c 1 | 18.3209; 12.3996; 12.1068 90; 98.766; 90 | 2718.2 | Wappes, Ethan A.; Vanitcha, Avassaya; Nagib, David A. β C-H di-halogenation <i>via</i> iterative hydrogen atom transfer. Chemical science, 2018, 9, 4500-4504 |
| 1549333 | CIF | C48 H57 B N2 O | P -1 | 12.799; 13.808; 13.844 64.938; 70.414; 66.334 | 1989.3 | Böhnke, Julian; Brückner, Tobias; Hermann, Alexander; González-Belman, Oscar F; Arrowsmith, Merle; Jiménez-Halla, J Oscar C; Braunschweig, Holger Single and double activation of acetone by isolobal B[triple bond, length as m-dash]N and B[triple bond, length as m-dash]B triple bonds. Chemical science, 2018, 9, 5354-5359 |
| 1549334 | CIF | C43 H68 B2 N2 O | P 1 21/n 1 | 9.499; 22.755; 19.041 90; 91.58; 90 | 4114 | Böhnke, Julian; Brückner, Tobias; Hermann, Alexander; González-Belman, Oscar F; Arrowsmith, Merle; Jiménez-Halla, J Oscar C; Braunschweig, Holger Single and double activation of acetone by isolobal B[triple bond, length as m-dash]N and B[triple bond, length as m-dash]B triple bonds. Chemical science, 2018, 9, 5354-5359 |
| 1549335 | CIF | C45 H52 B Cl N2 | C 1 2/c 1 | 26.74; 9.4128; 30.763 90; 100.73; 90 | 7608 | Böhnke, Julian; Brückner, Tobias; Hermann, Alexander; González-Belman, Oscar F; Arrowsmith, Merle; Jiménez-Halla, J Oscar C; Braunschweig, Holger Single and double activation of acetone by isolobal B[triple bond, length as m-dash]N and B[triple bond, length as m-dash]B triple bonds. Chemical science, 2018, 9, 5354-5359 |
| 1549336 | CIF | C51.5 H72 B2 N4 O | P -1 | 10.756; 12.715; 18.183 81.15; 87.75; 68.37 | 2284 | Böhnke, Julian; Brückner, Tobias; Hermann, Alexander; González-Belman, Oscar F; Arrowsmith, Merle; Jiménez-Halla, J Oscar C; Braunschweig, Holger Single and double activation of acetone by isolobal B[triple bond, length as m-dash]N and B[triple bond, length as m-dash]B triple bonds. Chemical science, 2018, 9, 5354-5359 |
| 1549337 | CIF | C45 H51 B N2 | P 1 21/c 1 | 12.303; 12.532; 24.192 90; 100.95; 90 | 3662 | Böhnke, Julian; Brückner, Tobias; Hermann, Alexander; González-Belman, Oscar F; Arrowsmith, Merle; Jiménez-Halla, J Oscar C; Braunschweig, Holger Single and double activation of acetone by isolobal B[triple bond, length as m-dash]N and B[triple bond, length as m-dash]B triple bonds. Chemical science, 2018, 9, 5354-5359 |
| 1549338 | CIF | C19 H21 O2 S | P 1 21 1 | 6.612; 7.8997; 15.4119 90; 92.455; 90 | 804.27 | Cheng, Fengchang; Lu, Wenxin; Huang, Wei; Wen, Lu; Li, Mingfeng; Meng, Fanke Cu-catalyzed enantioselective synthesis of tertiary benzylic copper complexes and their <i>in situ</i> addition to carbonyl compounds. Chemical science, 2018, 9, 4992-4998 |
| 1549339 | CIF | C24 H27 B O4 | P 1 21 1 | 12.5495; 6.3424; 13.2506 90; 92.671; 90 | 1053.52 | Cheng, Fengchang; Lu, Wenxin; Huang, Wei; Wen, Lu; Li, Mingfeng; Meng, Fanke Cu-catalyzed enantioselective synthesis of tertiary benzylic copper complexes and their <i>in situ</i> addition to carbonyl compounds. Chemical science, 2018, 9, 4992-4998 |
| 1549340 | CIF HKL Paper | C11 H6 F5 N O | P b c m | 13.1081; 11.1491; 7.1798 90; 90; 90 | 1049.3 | Zhao, Hui 3-Difluoromethyl-5-[4-(trifluoromethyl)phenyl]isoxazole IUCrData, 2018, 3, x180445 |
| 1549341 | CIF HKL Paper | C56 H50 N2 | P -1 | 10.4026; 13.6115; 16.5769 105.502; 105.796; 94.038 | 2150.3 | Adas, Sonya K.; Peloquin, Andrew J.; Iacono, Scott T.; Balaich, Gary J. 9-(3,5-Dimethylbenzylidene)-8-(3,5-dimethylphenyl)-1,3,5,7-tetraphenyl-2,4,7,8-tetrahydro-4,7-methanoazulene acetonitrile disolvate IUCrData, 2018, 3, x180553 |
| 1549342 | CIF HKL Paper | C16 H19 N5 O | P 1 21/c 1 | 15.8299; 10.627; 9.2041 90; 98.084; 90 | 1532.97 | Abad, Nadeem; Ramli, Youssef; Sebbar, Nada Kheira; Kaur, Manpreet; Essassi, El Mokhtar; Jasinski, Jerry P. 1-[(1-Butyl-1<i>H</i>-1,2,3-triazol-5-yl)methyl]-3-methylquinoxalin-2(1<i>H</i>)-one IUCrData, 2018, 3, x180482 |
| 1549343 | CIF HKL Paper | C18 H22 | P -1 | 7.9315; 8.2047; 12.3474 108.513; 98.09; 103.805 | 719.18 | Brieger, Lukas; Unkelbach, Christian; Strohmann, Carsten 1,2-Bis(3,5-dimethylphenyl)ethane IUCrData, 2018, 3, x180636 |
| 1549344 | CIF HKL Paper | C15 H14 Br2 | P 1 21 1 | 7.4526; 5.8441; 16.278 90; 101.808; 90 | 694 | Peloquin, Andrew J.; Godman, Nicholas P.; Allison, Bruce D.; Balaich, Gary J.; Iacono, Scott T. 1,3-Bis(4-bromophenyl)propane IUCrData, 2018, 3, x180563 |
| 1549345 | CIF HKL Paper | C15 H12 Cl N O2 | P -1 | 7.2162; 8.0068; 11.65 80.123; 84.57; 88.084 | 660.1 | Zhong, Ling; Shi, Jianyou; Zhong, Lei; Wei, Xin; Xhang, Hongjia; Cheng, Liang; Bai, Lan 2-(3-Chlorophenyl)-3,4-dihydrobenzo[<i>f</i>][1,4]oxazepin-5(2<i>H</i>)-one IUCrData, 2018, 3, x180587 |
| 1549346 | CIF HKL Paper | C16 H20 N2 O2 | P -1 | 8.8546; 8.9841; 9.5523 98.481; 96.412; 106.772 | 710 | El Foujji, Laila; Sebhaoui, Jihad; El Bakri, Youness; El Ghayati, L'houssaine; Essassi, El Mokhtar; Mague, Joel T. (3<i>R</i>,4<i>Z</i>)-1,3-Diethyl-4-(2-oxopropylidene)-2,3,4,5-tetrahydro-1<i>H</i>-1,5-benzodiazepin-2-one IUCrData, 2018, 3, x180515 |
| 1549347 | CIF HKL Paper | C17 H16 O | P 1 21/c 1 | 9.6483; 10.606; 13.4332 90; 104.034; 90 | 1333.59 | Seidel, Nadine; Seichter, Wilhelm; Weber, Edwin 1-Methoxy-1,1-diphenylbut-2-yne IUCrData, 2018, 3, x180415 |
| 1549348 | CIF HKL Paper | C13 H15 N5 O2 S | P b c a | 18.2763; 7.5909; 20.0571 90; 90; 90 | 2782.59 | Choudhury, Manisha; Viswanathan, Vijayan; Timiri, Ajay Kumar; Sinha, Barij Nayan; Jeyaprakash, Venkatesan; Velmurugan, Devadasan 2-[(4,6-Diaminopyrimidin-2-yl)sulfanyl]-<i>N</i>-(4-methoxyphenyl)acetamide IUCrData, 2018, 3, x180600 |
| 1549349 | CIF HKL Paper | C18 H16 N2 O3 | P 1 21/c 1 | 18.171; 4.9012; 16.9492 90; 91.923; 90 | 1508.64 | Abad, Nadeem; El Bakri, Youness; Sebhaoui, Jihad; Ramli, Youssef; Essassi, El Mokhtar; Mague, Joel T. Ethyl 2-(2-oxo-3-phenyl-1,2-dihydroquinoxalin-1-yl)acetate IUCrData, 2018, 3, x180519 |
| 1549350 | CIF HKL Paper | C27 H37 Cl N2 O4 | P c c n | 11.0729; 12.6284; 19.6141 90; 90; 90 | 2742.7 | Minaker, Samuel A.; Wang, Ruiyao; Aquino, Manuel A. S. 1,3-Bis(2,6-diisopropylphenyl)imidazolium perchlorate IUCrData, 2018, 3, x180516 |
| 1549351 | CIF HKL Paper | C12 H14 N2 O3 | P -1 | 4.8082; 8.26; 14.413 84.072; 81.473; 85.14 | 561.7 | Abad, Nadeem; Sebhaoui, Jihad; El Bakri, Youness; Ramli, Youssef; Essassi, El Mokhtar; Mague, Joel T. Ethyl 2-(3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)acetate IUCrData, 2018, 3, x180596 |
| 1549352 | CIF HKL Paper | C47.8 H42 Au Co2 F12.6 Fe2 N6 O5.4 P1.2 S1.8 | P -1 | 12.1395; 13.8587; 17.366 85.994; 80.863; 66.136 | 2637.9 | Vanicek, Stefan; Wurst, Klaus; Kopacka, Holger; Bildstein, Benno Bis(4-cobaltoceniumyl-1-ferrocenyl-3-methyl-1,2,3-triazolylidene)gold(I) hexafluoridophosphate‒trifluoromethanesulfonate (1.2/1.8) IUCrData, 2018, 3, x180623 |
| 1549353 | CIF HKL Paper | C21.2 H22.4 Cl6.4 Co3 | P -1 | 18.1419; 19.9967; 20.3048 79.631; 78.398; 63.844 | 6441.7 | Shaw, Michael J.; Xu, Nan; Caveny, Ian E.; Abucayon, Erwin G.; Ramuglia, Anthony R.; Richter-Addo, George B. Bis(cobaltocenium) tetrachloridocobaltate(II) dichloromethane 1.2-solvate IUCrData, 2018, 3, x180552 |
| 1549354 | CIF HKL Paper | C17 H14 N2 O2 | P 1 21 1 | 12.7853; 7.0167; 15.4215 90; 95.718; 90 | 1376.59 | Abad, Nadeem; El Bakri, Youness; Sebhaoui, Jihad; Ramli, Youssef; Essassi, El Mokhtar; Mague, Joel T. 1-[(Oxiran-2-yl)methyl]-3-phenyl-1,2-dihydroquinoxalin-2-one IUCrData, 2018, 3, x180610 |
| 1549355 | CIF HKL Paper | C28 H20 Br2 O | P 21 21 21 | 9.4301; 9.4561; 24.8572 90; 90; 90 | 2216.6 | Seidel, Nadine; Seichter, Wilhelm; Weber, Edwin 3,4-Dibromo-2,2,5,5-tetraphenyl-2,5-dihydrofuran IUCrData, 2018, 3, x180416 |
| 1549356 | CIF HKL Paper | C56 H52 As2 Cl6 N4 Zr | P 1 21/c 1 | 9.6505; 19.378; 15.1026 90; 97.849; 90 | 2797.8 | Borjas, Rosendo; Mariappan Balasekaran, Samundeeswari; Poineau, Frederic Bis(tetraphenylarsonium) hexachloridozirconate(IV) acetonitrile tetrasolvate IUCrData, 2018, 3, x180528 |
| 1549357 | CIF | C37 H54 Ir N P2 | P -1 | 9.1192; 10.6683; 17.8231 93.18; 92.823; 95.767 | 1719.89 | Kumar, Amit; Feller, Moran; Ben-David, Yehoshoa; Diskin-Posner, Yael; Milstein, David Formal oxidative addition of a C-H bond by a 16e iridium(i) complex involves metal-ligand cooperation. Chemical communications (Cambridge, England), 2018, 54, 5365-5368 |
| 1549358 | CIF HKL Paper | C16 H24 Br4 N2 Zn | P n a 21 | 11.0702; 26.0585; 7.7302 90; 90; 90 | 2229.95 | Aarthi, Ramkumar; Thiruvalluvar, Aravazhi Amalan; Ramachandra Raja, Chidambaram Bis(4-methylbenzylammonium) tetrabromidozincate IUCrData, 2018, 3, x180648 |
| 1549359 | CIF HKL Paper | Br F4 K | I 4/m c m | 6.0999; 6.0999; 11.0509 90; 90; 90 | 411.19 | Ivlev, Sergei I.; Kraus, Florian Redetermination of the crystal structure of K[BrF4] from single-crystal X-ray diffraction data IUCrData, 2018, 3 |
| 1549360 | CIF | Ba Er2 O5 Zn | P n m a | 12.30316; 5.69665; 7.04766 90; 90; 90 | 493.948 | Nakamura, K.; Fujii, K.; Niwa, E.; Yashima, M. Crystal structure and electrical conductivity of BaR2ZnO5 (R=Sm, Gd, Dy, Ho, and Er) - a new structure family of oxide-ion conductors Journal of the Ceramic Society of Japan, 2018, 126, 292-299 |
| 1549361 | CIF | Ba Dy2 O5 Zn | P n m a | 12.37206; 5.72443; 7.08598 90; 90; 90 | 501.85 | Nakamura, K.; Fujii, K.; Niwa, E.; Yashima, M. Crystal structure and electrical conductivity of BaR2ZnO5 (R=Sm, Gd, Dy, Ho, and Er) - a new structure family of oxide-ion conductors Journal of the Ceramic Society of Japan, 2018, 126, 292-299 |
| 1549362 | CIF | Ba Gd2 O5 Zn | P n m a | 12.49739; 5.77627; 7.15961 90; 90; 90 | 516.84 | Nakamura, K.; Fujii, K.; Niwa, E.; Yashima, M. Crystal structure and electrical conductivity of BaR2ZnO5 (R=Sm, Gd, Dy, Ho, and Er) - a new structure family of oxide-ion conductors Journal of the Ceramic Society of Japan, 2018, 126, 292-299 |
| 1549363 | CIF | Ba Ho2 O5 Zn | P n m a | 12.34773; 5.71449; 7.07449 90; 90; 90 | 499.183 | Nakamura, K.; Fujii, K.; Niwa, E.; Yashima, M. Crystal structure and electrical conductivity of BaR2ZnO5 (R=Sm, Gd, Dy, Ho, and Er) - a new structure family of oxide-ion conductors Journal of the Ceramic Society of Japan, 2018, 126, 292-299 |
| 1549364 | CIF | Ba O5 Sm2 Zn | P n m a | 12.59242; 5.81502; 7.20736 90; 90; 90 | 527.76 | Nakamura, K.; Fujii, K.; Niwa, E.; Yashima, M. Crystal structure and electrical conductivity of BaR2ZnO5 (R=Sm, Gd, Dy, Ho, and Er) - a new structure family of oxide-ion conductors Journal of the Ceramic Society of Japan, 2018, 126, 292-299 |
| 1549365 | CIF | O7 Ti2 Yb2 | F d -3 m | 10.133798; 10.133798; 10.133798 90; 90; 90 | 1040.68 | Uno, W.; Fujii, K.; Niwa, E.; Torii, S.; Miao, P.; Kamiyama, T.; Yashima, M. Experimental visualization of oxide-ion diffusion paths in pyrochlore-type Yb2Ti2O7 : sample at 1173 K Journal of the Ceramic Society of Japan, 2018, 126, 341-345 |
| 1549366 | CIF | O7 Ti2 Yb2 | F d -3 m | 10.03441; 10.03441; 10.03441 90; 90; 90 | 1010.36 | Uno, W.; Fujii, K.; Niwa, E.; Torii, S.; Miao, P.; Kamiyama, T.; Yashima, M. Experimental visualization of oxide-ion diffusion paths in pyrochlore-type Yb2Ti2O7 Journal of the Ceramic Society of Japan, 2018, 126, 341-345 |
| 1549367 | CIF | C54 H42 Co N4 O4 | P 1 21/c 1 | 14.361; 9.517; 15.449 90; 99.257; 90 | 2084 | Wang, Zikuan; Yao, Zhengmin; Lyu, Zeyu; Xiong, Qinsi; Wang, Bingwu; Fu, Xuefeng Thermodynamic and reactivity studies of a tin corrole-cobalt porphyrin heterobimetallic complex. Chemical science, 2018, 9, 4999-5007 |
| 1549368 | CIF | C62 H48 Co F N4 O4 | P c a 21 | 21.495; 13.598; 16.434 90; 90; 90 | 4803.5 | Wang, Zikuan; Yao, Zhengmin; Lyu, Zeyu; Xiong, Qinsi; Wang, Bingwu; Fu, Xuefeng Thermodynamic and reactivity studies of a tin corrole-cobalt porphyrin heterobimetallic complex. Chemical science, 2018, 9, 4999-5007 |
| 1549369 | CIF | C85 H44 Co F15 N8 O4 Sn | P 1 21/c 1 | 17.25; 13.082; 32.044 90; 96.735; 90 | 7181 | Wang, Zikuan; Yao, Zhengmin; Lyu, Zeyu; Xiong, Qinsi; Wang, Bingwu; Fu, Xuefeng Thermodynamic and reactivity studies of a tin corrole-cobalt porphyrin heterobimetallic complex. Chemical science, 2018, 9, 4999-5007 |
| 1549370 | CIF | C74 H16 F30 N8 O Sn2 | P -1 | 12.8962; 15.333; 21.248 101.533; 90.07; 106.286 | 3944.2 | Wang, Zikuan; Yao, Zhengmin; Lyu, Zeyu; Xiong, Qinsi; Wang, Bingwu; Fu, Xuefeng Thermodynamic and reactivity studies of a tin corrole-cobalt porphyrin heterobimetallic complex. Chemical science, 2018, 9, 4999-5007 |
| 1549371 | CIF | C94 H52 Co F15 N8 O5 Sn | P -1 | 15.523; 16.499; 20.024 93.436; 111.524; 102.953 | 4591.9 | Wang, Zikuan; Yao, Zhengmin; Lyu, Zeyu; Xiong, Qinsi; Wang, Bingwu; Fu, Xuefeng Thermodynamic and reactivity studies of a tin corrole-cobalt porphyrin heterobimetallic complex. Chemical science, 2018, 9, 4999-5007 |
| 1549372 | CIF | C12 H9 N3 O2 S | P 1 21 1 | 10.77117; 11.01902; 11.43023 90; 117.742; 90 | 1200.68 | Tan, Melissa; Shtukenberg, Alexander G.; Zhu, Shengcai; Xu, Wenqian; Dooryhee, Eric; Nichols, Shane M.; Ward, Michael D.; Kahr, Bart; Zhu, Qiang ROY revisited, again: the eighth solved structure. Faraday discussions, 2018, 211, 477-491 |
| 1549373 | CIF | C22 H17 N O9 | P c a 21 | 7.0231; 17.534; 14.6817 90; 90; 90 | 1807.9 | Panter, Fabian; Krug, Daniel; Baumann, Sascha; Müller, Rolf Self-resistance guided genome mining uncovers new topoisomerase inhibitors from myxobacteria. Chemical science, 2018, 9, 4898-4908 |
| 1549374 | CIF | C22 H17 N O9 | P -1 | 7.0902; 7.9097; 17.33 89.561; 84.797; 74.655 | 933.2 | Panter, Fabian; Krug, Daniel; Baumann, Sascha; Müller, Rolf Self-resistance guided genome mining uncovers new topoisomerase inhibitors from myxobacteria. Chemical science, 2018, 9, 4898-4908 |
| 1549375 | CIF | C54 H33 Cl Ir N6 S2 | P 1 21/n 1 | 14.6864; 15.1284; 29.6362 90; 99.037; 90 | 6502.9 | Guan, Ruilin; Chen, Yu; Zeng, Leli; Rees, Thomas W.; Jin, Chengzhi; Huang, Juanjuan; Chen, Zhe-Sheng; Ji, Liangnian; Chao, Hui Oncosis-inducing cyclometalated iridium(iii) complexes. Chemical science, 2018, 9, 5183-5190 |
| 1549376 | CIF | C19 H13 Br F3 N O3 S | P 61 | 16.963; 16.963; 11.4256 90; 90; 120 | 2847.2 | Greenhalgh, 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 |
| 1549377 | CIF | C27 H42 Cl4 N2 Pd | I 41/a :2 | 27.4219; 27.4219; 15.9884 90; 90; 90 | 12022.7 | Zheng, Ting; Liao, Heng; Gao, Jie; Zhong, Liu; Gao, Haiyang; Wu, Qing Synthesis and characterization of α-diamine palladium complexes and insight into hybridization effects of nitrogen donor atoms on norbornene (co)polymerizations Polymer Chemistry, 2018, 9, 3088 |
| 1549378 | CIF | C20 H28 Cl2 N2 Pd | P b c a | 13.5058; 13.9638; 21.6147 90; 90; 90 | 4076.4 | Zheng, Ting; Liao, Heng; Gao, Jie; Zhong, Liu; Gao, Haiyang; Wu, Qing Synthesis and characterization of α-diamine palladium complexes and insight into hybridization effects of nitrogen donor atoms on norbornene (co)polymerizations Polymer Chemistry, 2018, 9, 3088 |
| 1549379 | CIF | C36 H46 Cl2 N2 O Pd | P n m a | 11.5645; 21.3415; 13.8095 90; 90; 90 | 3408.24 | Zheng, Ting; Liao, Heng; Gao, Jie; Zhong, Liu; Gao, Haiyang; Wu, Qing Synthesis and characterization of α-diamine palladium complexes and insight into hybridization effects of nitrogen donor atoms on norbornene (co)polymerizations Polymer Chemistry, 2018, 9, 3088 |
| 1549380 | CIF | C28 H30 Cl2 N2 O Pd | P 1 21/n 1 | 14.0031; 17.0473; 21.8047 90; 102.678; 90 | 5078.2 | Zheng, Ting; Liao, Heng; Gao, Jie; Zhong, Liu; Gao, Haiyang; Wu, Qing Synthesis and characterization of α-diamine palladium complexes and insight into hybridization effects of nitrogen donor atoms on norbornene (co)polymerizations Polymer Chemistry, 2018, 9, 3088 |
| 1549381 | CIF HKL Paper | C15 H11 N3 O4 | P 1 21/c 1 | 12.8698; 8.1365; 13.0309 90; 107.275; 90 | 1302.98 | AaminaNaaz, Y.; Kamalraja, Jayabal; Perumal, Paramasivam T.; SubbiahPandi, A. 5'-Nitro-1,4-dihydrospiro[3,1-benzoxazine-2,3'-indolin]-2'-one IUCrData, 2018, 3, x180664 |
| 1549382 | CIF | C21 H29 N O3 S Si | P 1 21/n 1 | 11.6959; 16.06; 11.9522 90; 91.981; 90 | 2243.71 | Jayaraman, Arumugam; Misal Castro, Luis C.; Desrosiers, Vincent; Fontaine, Frédéric-Georges Metal-free borylative dearomatization of indoles: exploring the divergent reactivity of aminoborane C-H borylation catalysts. Chemical science, 2018, 9, 5057-5063 |
| 1549383 | CIF | C21 H25 B F N O4 S | P 1 21/c 1 | 10.5498; 19.255; 10.4914 90; 105.495; 90 | 2053.72 | Jayaraman, Arumugam; Misal Castro, Luis C.; Desrosiers, Vincent; Fontaine, Frédéric-Georges Metal-free borylative dearomatization of indoles: exploring the divergent reactivity of aminoborane C-H borylation catalysts. Chemical science, 2018, 9, 5057-5063 |
| 1549384 | CIF | C48 H78 Co Li2 Ni O18 | P -1 | 11.4322; 12.2773; 12.5149 103.535; 107.265; 110.653 | 1452.5 | Han, Haixiang; Wei, Zheng; Barry, Matthew C.; Carozza, Jesse C.; Alkan, Melisa; Rogachev, Andrey Yu; Filatov, Alexander S.; Abakumov, Artem M.; Dikarev, Evgeny V. A three body problem: a genuine hetero<i>tri</i>metallic molecule <i>vs.</i> a mixture of two parent hetero<i>bi</i>metallic molecules. Chemical science, 2018, 9, 4736-4745 |
| 1549385 | CIF | C48 H78 Li2 Ni2 O18 | P -1 | 11.408; 12.249; 12.519 103.477; 107.088; 110.797 | 1447.5 | Han, Haixiang; Wei, Zheng; Barry, Matthew C.; Carozza, Jesse C.; Alkan, Melisa; Rogachev, Andrey Yu; Filatov, Alexander S.; Abakumov, Artem M.; Dikarev, Evgeny V. A three body problem: a genuine hetero<i>tri</i>metallic molecule <i>vs.</i> a mixture of two parent hetero<i>bi</i>metallic molecules. Chemical science, 2018, 9, 4736-4745 |
| 1549386 | CIF | C48 H78 Li2 Mg1.07 Ni0.93 O18 | P -1 | 11.5228; 12.2661; 12.5357 103.595; 106.954; 111.073 | 1462.29 | Han, Haixiang; Wei, Zheng; Barry, Matthew C.; Carozza, Jesse C.; Alkan, Melisa; Rogachev, Andrey Yu; Filatov, Alexander S.; Abakumov, Artem M.; Dikarev, Evgeny V. A three body problem: a genuine hetero<i>tri</i>metallic molecule <i>vs.</i> a mixture of two parent hetero<i>bi</i>metallic molecules. Chemical science, 2018, 9, 4736-4745 |
| 1549387 | CIF | C48 H78 Co1.06 Li2 Mg0.94 O18 | P -1 | 11.5502; 12.2971; 12.5192 103.554; 107.079; 110.959 | 1468.06 | Han, Haixiang; Wei, Zheng; Barry, Matthew C.; Carozza, Jesse C.; Alkan, Melisa; Rogachev, Andrey Yu; Filatov, Alexander S.; Abakumov, Artem M.; Dikarev, Evgeny V. A three body problem: a genuine hetero<i>tri</i>metallic molecule <i>vs.</i> a mixture of two parent hetero<i>bi</i>metallic molecules. Chemical science, 2018, 9, 4736-4745 |
| 1549388 | CIF | C113 H184 O6 Si8 Ti4 | P 1 21/n 1 | 14.5653; 25.3532; 31.1528 90; 91.249; 90 | 11501.3 | Tsoureas, Nikolaos; Green, Jennifer C.; Cloke, F Geoffrey N; Puschmann, Horst; Roe, S. Mark; Tizzard, Graham Trimerisation of carbon suboxide at a di-titanium centre to form a pyrone ring system. Chemical science, 2018, 9, 5008-5014 |
| 1549389 | CIF | C55 H92 O2 Si4 Ti2 | P 1 21/n 1 | 12.9536; 22.7968; 18.9201 90; 92.537; 90 | 5581.6 | Tsoureas, Nikolaos; Green, Jennifer C.; Cloke, F Geoffrey N; Puschmann, Horst; Roe, S. Mark; Tizzard, Graham Trimerisation of carbon suboxide at a di-titanium centre to form a pyrone ring system. Chemical science, 2018, 9, 5008-5014 |
| 1549390 | CIF | C159 H108 Ag29 N3 O10 P4 S24 | R -3 :H | 27.4634; 27.4634; 46.6552 90; 90; 120 | 30474.7 | Nag, Abhijit; Chakraborty, Papri; Bodiuzzaman, Mohammad; Ahuja, Tripti; Antharjanam, Sudhadevi; Pradeep, Thalappil Polymorphism of Ag<sub>29</sub>(BDT)<sub>12</sub>(TPP)<sub>4</sub><sup>3-</sup> cluster: interactions of secondary ligands and their effect on solid state luminescence. Nanoscale, 2018, 10, 9851-9855 |
| 1549391 | CIF | C41.5 H56 Cl4 O12.5 U2 | P -1 | 10.683; 11.322; 11.736 67.493; 86.541; 76.417 | 1274 | Martin, Nicolas P.; Volkringer, Christophe; Henry, Natacha; Trivelli, Xavier; Stoclet, Grégory; Ikeda-Ohno, Atsushi; Loiseau, Thierry Formation of a new type of uranium(iv) poly-oxo cluster {U<sub>38</sub>} based on a controlled release of water <i>via</i> esterification reaction. Chemical science, 2018, 9, 5021-5032 |
| 1549392 | CIF | C60 H148 Cl42 O76 U38 | I 4/m | 19.6962; 19.6962; 29.9535 90; 90; 90 | 11620.2 | Martin, Nicolas P.; Volkringer, Christophe; Henry, Natacha; Trivelli, Xavier; Stoclet, Grégory; Ikeda-Ohno, Atsushi; Loiseau, Thierry Formation of a new type of uranium(iv) poly-oxo cluster {U<sub>38</sub>} based on a controlled release of water <i>via</i> esterification reaction. Chemical science, 2018, 9, 5021-5032 |
| 1549393 | CIF HKL Paper | C24 H22 N2 O2 P2 | P -1 | 8.6901; 10.1547; 12.6282 71.352; 84.442; 81.817 | 1043.56 | Höhne, Martha; Aluri, Bhaskar R.; Spannenberg, Anke; Müller, Bernd H.; Peulecke, Normen; Rosenthal, Uwe 1,1-Bis(diphenylphosphoryl)hydrazine IUCrData, 2018, 3, x180679 |
| 1549394 | CIF HKL Paper | C22 H32 N2 O3 | P 1 21/c 1 | 28.061; 4.765; 15.3667 90; 91.503; 90 | 2053.98 | Abad, Nadeem; El Bakri, Youness; Ramli, Youssef; Essassi, El Mokhtar; Mague, Joel T. Ethyl 2-[(2<i>E</i>)-4-decyl-3-oxo-1,2,3,4-tetrahydroquinoxalin-2-ylidene]acetate IUCrData, 2018, 3, x180680 |
| 1549395 | CIF | C47 H36 Dy F9 N2 O6 | P 1 | 10.5005; 10.5156; 11.1246 83.611; 66.854; 74.875 | 1090.31 | Li, Xi-Li; Zhu, Cancan; Rong, Qixiang; Wei, Jiahao; Li, Ruixue; Liu, Cai-Ming A pair of mononuclear Dy(iii) enantiomers showing single-ion magnetic and ferroelectric properties New Journal of Chemistry, 2018, 42, 10906 |
| 1549396 | CIF | C47 H36 Dy F9 N2 O6 | P 1 | 10.4994; 10.5083; 11.1201 83.608; 66.819; 74.881 | 1088.75 | Li, Xi-Li; Zhu, Cancan; Rong, Qixiang; Wei, Jiahao; Li, Ruixue; Liu, Cai-Ming A pair of mononuclear Dy(iii) enantiomers showing single-ion magnetic and ferroelectric properties New Journal of Chemistry, 2018, 42, 10906 |
| 1549397 | CIF | C24 H36 N2 S Si | I 1 2/a 1 | 24.712; 8.4842; 24.907 90; 101.616; 90 | 5115 | Kulikov, Oleg V.; Siriwardane, Dumindika A.; Budhathoki-Uprety, Januka; McCandless, Gregory T.; Mahmood, Samsuddin F.; Novak, Bruce M. The secondary structures of PEG-functionalized random copolymers derived from (R)- and (S)- families of alkyne polycarbodiimides Polymer Chemistry, 2018, 9, 2759 |
| 1549398 | CIF | C54 H84 Co I3 N6 O6 S6 | P 1 21 1 | 23.057; 13.6098; 23.378 90; 110.977; 90 | 6849.8 | Luu, Quang H.; Lewis, Kyle G.; Banerjee, Anik; Bhuvanesh, Nattamai; Gladysz, John A. The robust, readily available cobalt(iii) trication [Co(NH<sub>2</sub>CHPhCHPhNH<sub>2</sub>)<sub>3</sub>]<sup>3+</sup> is a progenitor of broadly applicable chirality and prochirality sensing agents. Chemical science, 2018, 9, 5087-5099 |
| 1549399 | CIF | C30 H30 N2 O3 S | P 1 21/n 1 | 13.2526; 8.5485; 23.163 90; 97.46; 90 | 2601.9 | Yang, Song; Li, Quan-Zhe; Xu, Chen; Xu, Qin; Shi, Min Rhodium-catalyzed asymmetric hydroamination and hydroindolation of keto-vinylidenecyclopropanes. Chemical science, 2018, 9, 5074-5081 |
| 1549400 | CIF | C33 H32 N2 O3 S | P 21 21 21 | 9.5994; 14.7775; 19.9833 90; 90; 90 | 2834.7 | Yang, Song; Li, Quan-Zhe; Xu, Chen; Xu, Qin; Shi, Min Rhodium-catalyzed asymmetric hydroamination and hydroindolation of keto-vinylidenecyclopropanes. Chemical science, 2018, 9, 5074-5081 |
| 1549401 | CIF | C30 H32 N2 O3 S | P 1 21/n 1 | 14.6758; 8.1119; 22.258 90; 97.042; 90 | 2629.8 | Yang, Song; Li, Quan-Zhe; Xu, Chen; Xu, Qin; Shi, Min Rhodium-catalyzed asymmetric hydroamination and hydroindolation of keto-vinylidenecyclopropanes. Chemical science, 2018, 9, 5074-5081 |
| 1549402 | CIF | C18 H16 O5 | C 1 c 1 | 34.531; 7.371; 11.7082 90; 100.238; 90 | 2932.6 | Louis, Marine; Guillot, Régis; Métivier, Rémi; Allain, Clémence β-Diketone derivatives: influence of the chelating group on the photophysical and mechanofluorochromic properties. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 822-828 |
| 1549403 | CIF | C32 H32 N6 O5 | F d d 2 | 29.697; 33.356; 5.4539 90; 90; 90 | 5402.5 | Xu, Lin-Lin; Wang, Xing; Ma, Biao; Yin, Ming-Xing; Lin, Hai-Xia; Dai, Hui-Xiong; Yu, Jin-Quan Copper mediated C-H amination with oximes: en route to primary anilines. Chemical science, 2018, 9, 5160-5164 |
| 1549404 | CIF | C22 H20 N4 O2 | P 1 21 1 | 12.646; 8.4619; 17.452 90; 90.459; 90 | 1867.5 | Xu, Lin-Lin; Wang, Xing; Ma, Biao; Yin, Ming-Xing; Lin, Hai-Xia; Dai, Hui-Xiong; Yu, Jin-Quan Copper mediated C-H amination with oximes: en route to primary anilines. Chemical science, 2018, 9, 5160-5164 |
| 1549405 | CIF | C17 H17 N O3 | P 1 21 1 | 7.731; 8.2071; 11.5044 90; 107.779; 90 | 695.08 | Wen, Xin; Wang, Yong; Zhang, X. Peter Enantioselective radical process for synthesis of chiral indolines by metalloradical alkylation of diverse C(sp<sup>3</sup>)-H bonds. Chemical science, 2018, 9, 5082-5086 |
| 1549406 | CIF | C34 H51 N3 O4 | P 1 21/c 1 | 14.4518; 15.8358; 14.1208 90; 93.946; 90 | 3223.97 | Wen, Xin; Wang, Yong; Zhang, X. Peter Enantioselective radical process for synthesis of chiral indolines by metalloradical alkylation of diverse C(sp<sup>3</sup>)-H bonds. Chemical science, 2018, 9, 5082-5086 |
| 1549407 | CIF | C16 H14 Cl N O2 | P 1 21 1 | 5.0463; 10.357; 13.2269 90; 92.007; 90 | 690.87 | Wen, Xin; Wang, Yong; Zhang, X. Peter Enantioselective radical process for synthesis of chiral indolines by metalloradical alkylation of diverse C(sp<sup>3</sup>)-H bonds. Chemical science, 2018, 9, 5082-5086 |
| 1549408 | CIF | C112 H88 Co N8 O8 | C 2 2 21 | 12.7206; 36.0918; 22.8341 90; 90; 90 | 10483.3 | Wen, Xin; Wang, Yong; Zhang, X. Peter Enantioselective radical process for synthesis of chiral indolines by metalloradical alkylation of diverse C(sp<sup>3</sup>)-H bonds. Chemical science, 2018, 9, 5082-5086 |
| 1549409 | CIF | C20 H14 Br2 F4 N4 S | P 1 21/c 1 | 14.8145; 12.6491; 11.5796 90; 106.709; 90 | 2078.28 | Das, Prajwalita; Niina, Kiyoteru; Hiromura, Tomoya; Tokunaga, Etsuko; Saito, Norimichi; Shibata, Norio An eccentric rod-like linear connection of two heterocycles: synthesis of pyridine <i>trans</i>-tetrafluoro-λ<sup>6</sup>-sulfanyl triazoles. Chemical science, 2018, 9, 4931-4936 |
| 1549410 | CIF | C20 H14 Br2 F4 N4 S | P 1 21/n 1 | 12.592; 7.7321; 21.336 90; 96.291; 90 | 2064.8 | Das, Prajwalita; Niina, Kiyoteru; Hiromura, Tomoya; Tokunaga, Etsuko; Saito, Norimichi; Shibata, Norio An eccentric rod-like linear connection of two heterocycles: synthesis of pyridine <i>trans</i>-tetrafluoro-λ<sup>6</sup>-sulfanyl triazoles. Chemical science, 2018, 9, 4931-4936 |
| 1549411 | CIF | C13 H12 Cl F6 N O | P 1 21/c 1 | 7.6263; 16.9562; 10.843 90; 92.648; 90 | 1400.64 | Carestia, Anthony M.; Ravelli, Davide; Alexanian, Erik J. Reagent-dictated site selectivity in intermolecular aliphatic C-H functionalizations using nitrogen-centered radicals. Chemical science, 2018, 9, 5360-5365 |
| 1549412 | CIF HKL Paper | C18 H16 Cu Na2 O16 | P -1 | 6.9048; 7.0555; 11.8449 105.071; 93.073; 109.955 | 517.26 | Yang, Annabeth P.; LaDuca, Robert L. Poly[diaquabis(μ-hydrogen benzene-1,2,4-tricarboxylato)copper(II)disodium]: a novel 4,5,6-connected trinodal net IUCrData, 2018, 3, x180676 |
| 1549413 | CIF HKL Paper | C14 H21 N O4 | P 1 21/c 1 | 8.16; 14.876; 12.549 90; 93.192; 90 | 1520.9 | Seye, Dame; Diop, Libasse; Diop, Cheikh Abdoul Khadir; Geiger, David K. Diisopropylammonium hydrogen phthalate IUCrData, 2018, 3, x180704 |
| 1549414 | CIF | C11 H12 B Br F3 N | P 1 21 1 | 9.1247; 11.1474; 11.9275 90; 90.442; 90 | 1213.2 | Shiro, Tomoya; Schuhmacher, Anne; Jackl, Moritz K.; Bode, Jeffrey W. Facile synthesis of α-aminoboronic acids from amines and potassium acyltrifluoroborates (KATs) <i>via</i> trifluoroborate-iminiums (TIMs). Chemical science, 2018, 9, 5191-5196 |
| 1549415 | CIF | C8 H8 B F4 N | P 1 21/c 1 | 6.1042; 37.0556; 7.9394 90; 93.529; 90 | 1792.45 | Shiro, Tomoya; Schuhmacher, Anne; Jackl, Moritz K.; Bode, Jeffrey W. Facile synthesis of α-aminoboronic acids from amines and potassium acyltrifluoroborates (KATs) <i>via</i> trifluoroborate-iminiums (TIMs). Chemical science, 2018, 9, 5191-5196 |
| 1549416 | CIF | C13 H18 B F4 N | P 21 21 21 | 8.4831; 8.7906; 17.8568 90; 90; 90 | 1331.61 | Shiro, Tomoya; Schuhmacher, Anne; Jackl, Moritz K.; Bode, Jeffrey W. Facile synthesis of α-aminoboronic acids from amines and potassium acyltrifluoroborates (KATs) <i>via</i> trifluoroborate-iminiums (TIMs). Chemical science, 2018, 9, 5191-5196 |
| 1549417 | CIF | C35.5 H39 B2 F8 N2 O0.5 | P 1 21/n 1 | 9.1554; 14.8171; 24.131 90; 93.931; 90 | 3265.82 | Shiro, Tomoya; Schuhmacher, Anne; Jackl, Moritz K.; Bode, Jeffrey W. Facile synthesis of α-aminoboronic acids from amines and potassium acyltrifluoroborates (KATs) <i>via</i> trifluoroborate-iminiums (TIMs). Chemical science, 2018, 9, 5191-5196 |
| 1549418 | CIF | C11 H14 B F4 N | P 21 21 21 | 10.8597; 11.1368; 19.408 90; 90; 90 | 2347.25 | Shiro, Tomoya; Schuhmacher, Anne; Jackl, Moritz K.; Bode, Jeffrey W. Facile synthesis of α-aminoboronic acids from amines and potassium acyltrifluoroborates (KATs) <i>via</i> trifluoroborate-iminiums (TIMs). Chemical science, 2018, 9, 5191-5196 |
| 1549419 | CIF | Ga2 Ge Na2 S Se5 | F d d 2 | 12.987; 23.653; 7.519 90; 90; 90 | 2310 | Li, Shu-Fang; Jiang, Xiao-Ming; Fan, Yu-Hang; Liu, Bin-Wen; Zeng, Hui-Yi; Guo, Guo-Cong New strategy for designing promising mid-infrared nonlinear optical materials: narrowing the band gap for large nonlinear optical efficiencies and reducing the thermal effect for a high laser-induced damage threshold. Chemical science, 2018, 9, 5700-5708 |
| 1549420 | CIF | Ga2 Ge Na2 Se6 | F d d 2 | 12.985; 23.88; 7.585 90; 90; 90 | 2352 | Li, Shu-Fang; Jiang, Xiao-Ming; Fan, Yu-Hang; Liu, Bin-Wen; Zeng, Hui-Yi; Guo, Guo-Cong New strategy for designing promising mid-infrared nonlinear optical materials: narrowing the band gap for large nonlinear optical efficiencies and reducing the thermal effect for a high laser-induced damage threshold. Chemical science, 2018, 9, 5700-5708 |
| 1549421 | CIF | Ga2 Na2 Se6 Sn | F d d 2 | 13.329; 24.291; 7.621 90; 90; 90 | 2467.5 | Li, Shu-Fang; Jiang, Xiao-Ming; Fan, Yu-Hang; Liu, Bin-Wen; Zeng, Hui-Yi; Guo, Guo-Cong New strategy for designing promising mid-infrared nonlinear optical materials: narrowing the band gap for large nonlinear optical efficiencies and reducing the thermal effect for a high laser-induced damage threshold. Chemical science, 2018, 9, 5700-5708 |
| 1549422 | CIF | Ga2 Na2 S Se5 Sn | F d d 2 | 13.264; 23.936; 7.514 90; 90; 90 | 2385.6 | Li, Shu-Fang; Jiang, Xiao-Ming; Fan, Yu-Hang; Liu, Bin-Wen; Zeng, Hui-Yi; Guo, Guo-Cong New strategy for designing promising mid-infrared nonlinear optical materials: narrowing the band gap for large nonlinear optical efficiencies and reducing the thermal effect for a high laser-induced damage threshold. Chemical science, 2018, 9, 5700-5708 |
| 1549423 | CIF | C18 H17 N Na O5 | P 63 | 20.8091; 20.8091; 6.5883 90; 90; 120 | 2470.6 | Engstrom, Jordan R.; Savyasachi, Aramballi J.; Parhizkar, Marzieh; Sutti, Alessandra; Hawes, Chris S.; White, Jonathan M.; Gunnlaugsson, Thorfinnur; Pfeffer, Frederick M. Norbornene chaotropic salts as low molecular mass ionic organogelators (LMIOGs). Chemical science, 2018, 9, 5233-5241 |
| 1549424 | CIF | C18 H17 N Na O5 | P 63 | 20.7637; 20.7637; 6.5915 90; 90; 120 | 2461.07 | Engstrom, Jordan R.; Savyasachi, Aramballi J.; Parhizkar, Marzieh; Sutti, Alessandra; Hawes, Chris S.; White, Jonathan M.; Gunnlaugsson, Thorfinnur; Pfeffer, Frederick M. Norbornene chaotropic salts as low molecular mass ionic organogelators (LMIOGs). Chemical science, 2018, 9, 5233-5241 |
| 1549425 | CIF | C26 H40 N2 O6 | P 1 | 8.8976; 9.7399; 15.4155 93.972; 99.602; 107.215 | 1248.19 | Engstrom, Jordan R.; Savyasachi, Aramballi J.; Parhizkar, Marzieh; Sutti, Alessandra; Hawes, Chris S.; White, Jonathan M.; Gunnlaugsson, Thorfinnur; Pfeffer, Frederick M. Norbornene chaotropic salts as low molecular mass ionic organogelators (LMIOGs). Chemical science, 2018, 9, 5233-5241 |
| 1549426 | CIF | C40 H27 Cl O | P -1 | 10.7657; 11.9402; 12.6973 65.614; 84.355; 71.603 | 1409.62 | Wang, Qing; Hu, Pan; Tanaka, Takayuki; Gopalakrishna, Tullimilli Y.; Herng, Tun Seng; Phan, Hoa; Zeng, Wangdong; Ding, Jun; Osuka, Atsuhiro; Chi, Chunyan; Siegel, Jay; Wu, Jishan Curved π-conjugated corannulene dimer diradicaloids. Chemical science, 2018, 9, 5100-5105 |
| 1549427 | CIF | C36 H24 O | P 1 21/c 1 | 10.7377; 7.2096; 30.6438 90; 97.73; 90 | 2350.72 | Wang, Qing; Hu, Pan; Tanaka, Takayuki; Gopalakrishna, Tullimilli Y.; Herng, Tun Seng; Phan, Hoa; Zeng, Wangdong; Ding, Jun; Osuka, Atsuhiro; Chi, Chunyan; Siegel, Jay; Wu, Jishan Curved π-conjugated corannulene dimer diradicaloids. Chemical science, 2018, 9, 5100-5105 |
| 1549428 | CIF | C42 H28 Cl O | P -1 | 7.3515; 11.2839; 19.4024 74.348; 87.386; 73.241 | 1483.1 | Wang, Qing; Hu, Pan; Tanaka, Takayuki; Gopalakrishna, Tullimilli Y.; Herng, Tun Seng; Phan, Hoa; Zeng, Wangdong; Ding, Jun; Osuka, Atsuhiro; Chi, Chunyan; Siegel, Jay; Wu, Jishan Curved π-conjugated corannulene dimer diradicaloids. Chemical science, 2018, 9, 5100-5105 |
| 1549429 | CIF | C58 H48 Br2 Cu N4 O4 | P 1 21/c 1 | 16.4411; 8.849; 18.948 90; 115.172; 90 | 2494.9 | Tonge, Christopher M.; Sauvé, Ethan R.; Paisley, Nathan R.; Heyes, Jordan E.; Hudson, Zachary M. Polymerization of acrylates based on n-type organic semiconductors using Cu(0)-RDRP Polymer Chemistry, 2018, 9, 3359 |
| 1549430 | CIF | C4 H15 B11 Br6 Si | P -1 | 7.628; 10.6903; 12.8641 83.21; 88.683; 73.76 | 1000.03 | Omann, Lukas; Pudasaini, Bimal; Irran, Elisabeth; Klare, Hendrik F. T.; Baik, Mu-Hyun; Oestreich, Martin Thermodynamic <i>versus</i> kinetic control in substituent redistribution reactions of silylium ions steered by the counteranion. Chemical science, 2018, 9, 5600-5607 |
| 1549431 | CIF | C14 H19 B11 Br6 Si | P b c a | 18.5845; 14.7047; 19.673 90; 90; 90 | 5376.23 | Omann, Lukas; Pudasaini, Bimal; Irran, Elisabeth; Klare, Hendrik F. T.; Baik, Mu-Hyun; Oestreich, Martin Thermodynamic <i>versus</i> kinetic control in substituent redistribution reactions of silylium ions steered by the counteranion. Chemical science, 2018, 9, 5600-5607 |
| 1549432 | CIF | C19 H29 B11 Br6 Cl2 Si | C 1 c 1 | 10.26054; 38.4104; 8.64061 90; 100.552; 90 | 3347.78 | Omann, Lukas; Pudasaini, Bimal; Irran, Elisabeth; Klare, Hendrik F. T.; Baik, Mu-Hyun; Oestreich, Martin Thermodynamic <i>versus</i> kinetic control in substituent redistribution reactions of silylium ions steered by the counteranion. Chemical science, 2018, 9, 5600-5607 |
| 1549433 | CIF | C8.5 H12.5 Cl1.5 I N O | C 1 2/c 1 | 25.6568; 9.9841; 9.988 90; 95.639; 90 | 2546.15 | Caputo, Dimitri F. J.; Arroniz, Carlos; Dürr, Alexander B; Mousseau, James J.; Stepan, Antonia F.; Mansfield, Steven J.; Anderson, Edward A. Synthesis and applications of highly functionalized 1-halo-3-substituted bicyclo[1.1.1]pentanes. Chemical science, 2018, 9, 5295-5300 |
| 1549434 | CIF | C8 H12 Br N O2 | P -1 | 7.0213; 11.7894; 12.2156 72.797; 86.293; 89.879 | 963.76 | Caputo, Dimitri F. J.; Arroniz, Carlos; Dürr, Alexander B; Mousseau, James J.; Stepan, Antonia F.; Mansfield, Steven J.; Anderson, Edward A. Synthesis and applications of highly functionalized 1-halo-3-substituted bicyclo[1.1.1]pentanes. Chemical science, 2018, 9, 5295-5300 |
| 1549435 | CIF | C21 H30 N2 O | P 1 21/n 1 | 14.727; 5.7756; 21.9219 90; 92.4149; 90 | 1862.96 | Caputo, Dimitri F. J.; Arroniz, Carlos; Dürr, Alexander B; Mousseau, James J.; Stepan, Antonia F.; Mansfield, Steven J.; Anderson, Edward A. Synthesis and applications of highly functionalized 1-halo-3-substituted bicyclo[1.1.1]pentanes. Chemical science, 2018, 9, 5295-5300 |
| 1549436 | CIF | C12 H12 I N O2 | P 1 21/c 1 | 12.8692; 8.4534; 11.4743 90; 99.0055; 90 | 1232.88 | Caputo, Dimitri F. J.; Arroniz, Carlos; Dürr, Alexander B; Mousseau, James J.; Stepan, Antonia F.; Mansfield, Steven J.; Anderson, Edward A. Synthesis and applications of highly functionalized 1-halo-3-substituted bicyclo[1.1.1]pentanes. Chemical science, 2018, 9, 5295-5300 |
| 1549437 | CIF | C13 H12 F3 I | P -1 | 5.602; 8.9978; 13.3874 95.953; 98.695; 98.785 | 653.64 | Caputo, Dimitri F. J.; Arroniz, Carlos; Dürr, Alexander B; Mousseau, James J.; Stepan, Antonia F.; Mansfield, Steven J.; Anderson, Edward A. Synthesis and applications of highly functionalized 1-halo-3-substituted bicyclo[1.1.1]pentanes. Chemical science, 2018, 9, 5295-5300 |
| 1549438 | CIF | C15 H16 O2 | P 1 21 1 | 8.6189; 8.0477; 8.6853 90; 101.24; 90 | 590.88 | Jurberg, Igor D.; Davies, Huw M. L. Blue light-promoted photolysis of aryldiazoacetates. Chemical science, 2018, 9, 5112-5118 |
| 1549439 | CIF HKL Paper | C61 H81 B F15 N3 Zr | P 1 21/c 1 | 23.493; 11.9942; 21.8489 90; 104.259; 90 | 5966.9 | Frerichs, Nils; Adler, Christian; Schmidtmann, Marc; Beckhaus, Rüdiger Crystal structure of a zwitterionic azaallyl zirconiumamide complex bearing a Zr^+^-μ-CH~3~—B^{-^} moiety and one equivalent of <i>n</i>-hexane as a solvent IUCrData, 2018, 3, x180644 |
| 1549440 | CIF HKL Paper | C23 H18 Fe2 O S2 | P -1 | 9.8525; 10.6407; 19.272 98.867; 95.255; 105.512 | 1904.76 | Sánchez García, Jessica J.; Flores-Alamo, Marcos; Klimova, Elena I. 4,5-Diferrocenyl-1,2-dithiol-3-one IUCrData, 2018, 3, x180685 |
| 1549450 | CIF | C12 H24 Co N7 O9 | R 3 c :H | 19.835; 19.835; 29.0373 90; 90; 120 | 9893.5 | Xu, Song; Ashley, Daniel C.; Kwon, Hyuk-Yong; Ware, Gabrielle R.; Chen, Chun-Hsing; Losovyj, Yaroslav; Gao, Xinfeng; Jakubikova, Elena; Smith, Jeremy M. A flexible, redox-active macrocycle enables the electrocatalytic reduction of nitrate to ammonia by a cobalt complex. Chemical science, 2018, 9, 4950-4958 |
| 1549451 | CIF | C14 H27 Br3 Co N5 | P 1 21/c 1 | 9.9394; 9.5494; 21.4604 90; 90.9342; 90 | 2036.65 | Xu, Song; Ashley, Daniel C.; Kwon, Hyuk-Yong; Ware, Gabrielle R.; Chen, Chun-Hsing; Losovyj, Yaroslav; Gao, Xinfeng; Jakubikova, Elena; Smith, Jeremy M. A flexible, redox-active macrocycle enables the electrocatalytic reduction of nitrate to ammonia by a cobalt complex. Chemical science, 2018, 9, 4950-4958 |
| 1549452 | CIF | C42 H36 N2 O4 | P -1 | 8.8034; 9.6631; 10.5046 102.117; 107.299; 102.283 | 797.12 | Sharber, Seth A.; Shih, Kuo-Chih; Mann, Arielle; Frausto, Fanny; Haas, Terry E.; Nieh, Mu-Ping; Thomas, Samuel W. Reversible mechanofluorochromism of aniline-terminated phenylene ethynylenes. Chemical science, 2018, 9, 5415-5426 |
| 1549453 | CIF | C46 H34 F10 N2 O4 | P -1 | 7.6139; 10.1143; 12.847 95.814; 92.348; 93.463 | 981.35 | Sharber, Seth A.; Shih, Kuo-Chih; Mann, Arielle; Frausto, Fanny; Haas, Terry E.; Nieh, Mu-Ping; Thomas, Samuel W. Reversible mechanofluorochromism of aniline-terminated phenylene ethynylenes. Chemical science, 2018, 9, 5415-5426 |
| 1549454 | CIF | C70 H82 F10 N2 O4 | P 1 21/c 1 | 22.741; 7.648; 35.273 90; 96.81; 90 | 6091.51 | Sharber, Seth A.; Shih, Kuo-Chih; Mann, Arielle; Frausto, Fanny; Haas, Terry E.; Nieh, Mu-Ping; Thomas, Samuel W. Reversible mechanofluorochromism of aniline-terminated phenylene ethynylenes. Chemical science, 2018, 9, 5415-5426 |
| 1549455 | CIF | C54 H50 F4 N10 O2 | P -1 | 12.392; 17.6527; 18.8864 95.161; 103.759; 106.881 | 3783.4 | Sharber, Seth A.; Shih, Kuo-Chih; Mann, Arielle; Frausto, Fanny; Haas, Terry E.; Nieh, Mu-Ping; Thomas, Samuel W. Reversible mechanofluorochromism of aniline-terminated phenylene ethynylenes. Chemical science, 2018, 9, 5415-5426 |
| 1549456 | CIF | C132 H112 Au6 B2 F8 N2 O P6 | P 21 21 21 | 13.7644; 24.8987; 35.6022 90; 90; 90 | 12201.4 | Guo, Ping; Yang, Biao; Zhang, Li; Zhao, Liang Temperature dependent chiroptical response of sigmoidal gold clusters: probing the stability of chiral metal clusters. Chemical science, 2018, 9, 5614-5622 |
| 1549457 | CIF | C14 H16 O2 | P 1 21/n 1 | 5.5798; 26.592; 8.0005 90; 108.656; 90 | 1124.72 | Salvati, Anna E.; Law, James A.; Liriano, Josue; Frederich, James H. Modular access to functionalized 5-8-5 fused ring systems <i>via</i> a photoinduced cycloisomerization reaction. Chemical science, 2018, 9, 5389-5393 |
| 1549458 | CIF | C14 H16 O2 | P 1 21/c 1 | 16.348; 6.781; 10.091 90; 100.02; 90 | 1101.6 | Salvati, Anna E.; Law, James A.; Liriano, Josue; Frederich, James H. Modular access to functionalized 5-8-5 fused ring systems <i>via</i> a photoinduced cycloisomerization reaction. Chemical science, 2018, 9, 5389-5393 |
| 1549459 | CIF | C14 H16 O2 | P 1 21/c 1 | 10.7209; 13.1604; 8.2158 90; 105.789; 90 | 1115.44 | Salvati, Anna E.; Law, James A.; Liriano, Josue; Frederich, James H. Modular access to functionalized 5-8-5 fused ring systems <i>via</i> a photoinduced cycloisomerization reaction. Chemical science, 2018, 9, 5389-5393 |
| 1549460 | CIF | C18 H22 O2 | P 1 21/c 1 | 14.4406; 9.5463; 10.3489 90; 98.2686; 90 | 1411.8 | Salvati, Anna E.; Law, James A.; Liriano, Josue; Frederich, James H. Modular access to functionalized 5-8-5 fused ring systems <i>via</i> a photoinduced cycloisomerization reaction. Chemical science, 2018, 9, 5389-5393 |
| 1549461 | CIF | C14 H16 O2 | P 1 21/n 1 | 6.5568; 15.0022; 11.4025 90; 97.5881; 90 | 1111.8 | Salvati, Anna E.; Law, James A.; Liriano, Josue; Frederich, James H. Modular access to functionalized 5-8-5 fused ring systems <i>via</i> a photoinduced cycloisomerization reaction. Chemical science, 2018, 9, 5389-5393 |
| 1549462 | CIF | C18 H22 O2 | P 1 21/c 1 | 9.7545; 9.4518; 15.7484 90; 103.855; 90 | 1409.72 | Salvati, Anna E.; Law, James A.; Liriano, Josue; Frederich, James H. Modular access to functionalized 5-8-5 fused ring systems <i>via</i> a photoinduced cycloisomerization reaction. Chemical science, 2018, 9, 5389-5393 |
| 1549463 | CIF | C15 H20 O2 | P -1 | 6.8954; 8.3622; 12.1458 106.492; 92.7147; 108.899 | 627.79 | Salvati, Anna E.; Law, James A.; Liriano, Josue; Frederich, James H. Modular access to functionalized 5-8-5 fused ring systems <i>via</i> a photoinduced cycloisomerization reaction. Chemical science, 2018, 9, 5389-5393 |
| 1549464 | CIF | C15 H20 O2 | P 21 21 21 | 10.3761; 10.82; 10.8988 90; 90; 90 | 1223.6 | Salvati, Anna E.; Law, James A.; Liriano, Josue; Frederich, James H. Modular access to functionalized 5-8-5 fused ring systems <i>via</i> a photoinduced cycloisomerization reaction. Chemical science, 2018, 9, 5389-5393 |
| 1549465 | CIF | C105 H87 Au13 Cu4 N3 P3 Se9 | R -3 c | 24.2592; 24.2592; 74.473 90; 90; 120 | 37956.2 | Song, Yongbo; Lv, Ying; Zhou, Meng; Luo, Tian-Yi; Zhao, Shuo; Rosi, Nathaniel L.; Yu, Haizhu; Zhu, Manzhou; Jin, Rongchao Single Ligand Exchange on an Au-Cu Bimetal Nanocluster and Mechanism Nanoscale, 2018 |
| 1549466 | CIF | C38 H22.2 O2 | P 1 21/c 1 | 7.538; 9.367; 18.374 90; 100.039; 90 | 1277.5 | Inagaki, Yuki; Mutoh, Katsuya; Abe, Jiro Stepwise photochromism of bisnaphthopyrans exhibiting an excitation intensity-dependent color change. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 946-953 |
| 1549467 | CIF | C2 H3 Na O2 | P c c a | 5.9482; 10.0866; 5.8984 90; 90; 90 | 353.89 | Birger Dittrich; Justin Bergmann; Peter Roloff; Guido J. Reiss New Polymorphs of the Phase-Change Material Sodium Acetate Crystals, 2018, 8, 213 |
| 1549468 | CIF | C2 H3 Na O2 | P 4/n m m :2 | 4.156; 4.156; 10.053 90; 90; 90 | 173.64 | Birger Dittrich; Justin Bergmann; Peter Roloff; Guido J. Reiss New Polymorphs of the Phase-Change Material Sodium Acetate Crystals, 2018, 8, 213 |
| 1549469 | CIF | C44 N4 Ni O22 P4 Zr2 | I 41 c d | 44.7776; 44.7776; 7.6581 90; 90; 90 | 15355 | Rhauderwiek, Timo; Zhao, Haishuang; Hirschle, Patrick; Döblinger, Markus; Bueken, Bart; Reinsch, Helge; De Vos, Dirk; Wuttke, Stefan; Kolb, Ute; Stock, Norbert Highly stable and porous porphyrin-based zirconium and hafnium phosphonates - electron crystallography as an important tool for structure elucidation. Chemical science, 2018, 9, 5467-5478 |
| 1549470 | CIF | H3 Na O8 Se2 V | C 1 2/c 1 | 18.5779; 7.5662; 12.5844 90; 111.612; 90 | 1644.6 | Stefano Canossa; Giovanni Predieri; Claudia Graiff Mild Synthesis and Structural Characterization of a Novel Vanadyl Selenite-Hydrogen Selenite Phase, Na[VO(SeO3)(HSeO3)].1,5H2O Crystals, 2018, 8, 215 |
| 1549471 | CIF | C56 H56 B2 | P 1 21/c 1 | 11.785; 19.051; 19.029 90; 93.29; 90 | 4265.3 | Chen, Chang-Hong; Gabbaï, François P Large-bite diboranes for the μ(1,2) complexation of hydrazine and cyanide. Chemical science, 2018, 9, 6210-6218 |
| 1549472 | CIF | C48 H54 B2 N2 | C 1 2/c 1 | 18.849; 11.5959; 20.422 90; 106.914; 90 | 4270.6 | Chen, Chang-Hong; Gabbaï, François P Large-bite diboranes for the μ(1,2) complexation of hydrazine and cyanide. Chemical science, 2018, 9, 6210-6218 |
| 1549473 | CIF | C79 H83 B2 Cl4 K N O6 | C 1 c 1 | 21.407; 13.6932; 23.988 90; 92.4764; 90 | 7025 | Chen, Chang-Hong; Gabbaï, François P Large-bite diboranes for the μ(1,2) complexation of hydrazine and cyanide. Chemical science, 2018, 9, 6210-6218 |
| 1549474 | CIF | C71 H78 B2 Cl4 K N O6 | P 1 21/c 1 | 15.4096; 23.693; 19.0628 90; 112.948; 90 | 6409 | Chen, Chang-Hong; Gabbaï, François P Large-bite diboranes for the μ(1,2) complexation of hydrazine and cyanide. Chemical science, 2018, 9, 6210-6218 |
| 1549475 | CIF | C82 H126 Al2 N4 P2 Pd2 | P -1 | 12.8924; 13.4295; 13.7975 110.488; 112.313; 100.712 | 1925.1 | Hooper, Thomas N.; Garçon, Martí; White, Andrew J. P.; Crimmin, Mark R. Room temperature catalytic carbon-hydrogen bond alumination of unactivated arenes: mechanism and selectivity. Chemical science, 2018, 9, 5435-5440 |
| 1549476 | CIF | C36 H48.9 Al Cl0.1 N2 | P 1 21/c 1 | 12.086; 22.1931; 12.9055 90; 106.077; 90 | 3326.2 | Hooper, Thomas N.; Garçon, Martí; White, Andrew J. P.; Crimmin, Mark R. Room temperature catalytic carbon-hydrogen bond alumination of unactivated arenes: mechanism and selectivity. Chemical science, 2018, 9, 5435-5440 |
| 1549477 | CIF | C35 H47 Al N2 | P n m a | 16.6858; 20.95; 9.0089 90; 90; 90 | 3149.2 | Hooper, Thomas N.; Garçon, Martí; White, Andrew J. P.; Crimmin, Mark R. Room temperature catalytic carbon-hydrogen bond alumination of unactivated arenes: mechanism and selectivity. Chemical science, 2018, 9, 5435-5440 |
| 1549478 | CIF | C85 H136 Al2 N4 P Pd | P -1 | 13.2046; 14.1589; 23.4405 94.72; 98.247; 108.643 | 4071.1 | Hooper, Thomas N.; Garçon, Martí; White, Andrew J. P.; Crimmin, Mark R. Room temperature catalytic carbon-hydrogen bond alumination of unactivated arenes: mechanism and selectivity. Chemical science, 2018, 9, 5435-5440 |
| 1549479 | CIF | C50 H33 Cl2 F7 N O Sb | R -3 | 28.6364; 28.6364; 29.7717 90; 90; 120 | 21143.2 | Yin, Jiangliang; Zhou, Fulin; Zhu, Lei; Yang, Mufan; Lan, Yu; You, Jingsong Annulation cascade of arylnitriles with alkynes to stable delocalized PAH carbocations via intramolecular rhodium migration Chemical Science, 2018 |
| 1549480 | CIF | C51.5 H35 Cl F6 N O3 Sb | P 1 21/n 1 | 9.14367; 44.3544; 12.23171 90; 109.948; 90 | 4663.08 | Yin, Jiangliang; Zhou, Fulin; Zhu, Lei; Yang, Mufan; Lan, Yu; You, Jingsong Annulation cascade of arylnitriles with alkynes to stable delocalized PAH carbocations via intramolecular rhodium migration Chemical Science, 2018 |
| 1549481 | CIF | C26 H20 Fe N12 O2 Pd | P -1 | 7.2613; 7.6635; 13.5746 95.988; 98.931; 90.085 | 742.04 | Zenere, Katrina A.; Duyker, Samuel G.; Trzop, Elzbieta; Collet, Eric; Chan, Bun; Doheny, Patrick W.; Kepert, Cameron J.; Neville, Suzanne M. Increasing spin crossover cooperativity in 2D Hofmann-type materials with guest molecule removal. Chemical science, 2018, 9, 5623-5629 |
| 1549482 | CIF | C26 H20 Fe N12 O2 Pd | P -1 | 7.0836; 15.1242; 13.5688 96.424; 97.878; 90.09 | 1430.7 | Zenere, Katrina A.; Duyker, Samuel G.; Trzop, Elzbieta; Collet, Eric; Chan, Bun; Doheny, Patrick W.; Kepert, Cameron J.; Neville, Suzanne M. Increasing spin crossover cooperativity in 2D Hofmann-type materials with guest molecule removal. Chemical science, 2018, 9, 5623-5629 |
| 1549483 | CIF | C26 H20 Fe N12 O2 Pt | P -1 | 7.2772; 7.6432; 13.5928 95.997; 98.598; 90.08 | 743.35 | Zenere, Katrina A.; Duyker, Samuel G.; Trzop, Elzbieta; Collet, Eric; Chan, Bun; Doheny, Patrick W.; Kepert, Cameron J.; Neville, Suzanne M. Increasing spin crossover cooperativity in 2D Hofmann-type materials with guest molecule removal. Chemical science, 2018, 9, 5623-5629 |
| 1549484 | CIF | C24 H31 Br Co N3 O4 | P -1 | 10.302; 10.479; 12.612 72.875; 70.7; 76.245 | 1213.1 | Planas, O.; Roldán-Gómez, S; Martin-Diaconescu, V; Luis, J. M.; Company, A.; Ribas, X. Mechanistic insights into the S<sub>N</sub>2-type reactivity of aryl-Co(iii) masked-carbenes for C-C bond forming transformations. Chemical science, 2018, 9, 5736-5746 |
| 1549485 | CIF | C40 H34 Co N6 O14 | P -1 | 11.724; 14; 15.95 66.86; 76.56; 68.44 | 2227 | Planas, O.; Roldán-Gómez, S; Martin-Diaconescu, V; Luis, J. M.; Company, A.; Ribas, X. Mechanistic insights into the S<sub>N</sub>2-type reactivity of aryl-Co(iii) masked-carbenes for C-C bond forming transformations. Chemical science, 2018, 9, 5736-5746 |
| 1549486 | CIF | C33 H30 Co N3 O6 | P -1 | 11.416; 13.616; 13.991 73.027; 70.324; 69.364 | 1879 | Planas, O.; Roldán-Gómez, S; Martin-Diaconescu, V; Luis, J. M.; Company, A.; Ribas, X. Mechanistic insights into the S<sub>N</sub>2-type reactivity of aryl-Co(iii) masked-carbenes for C-C bond forming transformations. Chemical science, 2018, 9, 5736-5746 |
| 1549487 | CIF | C46 H44 Co N3 O11 | P -1 | 11.93; 14.213; 17.277 98.862; 101.804; 112.978 | 2550 | Planas, O.; Roldán-Gómez, S; Martin-Diaconescu, V; Luis, J. M.; Company, A.; Ribas, X. Mechanistic insights into the S<sub>N</sub>2-type reactivity of aryl-Co(iii) masked-carbenes for C-C bond forming transformations. Chemical science, 2018, 9, 5736-5746 |
| 1549488 | CIF | C15 H20 Cl2 O6 Pd | C 1 2/m 1 | 11.6869; 8.8935; 8.551 90; 90.223; 90 | 888.76 | Eremin, Dmitry B.; Boiko, Daniil A.; Borkovskaya, Eugenia V.; Khrustalev, Victor N.; Chernyshev, Victor M.; Ananikov, Valentine P. Ten-fold boost of catalytic performance in thiol‒yne click reaction enabled by a palladium diketonate complex with a hexafluoroacetylacetonate ligand Catalysis Science & Technology, 2018, 8, 3073 |
| 1549489 | CIF | C10 H8 F6 O4 Pd | P -1 | 4.7881; 7.9629; 8.7923 80.994; 77.33; 72.621 | 310.64 | Eremin, Dmitry B.; Boiko, Daniil A.; Borkovskaya, Eugenia V.; Khrustalev, Victor N.; Chernyshev, Victor M.; Ananikov, Valentine P. Ten-fold boost of catalytic performance in thiol‒yne click reaction enabled by a palladium diketonate complex with a hexafluoroacetylacetonate ligand Catalysis Science & Technology, 2018, 8, 3073 |
| 1549490 | CIF | C56 H24 Cl8 N6 | P -1 | 12.4209; 13.6925; 15.889 81.806; 74.263; 87.206 | 2574.3 | Le 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 |
| 1549492 | CIF | C72 H68 Cl2 O6 | P -1 | 13.85; 15.15; 17.46 73.28; 78.26; 77.43 | 3385.5 | Feng, Xing; Qi, Chunxuan; Feng, Hai-Tao; Zhao, Zheng; Sung, Herman H. Y.; Williams, Ian D.; Kwok, Ryan T. K.; Lam, Jacky W. Y.; Qin, Anjun; Tang, Ben Zhong Dual fluorescence of tetraphenylethylene-substituted pyrenes with aggregation-induced emission characteristics for white-light emission. Chemical science, 2018, 9, 5679-5687 |
| 1549493 | CIF | C50 H46 N2 | P -1 | 10.1039; 14.5087; 15.0844 65.241; 89.939; 69.932 | 1859.5 | Feng, Xing; Qi, Chunxuan; Feng, Hai-Tao; Zhao, Zheng; Sung, Herman H. Y.; Williams, Ian D.; Kwok, Ryan T. K.; Lam, Jacky W. Y.; Qin, Anjun; Tang, Ben Zhong Dual fluorescence of tetraphenylethylene-substituted pyrenes with aggregation-induced emission characteristics for white-light emission. Chemical science, 2018, 9, 5679-5687 |
| 1549494 | CIF HKL Paper | C10 H23 Cl3 N2 Pd | P 1 21/c 1 | 7.286; 17.379; 12.95 90; 102.769; 90 | 1599.2 | Oberley, Alan J.; Kadel, Lava R.; Senaratne, Nilmini K.; Eichhorn, David M. Tetraethylammonium (acetonitrile)trichloridopalladate(II) IUCrData, 2018, 3, x180750 |
| 1549495 | CIF | C26 H44 Cl Ir N O7 P | P 1 21/c 1 | 15.0632; 12.3425; 16.2371 90; 107.643; 90 | 2876.77 | Gregor, Lauren C.; Grajeda, Javier; White, Peter S.; Vetter, Andrew J.; Miller, Alexander J. M. Salt-promoted catalytic methanol carbonylation using iridium pincer-crown ether complexes Catalysis Science & Technology, 2018, 8, 3133 |
| 1549496 | CIF | C26 H43 Ir N O7 P | P -1 | 7.7588; 15.5942; 24.116 89.185; 82.743; 89.582 | 2894.1 | Gregor, Lauren C.; Grajeda, Javier; White, Peter S.; Vetter, Andrew J.; Miller, Alexander J. M. Salt-promoted catalytic methanol carbonylation using iridium pincer-crown ether complexes Catalysis Science & Technology, 2018, 8, 3133 |
| 1549497 | CIF | C37 H28 N O P | P 1 21/n 1 | 21.3348; 5.9392; 23.3779 90; 102.485; 90 | 2892.2 | Xie, Zongliang; Yu, Tao; Chen, Junru; Ubba, Eethamukkala; Wang, Leyu; Mao, Zhu; Su, Tongtong; Zhang, Yi; Aldred, Matthew P.; Chi, Zhenguo Weak interactions but potent effect: tunable mechanoluminescence by adjusting intermolecular C-H···π interactions. Chemical science, 2018, 9, 5787-5794 |
| 1549498 | CIF | C37 H28 N O P | C 1 c 1 | 23.584; 6.0025; 21.526 90; 102.573; 90 | 2974.2 | Xie, Zongliang; Yu, Tao; Chen, Junru; Ubba, Eethamukkala; Wang, Leyu; Mao, Zhu; Su, Tongtong; Zhang, Yi; Aldred, Matthew P.; Chi, Zhenguo Weak interactions but potent effect: tunable mechanoluminescence by adjusting intermolecular C-H···π interactions. Chemical science, 2018, 9, 5787-5794 |
| 1549499 | CIF | C37 H27 Br2 Cl2 F6 Ir N5 P | P 1 21/n 1 | 14.2183; 13.7802; 19.1871 90; 97.389; 90 | 3728.1 | Erdmann, E.; Villinger, A.; König, B; Seidel, W. W. 1,10-Phenanthroline-dithiine iridium and ruthenium complexes: synthesis, characterization and photocatalytic dihydrogen evolution. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 1056-1067 |
| 1549500 | CIF | C42.5 H27 Cl F6 Ir N6 P S2 | P 1 21 1 | 22.4564; 13.5405; 25.1871 90; 91.785; 90 | 7654.9 | Erdmann, E.; Villinger, A.; König, B; Seidel, W. W. 1,10-Phenanthroline-dithiine iridium and ruthenium complexes: synthesis, characterization and photocatalytic dihydrogen evolution. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology, 2018, 17, 1056-1067 |
| 1549501 | CIF | C70 H95 Fe2 N17 O23 | P 1 2/n 1 | 12.2471; 18.3327; 17.6262 90; 95.002; 90 | 3942.41 | Surendhran, Roshaan; D'Arpino, Alexander A; Sciscent, Bao Y.; Cannella, Anthony F.; Friedman, Alan E.; MacMillan, Samantha N.; Gupta, Rupal; Lacy, David C. Deciphering the mechanism of O<sub>2</sub> reduction with electronically tunable non-heme iron enzyme model complexes. Chemical science, 2018, 9, 5773-5780 |
| 1549502 | CIF | C56 H60 Fe2 N16 O19 | P -1 | 11.359; 11.8525; 13.7993 68.492; 83.722; 66.929 | 1588.95 | Surendhran, Roshaan; D'Arpino, Alexander A; Sciscent, Bao Y.; Cannella, Anthony F.; Friedman, Alan E.; MacMillan, Samantha N.; Gupta, Rupal; Lacy, David C. Deciphering the mechanism of O<sub>2</sub> reduction with electronically tunable non-heme iron enzyme model complexes. Chemical science, 2018, 9, 5773-5780 |
| 1549503 | CIF | C38 H51 Co N11 O11 | P 1 21/n 1 | 11.8093; 19.833; 18.2984 90; 93.921; 90 | 4275.7 | Surendhran, Roshaan; D'Arpino, Alexander A; Sciscent, Bao Y.; Cannella, Anthony F.; Friedman, Alan E.; MacMillan, Samantha N.; Gupta, Rupal; Lacy, David C. Deciphering the mechanism of O<sub>2</sub> reduction with electronically tunable non-heme iron enzyme model complexes. Chemical science, 2018, 9, 5773-5780 |
| 1549504 | CIF | C36 H51 N7 O5 Zn | P 21 21 21 | 11.1043; 17.4254; 19.3342 90; 90; 90 | 3741.11 | Surendhran, Roshaan; D'Arpino, Alexander A; Sciscent, Bao Y.; Cannella, Anthony F.; Friedman, Alan E.; MacMillan, Samantha N.; Gupta, Rupal; Lacy, David C. Deciphering the mechanism of O<sub>2</sub> reduction with electronically tunable non-heme iron enzyme model complexes. Chemical science, 2018, 9, 5773-5780 |
| 1549505 | CIF | C36 H51 Fe N7 O5 | P 21 21 21 | 11.0981; 17.442; 19.3054 90; 90; 90 | 3737.01 | Surendhran, Roshaan; D'Arpino, Alexander A; Sciscent, Bao Y.; Cannella, Anthony F.; Friedman, Alan E.; MacMillan, Samantha N.; Gupta, Rupal; Lacy, David C. Deciphering the mechanism of O<sub>2</sub> reduction with electronically tunable non-heme iron enzyme model complexes. Chemical science, 2018, 9, 5773-5780 |
| 1549506 | CIF | C34 H45 Mn N9 O11 | P -1 | 10.2415; 11.6883; 18.9061 97.1912; 96.6555; 104.782 | 2145.12 | Surendhran, Roshaan; D'Arpino, Alexander A; Sciscent, Bao Y.; Cannella, Anthony F.; Friedman, Alan E.; MacMillan, Samantha N.; Gupta, Rupal; Lacy, David C. Deciphering the mechanism of O<sub>2</sub> reduction with electronically tunable non-heme iron enzyme model complexes. Chemical science, 2018, 9, 5773-5780 |
| 1549507 | CIF | C38 H54 N10 O12 Zn | P -1 | 10.1375; 11.6574; 19.0003 97.688; 96.622; 103.818 | 2135.4 | Surendhran, Roshaan; D'Arpino, Alexander A; Sciscent, Bao Y.; Cannella, Anthony F.; Friedman, Alan E.; MacMillan, Samantha N.; Gupta, Rupal; Lacy, David C. Deciphering the mechanism of O<sub>2</sub> reduction with electronically tunable non-heme iron enzyme model complexes. Chemical science, 2018, 9, 5773-5780 |
| 1549508 | CIF | C39 H48 Co N10 O5 | P -1 | 10.2617; 11.3806; 19.5188 105.524; 98.363; 94.721 | 2155.33 | Surendhran, Roshaan; D'Arpino, Alexander A; Sciscent, Bao Y.; Cannella, Anthony F.; Friedman, Alan E.; MacMillan, Samantha N.; Gupta, Rupal; Lacy, David C. Deciphering the mechanism of O<sub>2</sub> reduction with electronically tunable non-heme iron enzyme model complexes. Chemical science, 2018, 9, 5773-5780 |
| 1549509 | CIF | C34 H45 Fe N9 O11 | P -1 | 10.2009; 11.6975; 18.9343 97.4707; 96.4933; 104.418 | 2144.57 | Surendhran, Roshaan; D'Arpino, Alexander A; Sciscent, Bao Y.; Cannella, Anthony F.; Friedman, Alan E.; MacMillan, Samantha N.; Gupta, Rupal; Lacy, David C. Deciphering the mechanism of O<sub>2</sub> reduction with electronically tunable non-heme iron enzyme model complexes. Chemical science, 2018, 9, 5773-5780 |
| 1549510 | CIF | C40 H30 | P 1 21/c 1 | 9.2297; 10.6903; 27.8883 90; 91.6399; 90 | 2750.6 | Mannancherry, Rajesh; Rickhaus, Michel; Häussinger, Daniel; Prescimone, Alessandro; Mayor, Marcel Molecular dynamic staircases: all-carbon axial chiral "Geländer" structures. Chemical science, 2018, 9, 5758-5766 |
| 1549511 | CIF | C40 H30 | P 1 21/c 1 | 8.5388; 14.2697; 22.0284 90; 94.249; 90 | 2676.7 | Mannancherry, Rajesh; Rickhaus, Michel; Häussinger, Daniel; Prescimone, Alessandro; Mayor, Marcel Molecular dynamic staircases: all-carbon axial chiral "Geländer" structures. Chemical science, 2018, 9, 5758-5766 |
| 1549518 | CIF HKL Paper | C17 H19 N | P 1 21/n 1 | 6.7724; 7.1774; 26.793 90; 93.184; 90 | 1300.3 | Peloquin, Andrew J.; Smith, Madelyn B.; Balaich, Gary J.; Iacono, Scott T. (<i>E</i>)-1-[1-(3-Phenylcyclopenta-2,4-dien-1-ylidene)ethyl]pyrrolidine IUCrData, 2018, 3, x180764 |
| 1549520 | CIF HKL Paper | C19 H19 N3 O3 | P -1 | 7.5867; 10.268; 11.4684 95.592; 102.147; 109.987 | 806.72 | Koh, Dongsoo; Lee, Ji Hye 4-(3,5-Dimethoxyphenyl)-6-(2-methoxyphenyl)pyrimidin-2-amine IUCrData, 2018, 3, x180796 |
| 1549521 | CIF HKL Paper | C16 H24 Br4 Cd N2 O2 | P 1 21/n 1 | 16.7564; 7.9403; 17.9303 90; 103.777; 90 | 2317 | Umarani, Parthasarathy; Thiruvalluvar, Aravazhi Amalan; Ramachandra Raja, Chidambaram Bis(4-methoxybenzylammonium) tetrabromidocadmate(II) IUCrData, 2018, 3 |
| 1549524 | CIF | H6 N4 Ni O6 | P c a 21 | 11.0628; 6.0454; 9.3526 90; 90; 90 | 625.49 | Breternitz, Joachim; Godula-Jopek, Agata; Gregory, Duncan H. Ni(NH3)2(NO3)2 - A 3-D Network through Bridging Nitrate Units Isolated from the Thermal Decomposition of Nickel Hexammine Dinitrate Inorganics, 2018, 6 |
| 1549525 | CIF | C4 H6 Cl N3 O | P 1 21/n 1 | 8.1481; 6.8774; 10.9947 90; 95.97; 90 | 612.777 | Kumar, Prashant; Cabaj, Malgorzata Katarzyna; Pazio, Aleksandra; Dominiak, Paulina Maria Protonated nucleobases are not fully ionized in their chloride salt crystals and form metastable base pairs further stabilized by the surrounding anions IUCrJ, 2018, 5 |
| 1549526 | CIF | C5 H7 Cl N5 O0.5 | P 1 2/n 1 | 8.6936; 4.8189; 17.6971 90; 93.526; 90 | 739.992 | Kumar, Prashant; Cabaj, Malgorzata Katarzyna; Pazio, Aleksandra; Dominiak, Paulina Maria Protonated nucleobases are not fully ionized in their chloride salt crystals and form metastable base pairs further stabilized by the surrounding anions IUCrJ, 2018, 5 |
| 1549527 | CIF | C2.5 H3.5 Cl N2.5 O0.5 | P n m a | 13.5939; 6.4841; 9.86 90; 90; 90 | 869.1 | Kumar, Prashant; Cabaj, Malgorzata Katarzyna; Pazio, Aleksandra; Dominiak, Paulina Maria Protonated nucleobases are not fully ionized in their chloride salt crystals and form metastable base pairs further stabilized by the surrounding anions IUCrJ, 2018, 5 |
| 1549528 | CIF HKL Paper | C19 H16 O3 | P -1 | 6.8573; 7.4073; 15.55 87.843; 78.892; 72.347 | 738.4 | Biruntha, K.; Reuben Jonathan, D.; Mohamooda Sumaya, U.; Dravida Thendral, E. R. A.; Usha, G. (3<i>E</i>)-3-[(2<i>E</i>)-3-(4-Methoxyphenyl)prop-2-enylidene]-2,3-dihydro-4<i>H</i>-chromen-4-one IUCrData, 2018, 3, x180829 |
| 1549529 | CIF HKL Paper | C19.83 H29 Cl3 N4 O2.17 | P -1 | 11.0118; 11.7295; 11.7453 66.009; 67.12; 66.057 | 1220.4 | Van Erdewyk, Martha L.; Oshin, Kayode D. Crystal structure of tris[(pyridin-1-ium-2-yl)methyl]amine trichloride‒methanol‒water (1/1.829/0.342) IUCrData, 2018, 3, x180826 |
| 1549536 | CIF | C17 H19 Co N2 O7 | C 1 2/c 1 | 16.518; 15.555; 16.111 90; 104.402; 90 | 4009.4 | Li, Ming; Ma, Chuang; Liu, Xiong; Su, Jun; Cui, Xiaofeng; He, Yunbin Synthesis of a 2D phosphorus material in a MOF-based 2D nano-reactor. Chemical science, 2018, 9, 5912-5918 |
| 1549537 | CIF | C37 H45 Co2 N5 O15 | C 1 2/c 1 | 16.418; 15.589; 16.101 90; 103.863; 90 | 4000.9 | Li, Ming; Ma, Chuang; Liu, Xiong; Su, Jun; Cui, Xiaofeng; He, Yunbin Synthesis of a 2D phosphorus material in a MOF-based 2D nano-reactor. Chemical science, 2018, 9, 5912-5918 |
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