Crystallography Open Database
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Searching journal of publication like 'Chemical Science' volume of publication is 16
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| 1572875 | CIF | C6 H18 Cl4 Cu N2 O3 Si2 | F m m m | 10.2369; 20.4352; 33.981 90; 90; 90 | 7108.6 | Dalton, Connor W.; Gannon, Paige M.; Kaminsky, Werner; Reed, Douglas A. Leveraging ordered voids in microporous perovskites for intercalation and post-synthetic modification. Chemical science, 2024, 16, 1147-1154 |
| 1573035 | CIF | C119 H167 F12 N29 O12 P2 | P 1 21/n 1 | 16.0516; 25.7006; 27.3571 90; 91.647; 90 | 11281.1 | Závodná, Aneta; Janovský, Petr; Kolařík, Václav; Ward, Jas S.; Prucková, Zdeňka; Rouchal, Michal; Rissanen, Kari; Vícha, Robert Allosteric release of cucurbit[6]uril from a rotaxane using a molecular signal. Chemical science, 2024, 16, 83-89 |
| 1573036 | CIF | C58 H91.5 F12 N26 O17.75 P2 | A m a 2 | 17.47878; 27.72924; 15.22975 90; 90; 90 | 7381.45 | Závodná, Aneta; Janovský, Petr; Kolařík, Václav; Ward, Jas S.; Prucková, Zdeňka; Rouchal, Michal; Rissanen, Kari; Vícha, Robert Allosteric release of cucurbit[6]uril from a rotaxane using a molecular signal. Chemical science, 2024, 16, 83-89 |
| 1573037 | CIF | C67 H99 F12 N29 O14 P2 | P a -3 | 36.765; 36.765; 36.765 90; 90; 90 | 49694 | Závodná, Aneta; Janovský, Petr; Kolařík, Václav; Ward, Jas S.; Prucková, Zdeňka; Rouchal, Michal; Rissanen, Kari; Vícha, Robert Allosteric release of cucurbit[6]uril from a rotaxane using a molecular signal. Chemical science, 2024, 16, 83-89 |
| 1573038 | CIF | C67 H98 F12 N29 O14.5 P2 | P a -3 | 36.79372; 36.79372; 36.79372 90; 90; 90 | 49810.5 | Závodná, Aneta; Janovský, Petr; Kolařík, Václav; Ward, Jas S.; Prucková, Zdeňka; Rouchal, Michal; Rissanen, Kari; Vícha, Robert Allosteric release of cucurbit[6]uril from a rotaxane using a molecular signal. Chemical science, 2024, 16, 83-89 |
| 1573045 | CIF | C66 H44 B Cl4 F20 N O P2 | P -1 | 13.37; 15.247; 16.3 87.59; 75.11; 79.81 | 3161 | You, Lijun; Roth, Daniel; Greb, Lutz Structural constraint at a P-P bond: phosphinophosphination of alkenes, alkynes, and carbonyls by a concerted mechanism. Chemical science, 2025, 16, 1716-1721 |
| 1573046 | CIF | C63 H48 B Cl2 F20 N O P2 | C 1 c 1 | 10.1018; 31.87; 18.321 90; 92.637; 90 | 5892.1 | You, Lijun; Roth, Daniel; Greb, Lutz Structural constraint at a P-P bond: phosphinophosphination of alkenes, alkynes, and carbonyls by a concerted mechanism. Chemical science, 2025, 16, 1716-1721 |
| 1573047 | CIF | C65 H42 B F20 N O P2 | P -1 | 13.124; 16.183; 17.493 110.67; 95.58; 113.696 | 3057 | You, Lijun; Roth, Daniel; Greb, Lutz Structural constraint at a P-P bond: phosphinophosphination of alkenes, alkynes, and carbonyls by a concerted mechanism. Chemical science, 2025, 16, 1716-1721 |
| 1573048 | CIF | C32.5 H34 Cl2 N O P2 | P -1 | 12.944; 13.582; 19.223 103.948; 103.841; 97.75 | 3117.5 | You, Lijun; Roth, Daniel; Greb, Lutz Structural constraint at a P-P bond: phosphinophosphination of alkenes, alkynes, and carbonyls by a concerted mechanism. Chemical science, 2025, 16, 1716-1721 |
| 1573049 | CIF | C71 H48 B Cl2 F20 N O P2 | P -1 | 14.195; 15.574; 16.591 82.59; 77.118; 64.527 | 3226 | You, Lijun; Roth, Daniel; Greb, Lutz Structural constraint at a P-P bond: phosphinophosphination of alkenes, alkynes, and carbonyls by a concerted mechanism. Chemical science, 2025, 16, 1716-1721 |
| 1573050 | CIF | C71 H58 B Cl4 F20 N O P2 | P -1 | 13.127; 16.617; 17.814 114.495; 98.862; 91.899 | 3473.5 | You, Lijun; Roth, Daniel; Greb, Lutz Structural constraint at a P-P bond: phosphinophosphination of alkenes, alkynes, and carbonyls by a concerted mechanism. Chemical science, 2025, 16, 1716-1721 |
| 1573051 | CIF | C48 H34 Al F36 N O5 P2 | P b c a | 20.836; 18.713; 29.74 90; 90; 90 | 11596 | You, Lijun; Roth, Daniel; Greb, Lutz Structural constraint at a P-P bond: phosphinophosphination of alkenes, alkynes, and carbonyls by a concerted mechanism. Chemical science, 2025, 16, 1716-1721 |
| 1573052 | CIF | C63 H40 B F20 N O2 P2 | P 1 21/c 1 | 11.884; 16.729; 31.882 90; 96.442; 90 | 6298 | You, Lijun; Roth, Daniel; Greb, Lutz Structural constraint at a P-P bond: phosphinophosphination of alkenes, alkynes, and carbonyls by a concerted mechanism. Chemical science, 2025, 16, 1716-1721 |
| 1573053 | CIF | C64 H42 B F20 N O2 P2 | C 1 2/c 1 | 50.046; 10.705; 27.527 90; 123.266; 90 | 12331 | You, Lijun; Roth, Daniel; Greb, Lutz Structural constraint at a P-P bond: phosphinophosphination of alkenes, alkynes, and carbonyls by a concerted mechanism. Chemical science, 2025, 16, 1716-1721 |
| 1573142 | CIF | C36 H22 B Cl Co F10 Fe N15 O4 | P 1 21/c 1 | 14.768; 22.615; 14.318 90; 109.286; 90 | 4514 | Yadav, Jyoti; Konar, Sanjit Spin state modulation and kinetic control of thermal contraction in a [Fe<sub>2</sub>Co<sub>2</sub>] discrete Prussian blue analogue. Chemical science, 2024, 16, 130-138 |
| 1573143 | CIF | C38 H32 B Cl Co F10 Fe N15 O7 | P 1 21/c 1 | 14.938; 20.83; 15.45 90; 103.72; 90 | 4670 | Yadav, Jyoti; Konar, Sanjit Spin state modulation and kinetic control of thermal contraction in a [Fe<sub>2</sub>Co<sub>2</sub>] discrete Prussian blue analogue. Chemical science, 2024, 16, 130-138 |
| 1573144 | CIF | C36 H24 B Cl Co F10 Fe N15 O5 | P 1 21/c 1 | 14.555; 22.133; 14.59 90; 107.506; 90 | 4482.4 | Yadav, Jyoti; Konar, Sanjit Spin state modulation and kinetic control of thermal contraction in a [Fe<sub>2</sub>Co<sub>2</sub>] discrete Prussian blue analogue. Chemical science, 2024, 16, 130-138 |
| 1573145 | CIF | C38 H29 B Cl Co F10 Fe N15 O7 | P 1 21/c 1 | 14.867; 20.702; 15.437 90; 103.782; 90 | 4614 | Yadav, Jyoti; Konar, Sanjit Spin state modulation and kinetic control of thermal contraction in a [Fe<sub>2</sub>Co<sub>2</sub>] discrete Prussian blue analogue. Chemical science, 2024, 16, 130-138 |
| 1573146 | CIF | C36 H24 B Cl Co F10 Fe N15 O5 | P 1 21/c 1 | 14.5844; 21.947; 14.54 90; 107.574; 90 | 4436.8 | Yadav, Jyoti; Konar, Sanjit Spin state modulation and kinetic control of thermal contraction in a [Fe<sub>2</sub>Co<sub>2</sub>] discrete Prussian blue analogue. Chemical science, 2024, 16, 130-138 |
| 1573147 | CIF | C36 H24 B Cl Co F10 Fe N15 O5 | P 1 21/c 1 | 14.5597; 22.1504; 14.5863 90; 107.475; 90 | 4487 | Yadav, Jyoti; Konar, Sanjit Spin state modulation and kinetic control of thermal contraction in a [Fe<sub>2</sub>Co<sub>2</sub>] discrete Prussian blue analogue. Chemical science, 2024, 16, 130-138 |
| 1573148 | CIF | C36 H24 B Cl Co F10 Fe N15 O5 | P 1 21/c 1 | 14.586; 21.94; 14.537 90; 107.634; 90 | 4433.5 | Yadav, Jyoti; Konar, Sanjit Spin state modulation and kinetic control of thermal contraction in a [Fe<sub>2</sub>Co<sub>2</sub>] discrete Prussian blue analogue. Chemical science, 2024, 16, 130-138 |
| 1573149 | CIF | C36 H24 B Cl Co F10 Fe N15 O5 | P 1 21/c 1 | 14.608; 21.69; 14.447 90; 107.574; 90 | 4363.9 | Yadav, Jyoti; Konar, Sanjit Spin state modulation and kinetic control of thermal contraction in a [Fe<sub>2</sub>Co<sub>2</sub>] discrete Prussian blue analogue. Chemical science, 2024, 16, 130-138 |
| 1573150 | CIF | C36 H24 B Cl Co F10 Fe N15 O5 | P 1 21/c 1 | 14.5088; 22.4672; 14.6367 90; 107.396; 90 | 4552.9 | Yadav, Jyoti; Konar, Sanjit Spin state modulation and kinetic control of thermal contraction in a [Fe<sub>2</sub>Co<sub>2</sub>] discrete Prussian blue analogue. Chemical science, 2024, 16, 130-138 |
| 1573151 | CIF | C36 H24 B Cl Co F10 Fe N15 O5 | P 1 21/c 1 | 14.5659; 21.8912; 14.5075 90; 107.593; 90 | 4409.6 | Yadav, Jyoti; Konar, Sanjit Spin state modulation and kinetic control of thermal contraction in a [Fe<sub>2</sub>Co<sub>2</sub>] discrete Prussian blue analogue. Chemical science, 2024, 16, 130-138 |
| 1573152 | CIF | C36 H24 B Cl Co F10 Fe N15 O5 | P 1 21/c 1 | 14.6328; 21.6526; 14.4816 90; 107.596; 90 | 4373.6 | Yadav, Jyoti; Konar, Sanjit Spin state modulation and kinetic control of thermal contraction in a [Fe<sub>2</sub>Co<sub>2</sub>] discrete Prussian blue analogue. Chemical science, 2024, 16, 130-138 |
| 1573153 | CIF | C36 H24 B Cl Co F10 Fe N15 O5 | P 1 21/c 1 | 14.618; 21.998; 14.513 90; 107.492; 90 | 4451.1 | Yadav, Jyoti; Konar, Sanjit Spin state modulation and kinetic control of thermal contraction in a [Fe<sub>2</sub>Co<sub>2</sub>] discrete Prussian blue analogue. Chemical science, 2024, 16, 130-138 |
| 1573154 | CIF | C36 H24 B Cl Co F10 Fe N15 O5 | P 1 21/c 1 | 14.5189; 22.4945; 14.6481 90; 107.387; 90 | 4565.4 | Yadav, Jyoti; Konar, Sanjit Spin state modulation and kinetic control of thermal contraction in a [Fe<sub>2</sub>Co<sub>2</sub>] discrete Prussian blue analogue. Chemical science, 2024, 16, 130-138 |
| 1573155 | CIF | C36 H24 B Cl Co F10 Fe N15 O5 | P 1 21/c 1 | 14.5568; 22.4909; 14.6069 90; 107.337; 90 | 4565 | Yadav, Jyoti; Konar, Sanjit Spin state modulation and kinetic control of thermal contraction in a [Fe<sub>2</sub>Co<sub>2</sub>] discrete Prussian blue analogue. Chemical science, 2024, 16, 130-138 |
| 1573156 | CIF | C38 H29 B Cl Co F10 Fe N15 O7 | P 1 21/c 1 | 14.852; 20.7; 15.425 90; 103.695; 90 | 4607 | Yadav, Jyoti; Konar, Sanjit Spin state modulation and kinetic control of thermal contraction in a [Fe<sub>2</sub>Co<sub>2</sub>] discrete Prussian blue analogue. Chemical science, 2024, 16, 130-138 |
| 1573157 | CIF | C38 H29 B Cl Co F10 Fe N15 O7 | P 1 21/c 1 | 14.735; 20.586; 15.382 90; 103.396; 90 | 4539 | Yadav, Jyoti; Konar, Sanjit Spin state modulation and kinetic control of thermal contraction in a [Fe<sub>2</sub>Co<sub>2</sub>] discrete Prussian blue analogue. Chemical science, 2024, 16, 130-138 |
| 1573160 | CIF | C84 H100 Ga2 N4 | I 41 c d | 17.2516; 17.2516; 47.4743 90; 90; 90 | 14129.2 | Merschel, Arne; Heda, Shkelqim; Vishnevskiy, Yury V.; Neumann, Beate; Stammler, Hans-Georg; Ghadwal, Rajendra S. Annulated carbocyclic gallylene and bis-gallylene with two-coordinated Ga(i) atoms. Chemical science, 2025, 16, 2222-2230 |
| 1573161 | CIF | C80 H78 F16 Ga2 N4 | P 1 21/c 1 | 19.4377; 19.6182; 19.7964 90; 100.679; 90 | 7418.3 | Merschel, Arne; Heda, Shkelqim; Vishnevskiy, Yury V.; Neumann, Beate; Stammler, Hans-Georg; Ghadwal, Rajendra S. Annulated carbocyclic gallylene and bis-gallylene with two-coordinated Ga(i) atoms. Chemical science, 2025, 16, 2222-2230 |
| 1573162 | CIF | C82.88 H87 Fe1.97 Ga2 I0.06 N4 O7.88 | P -1 | 10.8571; 14.302; 25.6182 98.115; 96.616; 102.807 | 3795.66 | Merschel, Arne; Heda, Shkelqim; Vishnevskiy, Yury V.; Neumann, Beate; Stammler, Hans-Georg; Ghadwal, Rajendra S. Annulated carbocyclic gallylene and bis-gallylene with two-coordinated Ga(i) atoms. Chemical science, 2025, 16, 2222-2230 |
| 1573163 | CIF | C78 H90 Cl4 Ga2 N4 | P 1 21/n 1 | 10.3023; 18.4534; 20.0384 90; 103.039; 90 | 3711.3 | Merschel, Arne; Heda, Shkelqim; Vishnevskiy, Yury V.; Neumann, Beate; Stammler, Hans-Georg; Ghadwal, Rajendra S. Annulated carbocyclic gallylene and bis-gallylene with two-coordinated Ga(i) atoms. Chemical science, 2025, 16, 2222-2230 |
| 1573164 | CIF | C73 H86 Ga2 N4 | P -1 | 12.7988; 14.6243; 18.1282 80.487; 79.632; 85.811 | 3288.5 | Merschel, Arne; Heda, Shkelqim; Vishnevskiy, Yury V.; Neumann, Beate; Stammler, Hans-Georg; Ghadwal, Rajendra S. Annulated carbocyclic gallylene and bis-gallylene with two-coordinated Ga(i) atoms. Chemical science, 2025, 16, 2222-2230 |
| 1573165 | CIF | C66 H78 Ga2 I4 N4 | P -1 | 10.5694; 12.1801; 13.6704 101.963; 98.911; 107.53 | 1596.52 | Merschel, Arne; Heda, Shkelqim; Vishnevskiy, Yury V.; Neumann, Beate; Stammler, Hans-Georg; Ghadwal, Rajendra S. Annulated carbocyclic gallylene and bis-gallylene with two-coordinated Ga(i) atoms. Chemical science, 2025, 16, 2222-2230 |
| 1573166 | CIF | C88 H88 F12 Ga2 N6 | C 1 2/c 1 | 21.1589; 19.2641; 19.4975 90; 91.377; 90 | 7945 | Merschel, Arne; Heda, Shkelqim; Vishnevskiy, Yury V.; Neumann, Beate; Stammler, Hans-Georg; Ghadwal, Rajendra S. Annulated carbocyclic gallylene and bis-gallylene with two-coordinated Ga(i) atoms. Chemical science, 2025, 16, 2222-2230 |
| 1573176 | CIF | C31 H51 N O5 | C 1 2 1 | 13.5566; 6.1185; 34.8632 90; 91.681; 90 | 2890.52 | Wang, Zengyuan; Alsup, Tyler A.; Pan, Xingming; Li, Lu-Lu; Tian, Jupeng; Yang, Ziyi; Lin, Xiaoxu; Xu, Hui-Min; Rudolf, Jeffrey D.; Dong, Liao-Bin Biosynthesis of a bacterial meroterpenoid reveals a non-canonical class II meroterpenoid cyclase. Chemical science, 2024, 16, 310-317 |
| 1573177 | CIF | C30 H51 N O5 | P 21 21 21 | 7.2412; 12.2368; 34.0916 90; 90; 90 | 3020.83 | Wang, Zengyuan; Alsup, Tyler A.; Pan, Xingming; Li, Lu-Lu; Tian, Jupeng; Yang, Ziyi; Lin, Xiaoxu; Xu, Hui-Min; Rudolf, Jeffrey D.; Dong, Liao-Bin Biosynthesis of a bacterial meroterpenoid reveals a non-canonical class II meroterpenoid cyclase. Chemical science, 2024, 16, 310-317 |
| 1573178 | CIF | C28 H28 Al4 | P -1 | 9.775; 16.6702; 25.7105 107.247; 93.692; 98.988 | 3924.7 | Lückert, Paula L; Gilmer, Jannik; Virovets, Alexander; Lerner, Hans-Wolfram; Wagner, Matthias Donor-free 9,10-dihydro-9,10-dialuminaanthracenes. Chemical science, 2024, 16, 147-155 |
| 1573179 | CIF | C12 H8 Al4 Br8 | P -1 | 8.5249; 10.084; 15.022 80.5; 80.878; 65.121 | 1149.72 | Lückert, Paula L; Gilmer, Jannik; Virovets, Alexander; Lerner, Hans-Wolfram; Wagner, Matthias Donor-free 9,10-dihydro-9,10-dialuminaanthracenes. Chemical science, 2024, 16, 147-155 |
| 1573180 | CIF | C23 H29 Al2 K N2 O1.5 | P -1 | 10.9074; 12.1287; 20.097 90.03; 91.767; 109.036 | 2511.9 | Lückert, Paula L; Gilmer, Jannik; Virovets, Alexander; Lerner, Hans-Wolfram; Wagner, Matthias Donor-free 9,10-dihydro-9,10-dialuminaanthracenes. Chemical science, 2024, 16, 147-155 |
| 1573181 | CIF | C30 H30 Al2 N2 | P -1 | 9.0697; 9.2595; 9.8024 112.117; 105.052; 102.588 | 689.09 | Lückert, Paula L; Gilmer, Jannik; Virovets, Alexander; Lerner, Hans-Wolfram; Wagner, Matthias Donor-free 9,10-dihydro-9,10-dialuminaanthracenes. Chemical science, 2024, 16, 147-155 |
| 1573182 | CIF | C24 H16 Al4 Br4 | P 1 2/n 1 | 10.1518; 9.9203; 12.7992 90; 100.072; 90 | 1269.13 | Lückert, Paula L; Gilmer, Jannik; Virovets, Alexander; Lerner, Hans-Wolfram; Wagner, Matthias Donor-free 9,10-dihydro-9,10-dialuminaanthracenes. Chemical science, 2024, 16, 147-155 |
| 1573183 | CIF | C13.9 H13.69 Al4 Br6.1 | P -1 | 8.1909; 8.1869; 9.8777 109.179; 102.057; 104.104 | 575.78 | Lückert, Paula L; Gilmer, Jannik; Virovets, Alexander; Lerner, Hans-Wolfram; Wagner, Matthias Donor-free 9,10-dihydro-9,10-dialuminaanthracenes. Chemical science, 2024, 16, 147-155 |
| 1573184 | CIF | C22 H24.67 Al2 N2.67 O0.67 | P 1 21/n 1 | 9.87648; 14.3894; 15.3682 90; 104.96; 90 | 2110.05 | Lückert, Paula L; Gilmer, Jannik; Virovets, Alexander; Lerner, Hans-Wolfram; Wagner, Matthias Donor-free 9,10-dihydro-9,10-dialuminaanthracenes. Chemical science, 2024, 16, 147-155 |
| 1573185 | CIF | C20 H28 Al2 Br2 O2 | C 1 2/c 1 | 19.694; 7.0404; 19.08 90; 120.073; 90 | 2289.4 | Lückert, Paula L; Gilmer, Jannik; Virovets, Alexander; Lerner, Hans-Wolfram; Wagner, Matthias Donor-free 9,10-dihydro-9,10-dialuminaanthracenes. Chemical science, 2024, 16, 147-155 |
| 1573186 | CIF | C20 H24 Al2 Br2 O2 | P 1 21/n 1 | 9.5845; 13.7779; 16.7652 90; 106.151; 90 | 2126.54 | Lückert, Paula L; Gilmer, Jannik; Virovets, Alexander; Lerner, Hans-Wolfram; Wagner, Matthias Donor-free 9,10-dihydro-9,10-dialuminaanthracenes. Chemical science, 2024, 16, 147-155 |
| 1573187 | CIF | C12 H8 Al4 Br8 | P -1 | 8.071; 8.2992; 9.8658 108.901; 101.51; 103.983 | 578.24 | Lückert, Paula L; Gilmer, Jannik; Virovets, Alexander; Lerner, Hans-Wolfram; Wagner, Matthias Donor-free 9,10-dihydro-9,10-dialuminaanthracenes. Chemical science, 2024, 16, 147-155 |
| 1573188 | CIF | C28 H24 Al2 Br2 N2 | P -1 | 9.0374; 9.3213; 9.7274 110.307; 104.486; 104.444 | 691.18 | Lückert, Paula L; Gilmer, Jannik; Virovets, Alexander; Lerner, Hans-Wolfram; Wagner, Matthias Donor-free 9,10-dihydro-9,10-dialuminaanthracenes. Chemical science, 2024, 16, 147-155 |
| 1573189 | CIF | C22 H40 Al2 Br5 N | P 1 21 1 | 9.4049; 16.9807; 10.3837 90; 108.989; 90 | 1568.05 | Lückert, Paula L; Gilmer, Jannik; Virovets, Alexander; Lerner, Hans-Wolfram; Wagner, Matthias Donor-free 9,10-dihydro-9,10-dialuminaanthracenes. Chemical science, 2024, 16, 147-155 |
| 1573190 | CIF | C22 H30 Al2 O2 | P 1 21/n 1 | 9.9086; 13.8047; 16.1315 90; 95.104; 90 | 2197.8 | Lückert, Paula L; Gilmer, Jannik; Virovets, Alexander; Lerner, Hans-Wolfram; Wagner, Matthias Donor-free 9,10-dihydro-9,10-dialuminaanthracenes. Chemical science, 2024, 16, 147-155 |
| 1573214 | CIF | C14 H13 Br O3 | P 1 21/c 1 | 6.5459; 7.4134; 27.118 90; 96.115; 90 | 1308.5 | Xu, Zurong; Zhu, Dong; Wu, Rui; Zhu, Shifa Tandem Rh(ii)-catalyzed 1,3-acyloxy migration/intermolecular [2 + 2] cycloaddition of electron-deficient propargylic esters with alkenes and alkynes. Chemical science, 2024, 16, 205-210 |
| 1573215 | CIF | C16 H14 O5 | P 1 21 1 | 6.7856; 6.0442; 16.6292 90; 92.683; 90 | 681.27 | Xu, Zurong; Zhu, Dong; Wu, Rui; Zhu, Shifa Tandem Rh(ii)-catalyzed 1,3-acyloxy migration/intermolecular [2 + 2] cycloaddition of electron-deficient propargylic esters with alkenes and alkynes. Chemical science, 2024, 16, 205-210 |
| 1573216 | CIF | C17 H24 Cu2 I3 N5 O | P 1 21/c 1 | 10.8995; 16.7093; 13.8142 90; 108.662; 90 | 2383.61 | Chen, Jingwen; Zhou, Kang; Li, Jingbai; Xu, Guozhong; Hei, Xiuze; Li, Jing Strongly photoluminescent and radioluminescent copper(i) iodide hybrid materials made of coordinated ionic chains. Chemical science, 2025, 16, 1106-1114 |
| 1573217 | CIF | C18 H26 Cu2 I3 N5 O | P 1 21/c 1 | 11.453; 17.025; 12.8883 90; 94.855; 90 | 2504 | Chen, Jingwen; Zhou, Kang; Li, Jingbai; Xu, Guozhong; Hei, Xiuze; Li, Jing Strongly photoluminescent and radioluminescent copper(i) iodide hybrid materials made of coordinated ionic chains. Chemical science, 2025, 16, 1106-1114 |
| 1573218 | CIF | C34 H47 Cu4 I6 N9 O2 | P -1 | 10.1107; 11.2297; 11.9172 73.93; 67.168; 71.862 | 1166.1 | Chen, Jingwen; Zhou, Kang; Li, Jingbai; Xu, Guozhong; Hei, Xiuze; Li, Jing Strongly photoluminescent and radioluminescent copper(i) iodide hybrid materials made of coordinated ionic chains. Chemical science, 2025, 16, 1106-1114 |
| 1573219 | CIF | C15 H19 Cu2 I3 N4 O2 | P 1 21/n 1 | 11.4886; 13.4361; 15.0603 90; 98.972; 90 | 2296.3 | Chen, Jingwen; Zhou, Kang; Li, Jingbai; Xu, Guozhong; Hei, Xiuze; Li, Jing Strongly photoluminescent and radioluminescent copper(i) iodide hybrid materials made of coordinated ionic chains. Chemical science, 2025, 16, 1106-1114 |
| 1573220 | CIF | C26 H58 B F4 N P2 Pt | P 1 21/n 1 | 8.585; 12.11; 29.773 90; 90.461; 90 | 3095.2 | Atterberry, Benjamin A.; Wimmer, Erik J.; Klostermann, Sina; Frey, Wolfgang; Kästner, Johannes; Estes, Deven P.; Rossini, Aaron J. Structural characterization of surface immobilized platinum hydrides by sensitivity-enhanced <sup>195</sup>Pt solid state NMR spectroscopy and DFT calculations. Chemical science, 2025, 16, 1271-1287 |
| 1573221 | CIF | C24 H57 B F4 O P2 Pt | P 1 21/c 1 | 11.5231; 16.5896; 16.5713 90; 106.8; 90 | 3032.63 | Atterberry, Benjamin A.; Wimmer, Erik J.; Klostermann, Sina; Frey, Wolfgang; Kästner, Johannes; Estes, Deven P.; Rossini, Aaron J. Structural characterization of surface immobilized platinum hydrides by sensitivity-enhanced <sup>195</sup>Pt solid state NMR spectroscopy and DFT calculations. Chemical science, 2025, 16, 1271-1287 |
| 1573222 | CIF | C26 H59 B Cl4 F4 P2 Pt | C 1 c 1 | 11.1587; 19.7667; 16.9439 90; 96.666; 90 | 3712.06 | Atterberry, Benjamin A.; Wimmer, Erik J.; Klostermann, Sina; Frey, Wolfgang; Kästner, Johannes; Estes, Deven P.; Rossini, Aaron J. Structural characterization of surface immobilized platinum hydrides by sensitivity-enhanced <sup>195</sup>Pt solid state NMR spectroscopy and DFT calculations. Chemical science, 2025, 16, 1271-1287 |
| 1573223 | CIF | C70 H92 Cl2 N6 O26 Zr6 | P n m a | 14.0277; 31.9593; 20.8847 90; 90; 90 | 9362.9 | Morey, Merissa N.; Montone, Christine M.; Dworzak, Michael R.; Yap, Glenn P. A.; Bloch, Eric D. Tunable synthesis of heteroleptic zirconium-based porous coordination cages. Chemical science, 2025, 16, 816-823 |
| 1573224 | CIF | C9 H5 As S2 | P 1 21/n 1 | 10.5045; 6.2032; 13.9819 90; 102.093; 90 | 890.86 | Sumida, Akifumi; Saeki, Akinori; Matsuo, Kyohei; Naka, Kensuke; Imoto, Hiroaki Dithienoarsinines: stable and planar π-extended arsabenzenes. Chemical science, 2025, 16, 1126-1135 |
| 1573225 | CIF | C17 H9 As S2 | C 1 2/c 1 | 13.4892; 8.5408; 23.219 90; 97.422; 90 | 2652.6 | Sumida, Akifumi; Saeki, Akinori; Matsuo, Kyohei; Naka, Kensuke; Imoto, Hiroaki Dithienoarsinines: stable and planar π-extended arsabenzenes. Chemical science, 2025, 16, 1126-1135 |
| 1573226 | CIF | C17 H9 As S2 | P 1 21/c 1 | 13.1348; 8.5422; 12.1986 90; 93.983; 90 | 1365.38 | Sumida, Akifumi; Saeki, Akinori; Matsuo, Kyohei; Naka, Kensuke; Imoto, Hiroaki Dithienoarsinines: stable and planar π-extended arsabenzenes. Chemical science, 2025, 16, 1126-1135 |
| 1573227 | CIF | C17 H9 P S2 | C 1 2/c 1 | 13.2423; 8.4253; 23.582 90; 97.092; 90 | 2610.9 | Sumida, Akifumi; Saeki, Akinori; Matsuo, Kyohei; Naka, Kensuke; Imoto, Hiroaki Dithienoarsinines: stable and planar π-extended arsabenzenes. Chemical science, 2025, 16, 1126-1135 |
| 1573228 | CIF | C34 H20 O3 P2 S4 | P -1 | 7.4187; 13.2453; 17.9755 77.315; 81.898; 76.885 | 1670.53 | Sumida, Akifumi; Saeki, Akinori; Matsuo, Kyohei; Naka, Kensuke; Imoto, Hiroaki Dithienoarsinines: stable and planar π-extended arsabenzenes. Chemical science, 2025, 16, 1126-1135 |
| 1573229 | CIF | C34 H16 As2 S4 | P -1 | 8.0954; 11.366; 15.4655 87.822; 85.309; 80.114 | 1396.77 | Sumida, Akifumi; Saeki, Akinori; Matsuo, Kyohei; Naka, Kensuke; Imoto, Hiroaki Dithienoarsinines: stable and planar π-extended arsabenzenes. Chemical science, 2025, 16, 1126-1135 |
| 1573230 | CIF | C17 H9 As S2 | P 1 21/c 1 | 14.5703; 3.9421; 23.8017 90; 99.317; 90 | 1349.08 | Sumida, Akifumi; Saeki, Akinori; Matsuo, Kyohei; Naka, Kensuke; Imoto, Hiroaki Dithienoarsinines: stable and planar π-extended arsabenzenes. Chemical science, 2025, 16, 1126-1135 |
| 1573231 | CIF | C15 H11 As O4 S2 | P 1 21/c 1 | 10.403; 14.0494; 10.7101 90; 99.246; 90 | 1545.01 | Sumida, Akifumi; Saeki, Akinori; Matsuo, Kyohei; Naka, Kensuke; Imoto, Hiroaki Dithienoarsinines: stable and planar π-extended arsabenzenes. Chemical science, 2025, 16, 1126-1135 |
| 1573232 | CIF | C9 H5 As S2 | P 1 n 1 | 6.1248; 11.3296; 12.9122 90; 95.535; 90 | 891.82 | Sumida, Akifumi; Saeki, Akinori; Matsuo, Kyohei; Naka, Kensuke; Imoto, Hiroaki Dithienoarsinines: stable and planar π-extended arsabenzenes. Chemical science, 2025, 16, 1126-1135 |
| 1573233 | CIF | C14 H5 As O5 S2 W | P -1 | 7.312; 10.1653; 11.2954 92.355; 106.909; 100.48 | 785.92 | Sumida, Akifumi; Saeki, Akinori; Matsuo, Kyohei; Naka, Kensuke; Imoto, Hiroaki Dithienoarsinines: stable and planar π-extended arsabenzenes. Chemical science, 2025, 16, 1126-1135 |
| 1573234 | CIF | C23 H13 As S2 | I 1 2/a 1 | 16.1897; 7.1373; 31.4478 90; 90.732; 90 | 3633.5 | Sumida, Akifumi; Saeki, Akinori; Matsuo, Kyohei; Naka, Kensuke; Imoto, Hiroaki Dithienoarsinines: stable and planar π-extended arsabenzenes. Chemical science, 2025, 16, 1126-1135 |
| 1573235 | CIF | C23 H15 As O4 S2 | P n a 21 | 17.8326; 7.736; 30.234 90; 90; 90 | 4170.9 | Sumida, Akifumi; Saeki, Akinori; Matsuo, Kyohei; Naka, Kensuke; Imoto, Hiroaki Dithienoarsinines: stable and planar π-extended arsabenzenes. Chemical science, 2025, 16, 1126-1135 |
| 1573236 | CIF | C37 H24 N2 O | P -1 | 6.499; 11.218; 17.798 97.448; 93.423; 90.73 | 1284.1 | Dai, Hui; Liang, Yaohui; Long, Xiang; Tang, Tianyi; Xie, Haozhi; Ma, Zhiwei; Li, Gaoyu; Yang, Zhan; Zhao, Juan; Chi, Zhenguo An effective design strategy for thermally activated delayed fluorescence emitters with aggregation-induced emission to enable sky-blue OLEDs that achieve an EQE of nearly 30. Chemical science, 2024, 16, 156-162 |
| 1573237 | CIF | C37 H22 N2 O2 | P -1 | 5.7116; 12.3669; 18.667 102.633; 91.04; 92.503 | 1284.87 | Dai, Hui; Liang, Yaohui; Long, Xiang; Tang, Tianyi; Xie, Haozhi; Ma, Zhiwei; Li, Gaoyu; Yang, Zhan; Zhao, Juan; Chi, Zhenguo An effective design strategy for thermally activated delayed fluorescence emitters with aggregation-induced emission to enable sky-blue OLEDs that achieve an EQE of nearly 30. Chemical science, 2024, 16, 156-162 |
| 1573254 | CIF | C11 H15 Ag F6 N5 P | P -1 | 8.9329; 9.2591; 11.0005 97.817; 98.36; 109.228 | 833.34 | Chen, Zhe; Ouyang, Laofeng; Wang, Ning; Li, Weikang; Ke, Zhuofeng Remote C-H bond cooperation strategy enabled silver catalyzed borrowing hydrogen reactions. Chemical science, 2024, 16, 163-170 |
| 1573255 | CIF | C10 H16 Ag F6 N4 P | C 1 2/c 1 | 11.2729; 21.486; 6.9612 90; 111.597; 90 | 1567.7 | Chen, Zhe; Ouyang, Laofeng; Wang, Ning; Li, Weikang; Ke, Zhuofeng Remote C-H bond cooperation strategy enabled silver catalyzed borrowing hydrogen reactions. Chemical science, 2024, 16, 163-170 |
| 1573256 | CIF | C760 H564 Cd16 N96 O16 | C c c a :2 | 28.333; 43.635; 40.669 90; 90; 90 | 50280 | Li, Yu-Qing; Zhao, He; Han, Ermeng; Jiang, Zhiyuan; Bai, Qixia; Guan, Yu-Ming; Zhang, Zhe; Wu, Tun; Wang, Pingshan Dynamic selection in metallo-organic cube Cd<sup>II</sup> <sub>8</sub>L<sub>4</sub> conformations induced by perfluorooctanoate encapsulation. Chemical science, 2024, 16, 364-370 |
| 1573269 | CIF | C166 H123 | C 1 2/c 1 | 43.6143; 10.572; 25.1335 90; 98.309; 90 | 11467.2 | Sanderson, Hugh J.; Helbig, Andreas; Kociok-Köhn, Gabriele; Helten, Holger; Hintermair, Ulrich Reversible formation of tetraphenylpentalene, a room temperature stable antiaromatic hydrocarbon. Chemical science, 2025, 16, 952-961 |
| 1573270 | CIF | C40 H56 Fe P2 | P 1 21/n 1 | 6.0446; 34.1672; 17.5241 90; 96.228; 90 | 3597.8 | Franz, Roman; Bartek, Máté; Bruhn, Clemens; Kelemen, Zsolt; Pietschnig, Rudolf P<sup>+</sup> addition and transfer involving a tetraphosphenium ion. Chemical science, 2024, 16, 139-146 |
| 1573271 | CIF | C18 H28 B F4 Fe P3 | P 1 21/n 1 | 10.9377; 15.3369; 13.4763 90; 107.121; 90 | 2160.47 | Franz, Roman; Bartek, Máté; Bruhn, Clemens; Kelemen, Zsolt; Pietschnig, Rudolf P<sup>+</sup> addition and transfer involving a tetraphosphenium ion. Chemical science, 2024, 16, 139-146 |
| 1573272 | CIF | C42 H58 Al2 Cl12 Fe P4 | P -1 | 9.2572; 16.6386; 18.679 96.852; 99.363; 94.47 | 2804.5 | Franz, Roman; Bartek, Máté; Bruhn, Clemens; Kelemen, Zsolt; Pietschnig, Rudolf P<sup>+</sup> addition and transfer involving a tetraphosphenium ion. Chemical science, 2024, 16, 139-146 |
| 1573273 | CIF | C20 H51 O4 Si3 Y | P 1 21/n 1 | 9.9283; 32.1189; 10.3633 90; 112.542; 90 | 3052.23 | Tanuhadi, Elias; Bair, Anna S.; Johnson, Mary; Fontaine, Philip; Klosin, Jerzy; Pal, Sudipta; Arnold, Polly L. Stabilization of reactive rare earth alkyl complexes through mechanistic studies. Chemical science, 2024, 16, 280-287 |
| 1573274 | CIF | C20 H51 Lu O4 Si3 | P 1 21/c 1 | 10.6318; 9.5844; 29.2885 90; 90.415; 90 | 2984.4 | Tanuhadi, Elias; Bair, Anna S.; Johnson, Mary; Fontaine, Philip; Klosin, Jerzy; Pal, Sudipta; Arnold, Polly L. Stabilization of reactive rare earth alkyl complexes through mechanistic studies. Chemical science, 2024, 16, 280-287 |
| 1573275 | CIF | C18 H47 Lu O3 Si3 | P 1 21/n 1 | 19.0642; 15.9861; 19.1033 90; 107.166; 90 | 5562.62 | Tanuhadi, Elias; Bair, Anna S.; Johnson, Mary; Fontaine, Philip; Klosin, Jerzy; Pal, Sudipta; Arnold, Polly L. Stabilization of reactive rare earth alkyl complexes through mechanistic studies. Chemical science, 2024, 16, 280-287 |
| 1573276 | CIF | C18 H49 N2 Sc Si3 | P 21 21 21 | 10.2696; 15.0304; 17.6083 90; 90; 90 | 2717.95 | Tanuhadi, Elias; Bair, Anna S.; Johnson, Mary; Fontaine, Philip; Klosin, Jerzy; Pal, Sudipta; Arnold, Polly L. Stabilization of reactive rare earth alkyl complexes through mechanistic studies. Chemical science, 2024, 16, 280-287 |
| 1573277 | CIF | C18 H49 Lu N2 Si3 | P 21 21 21 | 9.7614; 16.1956; 17.1923 90; 90; 90 | 2717.96 | Tanuhadi, Elias; Bair, Anna S.; Johnson, Mary; Fontaine, Philip; Klosin, Jerzy; Pal, Sudipta; Arnold, Polly L. Stabilization of reactive rare earth alkyl complexes through mechanistic studies. Chemical science, 2024, 16, 280-287 |
| 1573278 | CIF | C18 H47 O3 Sc Si3 | P 1 21/n 1 | 9.4868; 15.7772; 18.6972 90; 101.956; 90 | 2737.8 | Tanuhadi, Elias; Bair, Anna S.; Johnson, Mary; Fontaine, Philip; Klosin, Jerzy; Pal, Sudipta; Arnold, Polly L. Stabilization of reactive rare earth alkyl complexes through mechanistic studies. Chemical science, 2024, 16, 280-287 |
| 1573279 | CIF | C18 H49 N2 Si3 Sm | P 21 21 21 | 9.8737; 16.2253; 17.3545 90; 90; 90 | 2780.26 | Tanuhadi, Elias; Bair, Anna S.; Johnson, Mary; Fontaine, Philip; Klosin, Jerzy; Pal, Sudipta; Arnold, Polly L. Stabilization of reactive rare earth alkyl complexes through mechanistic studies. Chemical science, 2024, 16, 280-287 |
| 1573280 | CIF | C18 H49 P2 Sc Si3 | P n a 21 | 16.9327; 9.5169; 18.2023 90; 90; 90 | 2933.24 | Tanuhadi, Elias; Bair, Anna S.; Johnson, Mary; Fontaine, Philip; Klosin, Jerzy; Pal, Sudipta; Arnold, Polly L. Stabilization of reactive rare earth alkyl complexes through mechanistic studies. Chemical science, 2024, 16, 280-287 |
| 1573281 | CIF | C18 H47 O3 Si3 Y | P 1 21/n 1 | 11.1358; 18.3119; 13.4974 90; 92.304; 90 | 2750.13 | Tanuhadi, Elias; Bair, Anna S.; Johnson, Mary; Fontaine, Philip; Klosin, Jerzy; Pal, Sudipta; Arnold, Polly L. Stabilization of reactive rare earth alkyl complexes through mechanistic studies. Chemical science, 2024, 16, 280-287 |
| 1573282 | CIF | C22 H57 Lu O P2 Si3 | P 21 21 21 | 10.4969; 18.0432; 18.0533 90; 90; 90 | 3419.25 | Tanuhadi, Elias; Bair, Anna S.; Johnson, Mary; Fontaine, Philip; Klosin, Jerzy; Pal, Sudipta; Arnold, Polly L. Stabilization of reactive rare earth alkyl complexes through mechanistic studies. Chemical science, 2024, 16, 280-287 |
| 1573286 | CIF | C35 H28 Cl4 P2 Pt | P 1 21/n 1 | 8.9321; 25.8402; 16.2519 90; 95.622; 90 | 3733 | Lindahl, Sarah E.; Metzger, Erin M.; Chen, Chun-Hsing; Pink, Maren; Zaleski, Jeffrey M. Pronounced electronic modulation of geometrically-regulated metalloenediyne cyclization. Chemical science, 2024, 16, 255-279 |
| 1573287 | CIF | C43 H42 Cl2 O2 P2 | P 1 21/c 1 | 8.7241; 18.1674; 24.8336 90; 90.885; 90 | 3935.5 | Lindahl, Sarah E.; Metzger, Erin M.; Chen, Chun-Hsing; Pink, Maren; Zaleski, Jeffrey M. Pronounced electronic modulation of geometrically-regulated metalloenediyne cyclization. Chemical science, 2024, 16, 255-279 |
| 1573288 | CIF | C47 H28 F24 O2 P2 | P 1 21/c 1 | 10.2044; 19.1296; 24.2065 90; 90.207; 90 | 4725.2 | Lindahl, Sarah E.; Metzger, Erin M.; Chen, Chun-Hsing; Pink, Maren; Zaleski, Jeffrey M. Pronounced electronic modulation of geometrically-regulated metalloenediyne cyclization. Chemical science, 2024, 16, 255-279 |
| 1573289 | CIF | C42 H18 Cl2 F24 P2 Pt | P 1 21/c 1 | 13.4013; 23.743; 14.4223 90; 99.623; 90 | 4524.4 | Lindahl, Sarah E.; Metzger, Erin M.; Chen, Chun-Hsing; Pink, Maren; Zaleski, Jeffrey M. Pronounced electronic modulation of geometrically-regulated metalloenediyne cyclization. Chemical science, 2024, 16, 255-279 |
| 1573290 | CIF | C42 H40 P2 | P -1 | 9.1022; 9.6658; 20.7479 91.7747; 92.4701; 102.405 | 1779.6 | Lindahl, Sarah E.; Metzger, Erin M.; Chen, Chun-Hsing; Pink, Maren; Zaleski, Jeffrey M. Pronounced electronic modulation of geometrically-regulated metalloenediyne cyclization. Chemical science, 2024, 16, 255-279 |
| 1573291 | CIF | C42 H42 Cl2 P2 Pt | P n m a | 16.5978; 19.5096; 18.9329 90; 90; 90 | 6130.8 | Lindahl, Sarah E.; Metzger, Erin M.; Chen, Chun-Hsing; Pink, Maren; Zaleski, Jeffrey M. Pronounced electronic modulation of geometrically-regulated metalloenediyne cyclization. Chemical science, 2024, 16, 255-279 |
| 1573292 | CIF | C22 H34 Cl2 P2 Pt | P 1 21/n 1 | 7.5197; 17.6155; 17.7459 90; 95.268; 90 | 2340.8 | Lindahl, Sarah E.; Metzger, Erin M.; Chen, Chun-Hsing; Pink, Maren; Zaleski, Jeffrey M. Pronounced electronic modulation of geometrically-regulated metalloenediyne cyclization. Chemical science, 2024, 16, 255-279 |
| 1573293 | CIF | C22 H32 Cl2 P2 Pt | P 1 21/c 1 | 19.6329; 14.5514; 18.4286 90; 113.829; 90 | 4816 | Lindahl, Sarah E.; Metzger, Erin M.; Chen, Chun-Hsing; Pink, Maren; Zaleski, Jeffrey M. Pronounced electronic modulation of geometrically-regulated metalloenediyne cyclization. Chemical science, 2024, 16, 255-279 |
| 1573294 | CIF | C39 H24 Cl4 F12 P2 Pt | P 1 21/n 1 | 10.297; 21.652; 19.471 90; 104.527; 90 | 4202.3 | Lindahl, Sarah E.; Metzger, Erin M.; Chen, Chun-Hsing; Pink, Maren; Zaleski, Jeffrey M. Pronounced electronic modulation of geometrically-regulated metalloenediyne cyclization. Chemical science, 2024, 16, 255-279 |
| 1573295 | CIF | C42 H16 F24 P2 | C 1 2/c 1 | 18.2822; 17.4936; 15.4479 90; 124.678; 90 | 4062.9 | Lindahl, Sarah E.; Metzger, Erin M.; Chen, Chun-Hsing; Pink, Maren; Zaleski, Jeffrey M. Pronounced electronic modulation of geometrically-regulated metalloenediyne cyclization. Chemical science, 2024, 16, 255-279 |
| 1573296 | CIF | C42 H16 Cl2 F24 P2 Pt | P 1 21/n 1 | 12.3782; 21.2832; 17.4143 90; 90.947; 90 | 4587.1 | Lindahl, Sarah E.; Metzger, Erin M.; Chen, Chun-Hsing; Pink, Maren; Zaleski, Jeffrey M. Pronounced electronic modulation of geometrically-regulated metalloenediyne cyclization. Chemical science, 2024, 16, 255-279 |
| 1573297 | CIF | C92 H96 Cl20 P4 Pt2 | P b c n | 22.317; 21.114; 21.952 90; 90; 90 | 10344 | Lindahl, Sarah E.; Metzger, Erin M.; Chen, Chun-Hsing; Pink, Maren; Zaleski, Jeffrey M. Pronounced electronic modulation of geometrically-regulated metalloenediyne cyclization. Chemical science, 2024, 16, 255-279 |
| 1573298 | CIF | C15 H16 Eu N6 O11 | P 1 21/n 1 | 10.0737; 16.5107; 12.7562 90; 104.639; 90 | 2052.79 | Sorace, Lorenzo; Dmitriev, Alexey A.; Perfetti, Mauro; Vostrikova, Kira E. Slow magnetic relaxation and strong magnetic coupling in the nitroxyl radical complexes of lanthanide(iii) with diamagnetic ground state (Ln = Lu, Eu). Chemical science, 2024, 16, 218-232 |
| 1573299 | CIF | C15 H16 Lu N6 O11 | P 1 21/n 1 | 9.9511; 16.4632; 12.8156 90; 104.088; 90 | 2036.39 | Sorace, Lorenzo; Dmitriev, Alexey A.; Perfetti, Mauro; Vostrikova, Kira E. Slow magnetic relaxation and strong magnetic coupling in the nitroxyl radical complexes of lanthanide(iii) with diamagnetic ground state (Ln = Lu, Eu). Chemical science, 2024, 16, 218-232 |
| 1573300 | CIF | C30 H25 N O3 | P 1 | 9.9067; 11.5214; 11.6032 93.702; 109.012; 103.102 | 1205.68 | He, Yicheng; Yan, Biwei; Ma, Cheng; Ni, Shaofei; Guo, Wusheng Ni-catalyzed asymmetric decarboxylation for the construction of carbocycles with contiguous quaternary carbon stereocenters. Chemical science, 2025, 16, 834-839 |
| 1573301 | CIF | C30 H27 N O3 | P 21 21 21 | 7.51317; 15.2775; 21.463 90; 90; 90 | 2463.58 | He, Yicheng; Yan, Biwei; Ma, Cheng; Ni, Shaofei; Guo, Wusheng Ni-catalyzed asymmetric decarboxylation for the construction of carbocycles with contiguous quaternary carbon stereocenters. Chemical science, 2025, 16, 834-839 |
| 1573302 | CIF | C28 H21 N O2 | P 21 21 21 | 6.22984; 15.4298; 22.0803 90; 90; 90 | 2122.47 | He, Yicheng; Yan, Biwei; Ma, Cheng; Ni, Shaofei; Guo, Wusheng Ni-catalyzed asymmetric decarboxylation for the construction of carbocycles with contiguous quaternary carbon stereocenters. Chemical science, 2025, 16, 834-839 |
| 1573303 | CIF | C22 H24 Cu F12 N10 O8 S4 | P -1 | 10.3863; 13.163; 14.3802 90.6959; 101.511; 104.786 | 1858.52 | Nishiguchi, Taichi; Ohara, Yuki; Kadota, Kentaro; Zheng, Xin; Noro, Shin-Ichiro; Horike, Satoshi Mechanically induced polyamorphism in a one-dimensional coordination polymer. Chemical science, 2025, 16, 621-626 |
| 1573309 | CIF | C14 H15 N3 | P -1 | 8.7161; 9.2511; 9.8844 63.309; 64.432; 72.772 | 637.16 | Mandal, Mrinal; Mardanya, Sukumar; Saha, Arijit; Singh, Manjeev; Ghosh, Swarnali; Chatterjee, Tanmay; Patra, Ramen; Bhunia, Surojit; Mandal, Saptarshi; Mukherjee, Soumen; Debnath, Rahul; Reddy, C. Malla; Das, Mousumi; Mandal, Prasun K. Charge-transfer mediated J-aggregation in red emitting ultra-small-single-benzenic <i>meta</i>-fluorophore crystals. Chemical science, 2025, 16, 901-909 |
| 1573310 | CIF | C12 H11 N3 | P 1 21/c 1 | 15.292; 10.45; 6.872 90; 97.614; 90 | 1088.5 | Mandal, Mrinal; Mardanya, Sukumar; Saha, Arijit; Singh, Manjeev; Ghosh, Swarnali; Chatterjee, Tanmay; Patra, Ramen; Bhunia, Surojit; Mandal, Saptarshi; Mukherjee, Soumen; Debnath, Rahul; Reddy, C. Malla; Das, Mousumi; Mandal, Prasun K. Charge-transfer mediated J-aggregation in red emitting ultra-small-single-benzenic <i>meta</i>-fluorophore crystals. Chemical science, 2025, 16, 901-909 |
| 1573368 | CIF | C59 H82 Ga2 N4 O P2 | P 1 21/c 1 | 23.5423; 13.8181; 17.4303 90; 96.371; 90 | 5635.2 | Sharma, Mahendra K.; Wölper, Christoph; Siera, Hannah; Haberhauer, Gebhard; Schulz, Stephan Synthesis and reactivity of a six-membered heterocyclic 1,3-diphosphaallene. Chemical science, 2025, 16, 1189-1196 |
| 1573369 | CIF | C72 H108 Ga2 N6 O P2 | C 1 2/c 1 | 26.3977; 13.4903; 40.1349 90; 91.7723; 90 | 14285.7 | Sharma, Mahendra K.; Wölper, Christoph; Siera, Hannah; Haberhauer, Gebhard; Schulz, Stephan Synthesis and reactivity of a six-membered heterocyclic 1,3-diphosphaallene. Chemical science, 2025, 16, 1189-1196 |
| 1573370 | CIF | C69 H106 Ga2 N4 O P2 Si | P 1 21/c 1 | 15.1894; 13.1269; 34.6139 90; 96.719; 90 | 6854.3 | Sharma, Mahendra K.; Wölper, Christoph; Siera, Hannah; Haberhauer, Gebhard; Schulz, Stephan Synthesis and reactivity of a six-membered heterocyclic 1,3-diphosphaallene. Chemical science, 2025, 16, 1189-1196 |
| 1573371 | CIF | C79 H111 Ga2 N6 O P2 | C 1 2/c 1 | 20.731; 18.24; 39.5206 90; 95.9543; 90 | 14863.4 | Sharma, Mahendra K.; Wölper, Christoph; Siera, Hannah; Haberhauer, Gebhard; Schulz, Stephan Synthesis and reactivity of a six-membered heterocyclic 1,3-diphosphaallene. Chemical science, 2025, 16, 1189-1196 |
| 1573372 | CIF | C28 H27 N3 O2 S | P -1 | 9.4004; 10.111; 13.6049 97.488; 104.094; 95.42 | 1232.74 | Saha, Shib Nath; Ballav, Nityananda; Ghosh, Suman; Baidya, Mahiuddin Regioselective intermolecular carboamination of allylamines <i>via</i> nucleopalladation: empowering three-component synthesis of vicinal diamines. Chemical science, 2024, 16, 386-392 |
| 1573373 | CIF | C21 H21 N3 O | P 1 21/c 1 | 9.9446; 20.0301; 18.2275 90; 95.7521; 90 | 3612.5 | Saha, Shib Nath; Ballav, Nityananda; Ghosh, Suman; Baidya, Mahiuddin Regioselective intermolecular carboamination of allylamines <i>via</i> nucleopalladation: empowering three-component synthesis of vicinal diamines. Chemical science, 2024, 16, 386-392 |
| 1573374 | CIF | C15 H23 B O4 | P -1 | 9.1472; 9.2824; 9.3217 97.608; 94.602; 101.377 | 764.48 | Vyas, Het; Gangani, Ashvin J.; Mini, Aiswarya; Pathil, Melissa; Ruth, Austin; Sharma, Abhishek Strain-release enables access to carbonyl conjugated allylic diborons and alkenyl boronates having multiple contiguous stereocenters in a one-pot process. Chemical science, 2025, 16, 1205-1215 |
| 1573375 | CIF | C22 H28 B N O7 | P 1 21/c 1 | 17.4121; 10.4286; 13.1111 90; 109.67; 90 | 2241.84 | Vyas, Het; Gangani, Ashvin J.; Mini, Aiswarya; Pathil, Melissa; Ruth, Austin; Sharma, Abhishek Strain-release enables access to carbonyl conjugated allylic diborons and alkenyl boronates having multiple contiguous stereocenters in a one-pot process. Chemical science, 2025, 16, 1205-1215 |
| 1573376 | CIF | C9 H7 F6 N5 | P n a 21 | 10.0705; 18.6804; 5.758 90; 90; 90 | 1083.2 | Michelini, Lorenzo; Slaney, Tanya; Virk, Seerat; Rafic, Estefanía; Qie, L. Charlie; Corejova, Klara; Lepage, Mathieu L.; Musolino, Stefania F.; Oliver, Allen G.; Etchenique, Roberto; Hong, W. David; DiLabio, Gino A.; Wulff, Jeremy E. A diazirine's central carbon is sp<sup>2</sup>-hybridized, facilitating conjugation to dye molecules. Chemical science, 2025, 16, 970-979 |
| 1573398 | CIF | C34 H28 N2 O6 | P b c a | 10.6143; 13.2575; 19.9774 90; 90; 90 | 2811.2 | Zhou, Huan; Zhang, Yuxuan; Zheng, Zhiye; Wan, Junhua; Zhang, Hui; Lin, Kunhua; Sessler, Jonathan L.; Wang, Hongyu Internally diketopyrrolopyrrole-bridged bis-anthracene macrocycle: a multifunctional fluorescent platform. Chemical science, 2025, 16, 910-919 |
| 1573399 | CIF | C80 H66 N16 O8 | P -1 | 11.1096; 11.2145; 15.2337 68.402; 79.501; 69.937 | 1654.2 | Zhou, Huan; Zhang, Yuxuan; Zheng, Zhiye; Wan, Junhua; Zhang, Hui; Lin, Kunhua; Sessler, Jonathan L.; Wang, Hongyu Internally diketopyrrolopyrrole-bridged bis-anthracene macrocycle: a multifunctional fluorescent platform. Chemical science, 2025, 16, 910-919 |
| 1573400 | CIF | C100 H92 Cl3 N16 O18 | P -1 | 14.3247; 17.1233; 23.0646 96.822; 98.846; 108.196 | 5226.07 | Wang, Shuhe; Sigl, Johannes; Allmendinger, Lars; Maurizot, Victor; Huc, Ivan Design of an abiotic unimolecular three-helix bundle. Chemical science, 2025, 16, 1136-1146 |
| 1573401 | CIF | C104.52 H93.44 Cl2 N19 O17.94 | P -1 | 13.1606; 17.3713; 24.34 95.661; 93.989; 105.354 | 5313.14 | Wang, Shuhe; Sigl, Johannes; Allmendinger, Lars; Maurizot, Victor; Huc, Ivan Design of an abiotic unimolecular three-helix bundle. Chemical science, 2025, 16, 1136-1146 |
| 1573402 | CIF | C17 H16 F N O2 | P 1 21 1 | 6.4767; 15.7755; 7.425 90; 100.19; 90 | 746.67 | Tian, Kui; Jin, Zhuan; Liu, Xin-Lian; He, Ling; Liu, Hong-Fu; Yu, Pin-Ke; Chang, Xin; Dong, Xiu-Qin; Wang, Chun-Jiang Stereodivergent assembly of δ-valerolactones with an azaarene-containing quaternary stereocenter enabled by Cu/Ru relay catalysis. Chemical science, 2025, 16, 1233-1240 |
| 1573403 | CIF | C16 H19 N3 | P 1 21 1 | 7.8385; 5.253; 16.8163 90; 103.167; 90 | 674.22 | Pilopp, Yannic; Beer, Henrik; Bresien, Jonas; Michalik, Dirk; Villinger, Alexander; Schulz, Axel Designing a visible light-mediated double photoswitch: a combination of biradical and azobenzene structural motifs that can be switched independently. Chemical science, 2025, 16, 876-888 |
| 1573404 | CIF | C65 H67 N5 P2 | P 1 21/c 1 | 10.8196; 21.236; 24.229 90; 102.703; 90 | 5430.7 | Pilopp, Yannic; Beer, Henrik; Bresien, Jonas; Michalik, Dirk; Villinger, Alexander; Schulz, Axel Designing a visible light-mediated double photoswitch: a combination of biradical and azobenzene structural motifs that can be switched independently. Chemical science, 2025, 16, 876-888 |
| 1573405 | CIF | C17 H17 N3 | P 1 21/c 1 | 7.2792; 9.3758; 20.838 90; 99.559; 90 | 1402.4 | Pilopp, Yannic; Beer, Henrik; Bresien, Jonas; Michalik, Dirk; Villinger, Alexander; Schulz, Axel Designing a visible light-mediated double photoswitch: a combination of biradical and azobenzene structural motifs that can be switched independently. Chemical science, 2025, 16, 876-888 |
| 1573406 | CIF | C65 H66 F N5 P2 | P 1 21/n 1 | 10.8647; 21.2993; 24.1947 90; 102.911; 90 | 5457.4 | Pilopp, Yannic; Beer, Henrik; Bresien, Jonas; Michalik, Dirk; Villinger, Alexander; Schulz, Axel Designing a visible light-mediated double photoswitch: a combination of biradical and azobenzene structural motifs that can be switched independently. Chemical science, 2025, 16, 876-888 |
| 1573407 | CIF | C17 H19 N3 O | P 21 21 21 | 4.6237; 9.0404; 35.034 90; 90; 90 | 1464.4 | Pilopp, Yannic; Beer, Henrik; Bresien, Jonas; Michalik, Dirk; Villinger, Alexander; Schulz, Axel Designing a visible light-mediated double photoswitch: a combination of biradical and azobenzene structural motifs that can be switched independently. Chemical science, 2025, 16, 876-888 |
| 1573408 | CIF | C206 H123 Al8 F233 O24 Y2 | P 1 21/n 1 | 18.06498; 19.02813; 39.8336 90; 94.9425; 90 | 13641.6 | Corner, Sophie C.; Blackmore, William J. A.; Gransbury, Gemma K.; Mattioni, Andrea; Whitehead, George F. S.; Chilton, Nicholas F.; Mills, David P. A fluorobenzene-bound dysprosium half-sandwich dication single-molecule magnet. Chemical science, 2025, 16, 610-620 |
| 1573409 | CIF | C74 H154 B12 Dy6 | P -1 | 15.6166; 16.3417; 21.7358 90.725; 110.278; 117.066 | 4536 | Corner, Sophie C.; Blackmore, William J. A.; Gransbury, Gemma K.; Mattioni, Andrea; Whitehead, George F. S.; Chilton, Nicholas F.; Mills, David P. A fluorobenzene-bound dysprosium half-sandwich dication single-molecule magnet. Chemical science, 2025, 16, 610-620 |
| 1573410 | CIF | C62 H25 Al2 Dy F78 O8 | P 1 21/c 1 | 21.7517; 20.9203; 18.7796 90; 93.564; 90 | 8529.2 | Corner, Sophie C.; Blackmore, William J. A.; Gransbury, Gemma K.; Mattioni, Andrea; Whitehead, George F. S.; Chilton, Nicholas F.; Mills, David P. A fluorobenzene-bound dysprosium half-sandwich dication single-molecule magnet. Chemical science, 2025, 16, 610-620 |
| 1573411 | CIF | C10 H23 B2 Dy | P 1 21/c 1 | 8.3735; 20.8167; 8.5037 90; 117.93; 90 | 1309.61 | Corner, Sophie C.; Blackmore, William J. A.; Gransbury, Gemma K.; Mattioni, Andrea; Whitehead, George F. S.; Chilton, Nicholas F.; Mills, David P. A fluorobenzene-bound dysprosium half-sandwich dication single-molecule magnet. Chemical science, 2025, 16, 610-620 |
| 1573412 | CIF | C40 H92 B8 Y4 | P 1 21/c 1 | 16.9654; 21.7125; 14.5559 90; 90.735; 90 | 5361.39 | Corner, Sophie C.; Blackmore, William J. A.; Gransbury, Gemma K.; Mattioni, Andrea; Whitehead, George F. S.; Chilton, Nicholas F.; Mills, David P. A fluorobenzene-bound dysprosium half-sandwich dication single-molecule magnet. Chemical science, 2025, 16, 610-620 |
| 1573413 | CIF | C60 H54 Al2 F57 O6 Si3 Y | P -1 | 16.6426; 16.7663; 18.4889 105.461; 104.692; 113.53 | 4163.3 | Corner, Sophie C.; Blackmore, William J. A.; Gransbury, Gemma K.; Mattioni, Andrea; Whitehead, George F. S.; Chilton, Nicholas F.; Mills, David P. A fluorobenzene-bound dysprosium half-sandwich dication single-molecule magnet. Chemical science, 2025, 16, 610-620 |
| 1573414 | CIF | C206 H123 Al8 Dy2 F233 O24 | P 1 21/n 1 | 18.2139; 19.314; 40.1803 90; 94.849; 90 | 14084.2 | Corner, Sophie C.; Blackmore, William J. A.; Gransbury, Gemma K.; Mattioni, Andrea; Whitehead, George F. S.; Chilton, Nicholas F.; Mills, David P. A fluorobenzene-bound dysprosium half-sandwich dication single-molecule magnet. Chemical science, 2025, 16, 610-620 |
| 1573415 | CIF | C14 H16 N4 O4 W | C 1 2/c 1 | 8.6484; 14.2399; 13.3208 90; 97.498; 90 | 1626.5 | Jankins, Tanner C.; Rubel, Camille Z.; Ho, Hang Chi; Martin-Montero, Raul; Engle, Keary M. Tungsten-catalyzed stereodivergent isomerization of terminal olefins. Chemical science, 2025, 16, 2307-2315 |
| 1573416 | CIF | C38 H46 N2 O12 W2 | P -1 | 8.9455; 10.6935; 12.0535 66.56; 71.07; 71.049 | 974.88 | Jankins, Tanner C.; Rubel, Camille Z.; Ho, Hang Chi; Martin-Montero, Raul; Engle, Keary M. Tungsten-catalyzed stereodivergent isomerization of terminal olefins. Chemical science, 2025, 16, 2307-2315 |
| 1573430 | CIF | C51 H43 N3 | P 1 21/n 1 | 12.0996; 10.9016; 29.2496 90; 96.378; 90 | 3834.3 | Liu, Le; Song, Shuangji; Lee, Jiyeon; Rao, Yutao; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Oh, Juwon; Kim, Jiwon; Osuka, Atsuhiro; Song, Jianxin Sub-<i>m</i>-benziporphyrin: a subcarbaporphyrinoid and its B<sup>III</sup> complex with an unprecedented planar tridentate 14π-aromatic network. Chemical science, 2025, 16, 1155-1160 |
| 1573431 | CIF | C49 H39 B N2 O2 | P 1 21/c 1 | 13.211; 20.856; 15.732 90; 114.86; 90 | 3933 | Liu, Le; Song, Shuangji; Lee, Jiyeon; Rao, Yutao; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Oh, Juwon; Kim, Jiwon; Osuka, Atsuhiro; Song, Jianxin Sub-<i>m</i>-benziporphyrin: a subcarbaporphyrinoid and its B<sup>III</sup> complex with an unprecedented planar tridentate 14π-aromatic network. Chemical science, 2025, 16, 1155-1160 |
| 1573432 | CIF | C55 H43 B N2 | P -1 | 12.2357; 13.4613; 14.9649 78.284; 77.397; 76.902 | 2312.08 | Liu, Le; Song, Shuangji; Lee, Jiyeon; Rao, Yutao; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Oh, Juwon; Kim, Jiwon; Osuka, Atsuhiro; Song, Jianxin Sub-<i>m</i>-benziporphyrin: a subcarbaporphyrinoid and its B<sup>III</sup> complex with an unprecedented planar tridentate 14π-aromatic network. Chemical science, 2025, 16, 1155-1160 |
| 1573433 | CIF | C50 H41 B N2 O2 | P -1 | 14.4553; 15.13; 21.027 92.22; 94.235; 98.658 | 4528.2 | Liu, Le; Song, Shuangji; Lee, Jiyeon; Rao, Yutao; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Oh, Juwon; Kim, Jiwon; Osuka, Atsuhiro; Song, Jianxin Sub-<i>m</i>-benziporphyrin: a subcarbaporphyrinoid and its B<sup>III</sup> complex with an unprecedented planar tridentate 14π-aromatic network. Chemical science, 2025, 16, 1155-1160 |
| 1573434 | CIF | C49 H39 B N2 O | P -1 | 11.919; 12.5825; 14.8081 104.186; 110.328; 96.071 | 1974 | Liu, Le; Song, Shuangji; Lee, Jiyeon; Rao, Yutao; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Oh, Juwon; Kim, Jiwon; Osuka, Atsuhiro; Song, Jianxin Sub-<i>m</i>-benziporphyrin: a subcarbaporphyrinoid and its B<sup>III</sup> complex with an unprecedented planar tridentate 14π-aromatic network. Chemical science, 2025, 16, 1155-1160 |
| 1573435 | CIF | C49 H39 B N2 | P -1 | 11.6677; 12.7694; 14.5328 103.399; 109.908; 94.935 | 1948 | Liu, Le; Song, Shuangji; Lee, Jiyeon; Rao, Yutao; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Oh, Juwon; Kim, Jiwon; Osuka, Atsuhiro; Song, Jianxin Sub-<i>m</i>-benziporphyrin: a subcarbaporphyrinoid and its B<sup>III</sup> complex with an unprecedented planar tridentate 14π-aromatic network. Chemical science, 2025, 16, 1155-1160 |
| 1573437 | CIF | C126 H170 Mo12 N26 O74 | P 1 21/n 1 | 23.4316; 20.2535; 24.6419 90; 104.086; 90 | 11342.7 | Yadav, Ankit K.; Gładysiak, Andrzej; Wolpert, Emma H.; Ganose, Alex M.; Samel-Garloff, Bronson; Koley, Dipankar; Jelfs, Kim E.; Stylianou, Kyriakos C. Solvatomorphic diversity dictates the stability and solubility of metal-organic polyhedra. Chemical science, 2025, 16, 2589-2599 |
| 1573438 | CIF | C108 H108 Mo12 N18 O72 | P 6/m | 20.6212; 20.6212; 15.9529 90; 90; 120 | 5874.87 | Yadav, Ankit K.; Gładysiak, Andrzej; Wolpert, Emma H.; Ganose, Alex M.; Samel-Garloff, Bronson; Koley, Dipankar; Jelfs, Kim E.; Stylianou, Kyriakos C. Solvatomorphic diversity dictates the stability and solubility of metal-organic polyhedra. Chemical science, 2025, 16, 2589-2599 |
| 1573439 | CIF | C120 H132 Mo12 N18 O72 | P -1 | 18.9295; 20.8274; 31.777 84.01; 86.075; 80.923 | 12286.5 | Yadav, Ankit K.; Gładysiak, Andrzej; Wolpert, Emma H.; Ganose, Alex M.; Samel-Garloff, Bronson; Koley, Dipankar; Jelfs, Kim E.; Stylianou, Kyriakos C. Solvatomorphic diversity dictates the stability and solubility of metal-organic polyhedra. Chemical science, 2025, 16, 2589-2599 |
| 1573440 | CIF | C144 H204 Mo12 N24 O72 | P 1 21/n 1 | 23.4926; 21.0361; 24.7119 90; 103.643; 90 | 11867.9 | Yadav, Ankit K.; Gładysiak, Andrzej; Wolpert, Emma H.; Ganose, Alex M.; Samel-Garloff, Bronson; Koley, Dipankar; Jelfs, Kim E.; Stylianou, Kyriakos C. Solvatomorphic diversity dictates the stability and solubility of metal-organic polyhedra. Chemical science, 2025, 16, 2589-2599 |
| 1573441 | CIF | C112 H122 Mo12 N20 O72 | C m c e | 37.4589; 29.3487; 20.1896 90; 90; 90 | 22195.8 | Yadav, Ankit K.; Gładysiak, Andrzej; Wolpert, Emma H.; Ganose, Alex M.; Samel-Garloff, Bronson; Koley, Dipankar; Jelfs, Kim E.; Stylianou, Kyriakos C. Solvatomorphic diversity dictates the stability and solubility of metal-organic polyhedra. Chemical science, 2025, 16, 2589-2599 |
| 1573442 | CIF | C54.83 H67.65 Cl1.65 N6 O2 | P -1 | 8.0413; 14.3206; 21.6156 78.691; 88.151; 87.222 | 2437.3 | Szymański, Bartosz; Sahoo, Smruti Ranjan; Vakuliuk, Olena; Valiev, Rashid; Ramazanov, Ruslan; Łaski, Piotr; Jarzembska, Katarzyna N.; Kamiński, Radosław; Teimouri, Mohammad B.; Baryshnikov, Glib; Gryko, Daniel T. Shedding new light on quadrupolar 1,4-dihydropyrrolo[3,2-<i>b</i>]pyrroles: impact of electron-deficient scaffolds over emission. Chemical science, 2025, 16, 2170-2179 |
| 1573443 | CIF | C54 H66 N6 S2 | P -1 | 6.81179; 8.26449; 20.8251 92.8453; 96.3218; 95.0155 | 1158.7 | Szymański, Bartosz; Sahoo, Smruti Ranjan; Vakuliuk, Olena; Valiev, Rashid; Ramazanov, Ruslan; Łaski, Piotr; Jarzembska, Katarzyna N.; Kamiński, Radosław; Teimouri, Mohammad B.; Baryshnikov, Glib; Gryko, Daniel T. Shedding new light on quadrupolar 1,4-dihydropyrrolo[3,2-<i>b</i>]pyrroles: impact of electron-deficient scaffolds over emission. Chemical science, 2025, 16, 2170-2179 |
| 1573444 | CIF | C54 H64 N8 O6 | C 1 2/c 1 | 47.3727; 10.9462; 9.5717 90; 90.519; 90 | 4963.2 | Szymański, Bartosz; Sahoo, Smruti Ranjan; Vakuliuk, Olena; Valiev, Rashid; Ramazanov, Ruslan; Łaski, Piotr; Jarzembska, Katarzyna N.; Kamiński, Radosław; Teimouri, Mohammad B.; Baryshnikov, Glib; Gryko, Daniel T. Shedding new light on quadrupolar 1,4-dihydropyrrolo[3,2-<i>b</i>]pyrroles: impact of electron-deficient scaffolds over emission. Chemical science, 2025, 16, 2170-2179 |
| 1573445 | CIF | C32 H22 N6 S2 | P 1 21/c 1 | 6.73075; 13.0685; 14.6429 90; 91.099; 90 | 1287.76 | Szymański, Bartosz; Sahoo, Smruti Ranjan; Vakuliuk, Olena; Valiev, Rashid; Ramazanov, Ruslan; Łaski, Piotr; Jarzembska, Katarzyna N.; Kamiński, Radosław; Teimouri, Mohammad B.; Baryshnikov, Glib; Gryko, Daniel T. Shedding new light on quadrupolar 1,4-dihydropyrrolo[3,2-<i>b</i>]pyrroles: impact of electron-deficient scaffolds over emission. Chemical science, 2025, 16, 2170-2179 |
| 1573446 | CIF | C32 H22 N6 O2 | C 1 2/c 1 | 23.4345; 7.9786; 13.6019 90; 105.599; 90 | 2449.54 | Szymański, Bartosz; Sahoo, Smruti Ranjan; Vakuliuk, Olena; Valiev, Rashid; Ramazanov, Ruslan; Łaski, Piotr; Jarzembska, Katarzyna N.; Kamiński, Radosław; Teimouri, Mohammad B.; Baryshnikov, Glib; Gryko, Daniel T. Shedding new light on quadrupolar 1,4-dihydropyrrolo[3,2-<i>b</i>]pyrroles: impact of electron-deficient scaffolds over emission. Chemical science, 2025, 16, 2170-2179 |
| 1573447 | CIF | C54 H66 N6 S2 | P 1 21/c 1 | 26.3539; 5.7949; 16.2792 90; 106.857; 90 | 2379.3 | Szymański, Bartosz; Sahoo, Smruti Ranjan; Vakuliuk, Olena; Valiev, Rashid; Ramazanov, Ruslan; Łaski, Piotr; Jarzembska, Katarzyna N.; Kamiński, Radosław; Teimouri, Mohammad B.; Baryshnikov, Glib; Gryko, Daniel T. Shedding new light on quadrupolar 1,4-dihydropyrrolo[3,2-<i>b</i>]pyrroles: impact of electron-deficient scaffolds over emission. Chemical science, 2025, 16, 2170-2179 |
| 1573448 | CIF | C46 H50 N6 O4 | P 1 21/n 1 | 12.653; 17.7756; 18.8818 90; 102.848; 90 | 4140.47 | Szymański, Bartosz; Sahoo, Smruti Ranjan; Vakuliuk, Olena; Valiev, Rashid; Ramazanov, Ruslan; Łaski, Piotr; Jarzembska, Katarzyna N.; Kamiński, Radosław; Teimouri, Mohammad B.; Baryshnikov, Glib; Gryko, Daniel T. Shedding new light on quadrupolar 1,4-dihydropyrrolo[3,2-<i>b</i>]pyrroles: impact of electron-deficient scaffolds over emission. Chemical science, 2025, 16, 2170-2179 |
| 1573449 | CIF | C60 H59 N24 O29.5 Zn9 | R -3 c :H | 15.31573; 15.31573; 56.9773 90; 90; 120 | 11574.7 | Tao, Ye; Dong, Qiubing; Wan, Jingmeng; Huang, Fu-Ping; Duan, Jingui; Zeng, Ming-Hua Evolution from [Zn<sub>9</sub>] to a record-high [Zn<sub>54</sub>] subblock and engineering a hierarchical supramolecular framework for enhanced iodine uptake. Chemical science, 2025, 16, 1730-1736 |
| 1573450 | CIF | C348 H288 I56.6 N156 O118.8 Zn54 | F d -3 :2 | 58.9792; 58.9792; 58.9792 90; 90; 90 | 205162 | Tao, Ye; Dong, Qiubing; Wan, Jingmeng; Huang, Fu-Ping; Duan, Jingui; Zeng, Ming-Hua Evolution from [Zn<sub>9</sub>] to a record-high [Zn<sub>54</sub>] subblock and engineering a hierarchical supramolecular framework for enhanced iodine uptake. Chemical science, 2025, 16, 1730-1736 |
| 1573451 | CIF | C523.2 H705.2 N195.61 O170 Zn54 | F d -3 :2 | 58.3017; 58.3017; 58.3017 90; 90; 90 | 198173 | Tao, Ye; Dong, Qiubing; Wan, Jingmeng; Huang, Fu-Ping; Duan, Jingui; Zeng, Ming-Hua Evolution from [Zn<sub>9</sub>] to a record-high [Zn<sub>54</sub>] subblock and engineering a hierarchical supramolecular framework for enhanced iodine uptake. Chemical science, 2025, 16, 1730-1736 |
| 1573455 | CIF | C34 H22 Br2 F2 N4 O2 | C 1 2/c 1 | 13.8725; 29.1188; 9.362 90; 127.298; 90 | 3008.4 | Qi, Liang-Wen; Twumasi, Emmanuella Bema; Li, Xiao-Wei; Li, Rui; Lu, Yixin Reductive coupling of azonaphthalenes for the synthesis of BINAMs <i>via</i> a diboron-enabled [5,5]-sigmatropic rearrangement. Chemical science, 2025, 16, 1441-1446 |
| 1573456 | CIF | C28 H19 N O S | P 1 21/c 1 | 20.812; 7.486; 13.413 90; 105.313; 90 | 2015.5 | Sharangi, Sanhati; Chakraborty, Barsha; Jha, Raushan Kumar; Mandal, Swarnadeep; Koner, Apurba Lal; Kumar, Sangit Regio- and diastereoselective synthesis of cyclobutylated phenothiazines <i>via</i> [2 + 2] photocycloaddition: demonstrating wavelength-gated cycloreversion inside live cells. Chemical science, 2025, 16, 709-720 |
| 1573457 | CIF | C25 N O S | P 1 21/c 1 | 23.545; 7.4959; 24.005 90; 117.294; 90 | 3765 | Sharangi, Sanhati; Chakraborty, Barsha; Jha, Raushan Kumar; Mandal, Swarnadeep; Koner, Apurba Lal; Kumar, Sangit Regio- and diastereoselective synthesis of cyclobutylated phenothiazines <i>via</i> [2 + 2] photocycloaddition: demonstrating wavelength-gated cycloreversion inside live cells. Chemical science, 2025, 16, 709-720 |
| 1573458 | CIF | C24 H17 N O S | P 1 21/n 1 | 11.7018; 13.6726; 21.985 90; 91.133; 90 | 3516.8 | Sharangi, Sanhati; Chakraborty, Barsha; Jha, Raushan Kumar; Mandal, Swarnadeep; Koner, Apurba Lal; Kumar, Sangit Regio- and diastereoselective synthesis of cyclobutylated phenothiazines <i>via</i> [2 + 2] photocycloaddition: demonstrating wavelength-gated cycloreversion inside live cells. Chemical science, 2025, 16, 709-720 |
| 1573459 | CIF | C25 H19 N O S | P 1 21/n 1 | 8.381; 20.496; 11.336 90; 105.075; 90 | 1880.3 | Sharangi, Sanhati; Chakraborty, Barsha; Jha, Raushan Kumar; Mandal, Swarnadeep; Koner, Apurba Lal; Kumar, Sangit Regio- and diastereoselective synthesis of cyclobutylated phenothiazines <i>via</i> [2 + 2] photocycloaddition: demonstrating wavelength-gated cycloreversion inside live cells. Chemical science, 2025, 16, 709-720 |
| 1573460 | CIF | C24 H19 N O S | R -3 :H | 32.1279; 32.1279; 9.3505 90; 90; 120 | 8358.5 | Sharangi, Sanhati; Chakraborty, Barsha; Jha, Raushan Kumar; Mandal, Swarnadeep; Koner, Apurba Lal; Kumar, Sangit Regio- and diastereoselective synthesis of cyclobutylated phenothiazines <i>via</i> [2 + 2] photocycloaddition: demonstrating wavelength-gated cycloreversion inside live cells. Chemical science, 2025, 16, 709-720 |
| 1573461 | CIF | C30 H21 N O S | P 1 21 1 | 5.9514; 16.6; 22.163 90; 90.368; 90 | 2189.5 | Sharangi, Sanhati; Chakraborty, Barsha; Jha, Raushan Kumar; Mandal, Swarnadeep; Koner, Apurba Lal; Kumar, Sangit Regio- and diastereoselective synthesis of cyclobutylated phenothiazines <i>via</i> [2 + 2] photocycloaddition: demonstrating wavelength-gated cycloreversion inside live cells. Chemical science, 2025, 16, 709-720 |
| 1573462 | CIF | C26 H19 N O S | P 1 21/n 1 | 12.2581; 25.0852; 12.7705 90; 95.524; 90 | 3908.7 | Sharangi, Sanhati; Chakraborty, Barsha; Jha, Raushan Kumar; Mandal, Swarnadeep; Koner, Apurba Lal; Kumar, Sangit Regio- and diastereoselective synthesis of cyclobutylated phenothiazines <i>via</i> [2 + 2] photocycloaddition: demonstrating wavelength-gated cycloreversion inside live cells. Chemical science, 2025, 16, 709-720 |
| 1573463 | CIF | C24 H17 N O2 S | P 21 21 21 | 7.3105; 9.5818; 26.479 90; 90; 90 | 1854.8 | Sharangi, Sanhati; Chakraborty, Barsha; Jha, Raushan Kumar; Mandal, Swarnadeep; Koner, Apurba Lal; Kumar, Sangit Regio- and diastereoselective synthesis of cyclobutylated phenothiazines <i>via</i> [2 + 2] photocycloaddition: demonstrating wavelength-gated cycloreversion inside live cells. Chemical science, 2025, 16, 709-720 |
| 1573464 | CIF | C26 H25 F O6 | P -1 | 7.2891; 9.7884; 15.6447 88.064; 84.589; 80.174 | 1094.77 | Zhang, Kuan; Gao, Zhengyang; Xia, Yan; Li, Pengfei; Gao, Pin; Duan, Xin-Hua; Guo, Li-Na Synthesis of fluorine-containing bicyclo[4.1.1]octenes <i>via</i> photocatalyzed defluorinative (4 + 3) annulation of bicyclo[1.1.0]butanes with <i>gem</i>-difluoroalkenes. Chemical science, 2025, 16, 1411-1416 |
| 1573465 | CIF | C22 H19 F O2 | P n a 21 | 11.4103; 16.6264; 9.2337 90; 90; 90 | 1751.75 | Zhang, Kuan; Gao, Zhengyang; Xia, Yan; Li, Pengfei; Gao, Pin; Duan, Xin-Hua; Guo, Li-Na Synthesis of fluorine-containing bicyclo[4.1.1]octenes <i>via</i> photocatalyzed defluorinative (4 + 3) annulation of bicyclo[1.1.0]butanes with <i>gem</i>-difluoroalkenes. Chemical science, 2025, 16, 1411-1416 |
| 1573466 | CIF | C27 H22 F3 Fe N O2 S | P 21 21 21 | 9.5134; 9.874; 24.656 90; 90; 90 | 2316.1 | Parganiha, Devendra; Thorat, Raviraj Ananda; Dhumale, Ashwini Dilip; Upadhyay, Yagya Dutt; Jha, Raushan Kumar; Raju, Saravanan; Kumar, Sangit Substrate NOBINAc ligand affinity for Pd<sup>II</sup>-catalyzed enantioselective C-H activation over reactive β-C-H bonds in ferrocenyl amines. Chemical science, 2025, 16, 700-708 |
| 1573467 | CIF | C22 H20 F3 Fe N O2 S | P -1 | 9.65; 10.5668; 11.6109 89.893; 69.144; 67.203 | 1007.15 | Parganiha, Devendra; Thorat, Raviraj Ananda; Dhumale, Ashwini Dilip; Upadhyay, Yagya Dutt; Jha, Raushan Kumar; Raju, Saravanan; Kumar, Sangit Substrate NOBINAc ligand affinity for Pd<sup>II</sup>-catalyzed enantioselective C-H activation over reactive β-C-H bonds in ferrocenyl amines. Chemical science, 2025, 16, 700-708 |
| 1573468 | CIF | C27 H22 F3 Fe N O2 S | P 21 21 21 | 9.5665; 9.829; 25.415 90; 90; 90 | 2389.8 | Parganiha, Devendra; Thorat, Raviraj Ananda; Dhumale, Ashwini Dilip; Upadhyay, Yagya Dutt; Jha, Raushan Kumar; Raju, Saravanan; Kumar, Sangit Substrate NOBINAc ligand affinity for Pd<sup>II</sup>-catalyzed enantioselective C-H activation over reactive β-C-H bonds in ferrocenyl amines. Chemical science, 2025, 16, 700-708 |
| 1573541 | CIF | C22 H28 Na4 O10 P2 | P 1 21/c 1 | 12.6672; 6.1624; 18.016 90; 106.967; 90 | 1345.1 | Zhang, Yan; Apostol, Petru; Rambabu, Darsi; Guo, Xiaolong; Liu, Xuelian; Lin, Xiaodong; Xie, Haijiao; Chen, Xiaohua; Robeyns, Koen; Wang, Jiande; Wang, Junzhong; Vlad, Alexandru Ionically conducting Li- and Na-phosphonates as organic electrode materials for rechargeable batteries. Chemical science, 2025, 16, 1819-1825 |
| 1573542 | CIF | C86 H44 N2 | I 1 2/a 1 | 15.8224; 21.9763; 28.7119 90; 93.501; 90 | 9965 | Nakamura, Tomoya; Nagai, Takabumi; Miyake, Yuki; Yamada, Takumi; Miura, Makoto; Yoshida, Hiroyuki; Kanemitsu, Yoshihiko; Truong, Minh Anh; Murdey, Richard; Wakamiya, Atsushi Single-isomer bis(pyrrolidino)fullerenes as electron-transporting materials for tin halide perovskite solar cells. Chemical science, 2025, 16, 2265-2272 |
| 1573543 | CIF | C27 H20 F2 O3 | P -1 | 9.86943; 17.5275; 26.1199 95.7908; 99.8803; 106.339 | 4218.1 | Li, Na; Li, Chenghui; Zhou, Qianying; Zhang, Xin; Deng, Zhouming; Jiang, Zhong-Xing; Yang, Zhigang General access to furan-substituted <i>gem</i>-difluoroalkenes enabled by PFTB-promoted cross-coupling of ene-yne-ketones and difluorocarbene. Chemical science, 2025, 16, 1455-1464 |
| 1573545 | CIF | C26 H21 B N4 O | P 1 21/n 1 | 9.804; 16.35; 13.564 90; 108.989; 90 | 2056 | Watson, Alexander E. R.; Boyle, Paul D.; Ragogna, Paul J.; Gilroy, Joe B. Ligand protonation leads to highly fluorescent boronium cations. Chemical science, 2025, 16, 2258-2264 |
| 1573546 | CIF | C34 H32 B Cl3 N4 O | P 21 21 21 | 9.673; 16.008; 20.119 90; 90; 90 | 3115 | Watson, Alexander E. R.; Boyle, Paul D.; Ragogna, Paul J.; Gilroy, Joe B. Ligand protonation leads to highly fluorescent boronium cations. Chemical science, 2025, 16, 2258-2264 |
| 1573547 | CIF | B2 Ba Ca Cs F O5 | P -4 21 m | 8.8668; 8.8668; 8.7669 90; 90; 90 | 689.25 | Chen, Fuqiang; Wu, Hongping; Hu, Zhanggui; Wang, Jiyang; Wu, Yicheng; Yu, Hongwei Rational design of a series of non-centrosymmetric antiperovskite and double antiperovskite borate fluorides. Chemical science, 2025, 16, 2015-2023 |
| 1573548 | CIF | B2 Ba Ca F O5 Rb | P -4 21 m | 8.7713; 8.7713; 4.3173 90; 90; 90 | 332.15 | Chen, Fuqiang; Wu, Hongping; Hu, Zhanggui; Wang, Jiyang; Wu, Yicheng; Yu, Hongwei Rational design of a series of non-centrosymmetric antiperovskite and double antiperovskite borate fluorides. Chemical science, 2025, 16, 2015-2023 |
| 1573549 | CIF | B2 Ba Ca F K O5 | P -4 21 m | 8.7276; 8.7276; 4.284 90; 90; 90 | 326.32 | Chen, Fuqiang; Wu, Hongping; Hu, Zhanggui; Wang, Jiyang; Wu, Yicheng; Yu, Hongwei Rational design of a series of non-centrosymmetric antiperovskite and double antiperovskite borate fluorides. Chemical science, 2025, 16, 2015-2023 |
| 1573550 | CIF | C38 H32 N4 O2 | P -1 | 7.2089; 9.3281; 11.0857 97.148; 92.22; 96.254 | 734.23 | Mandal, Debasish; Sarkar, Abani; Behera, Kanhu Charan; Ravikanth, Mangalampalli pH-responsive supramolecular switch of a rationally designed dipyrroethene-based chromophore. Chemical science, 2025, 16, 1772-1782 |
| 1573551 | CIF | C42 H34 F6 N4 O6 | C 1 2/c 1 | 13.3398; 12.3038; 25.4069 90; 97.608; 90 | 4133.3 | Mandal, Debasish; Sarkar, Abani; Behera, Kanhu Charan; Ravikanth, Mangalampalli pH-responsive supramolecular switch of a rationally designed dipyrroethene-based chromophore. Chemical science, 2025, 16, 1772-1782 |
| 1573552 | CIF | C19 H17 N3 | P -1 | 9.295; 9.499; 10.348 79.673; 65.183; 63.713 | 743.5 | Mandal, Debasish; Sarkar, Abani; Behera, Kanhu Charan; Ravikanth, Mangalampalli pH-responsive supramolecular switch of a rationally designed dipyrroethene-based chromophore. Chemical science, 2025, 16, 1772-1782 |
| 1573553 | CIF | C64 H92 N4 Tb2 | P n a 21 | 30.8903; 10.27991; 18.11204 90; 90; 90 | 5751.47 | Jin, Peng-Bo; Luo, Qian-Cheng; Gransbury, Gemma K.; Winpenny, Richard E. P.; Mills, David P.; Zheng, Yan-Zhen Rare earth benzene tetraanion-bridged amidinate complexes. Chemical science, 2025, 16, 1907-1924 |
| 1573554 | CIF | C10.09 H14.96 Cl0.17 Dy0.17 N0.7 | C 1 2/c 1 | 23.9612; 10.5893; 22.5423 90; 112.235; 90 | 5294.4 | Jin, Peng-Bo; Luo, Qian-Cheng; Gransbury, Gemma K.; Winpenny, Richard E. P.; Mills, David P.; Zheng, Yan-Zhen Rare earth benzene tetraanion-bridged amidinate complexes. Chemical science, 2025, 16, 1907-1924 |
| 1573555 | CIF | C65 H94 I N4 Y | I 1 2/a 1 | 25.2282; 10.9625; 23.8393 90; 116.041; 90 | 5923.8 | Jin, Peng-Bo; Luo, Qian-Cheng; Gransbury, Gemma K.; Winpenny, Richard E. P.; Mills, David P.; Zheng, Yan-Zhen Rare earth benzene tetraanion-bridged amidinate complexes. Chemical science, 2025, 16, 1907-1924 |
| 1573556 | CIF | C58 H86 Cl N4 Tb | C 1 2/c 1 | 23.9599; 10.5837; 22.4979 90; 112.183; 90 | 5282.8 | Jin, Peng-Bo; Luo, Qian-Cheng; Gransbury, Gemma K.; Winpenny, Richard E. P.; Mills, David P.; Zheng, Yan-Zhen Rare earth benzene tetraanion-bridged amidinate complexes. Chemical science, 2025, 16, 1907-1924 |
| 1573557 | CIF | C67 H99 Dy2 N4 | P 1 21/c 1 | 10.8382; 38.9439; 15.0078 90; 105.063; 90 | 6116.87 | Jin, Peng-Bo; Luo, Qian-Cheng; Gransbury, Gemma K.; Winpenny, Richard E. P.; Mills, David P.; Zheng, Yan-Zhen Rare earth benzene tetraanion-bridged amidinate complexes. Chemical science, 2025, 16, 1907-1924 |
| 1573558 | CIF | C67 H99 N4 Y2 | P 1 21/c 1 | 10.8398; 38.9679; 15.0051 90; 105.029; 90 | 6121.42 | Jin, Peng-Bo; Luo, Qian-Cheng; Gransbury, Gemma K.; Winpenny, Richard E. P.; Mills, David P.; Zheng, Yan-Zhen Rare earth benzene tetraanion-bridged amidinate complexes. Chemical science, 2025, 16, 1907-1924 |
| 1573559 | CIF | C75 H120 N4 Tb2 | P -1 | 14.4004; 15.4059; 18.05 97.598; 103.094; 112.008 | 3510.01 | Jin, Peng-Bo; Luo, Qian-Cheng; Gransbury, Gemma K.; Winpenny, Richard E. P.; Mills, David P.; Zheng, Yan-Zhen Rare earth benzene tetraanion-bridged amidinate complexes. Chemical science, 2025, 16, 1907-1924 |
| 1573560 | CIF | C65 H94 Gd I N4 | C 1 2/c 1 | 26.171; 11.0443; 23.94 90; 119.762; 90 | 6006.9 | Jin, Peng-Bo; Luo, Qian-Cheng; Gransbury, Gemma K.; Winpenny, Richard E. P.; Mills, David P.; Zheng, Yan-Zhen Rare earth benzene tetraanion-bridged amidinate complexes. Chemical science, 2025, 16, 1907-1924 |
| 1573561 | CIF | C64 H92 Gd2 N4 | P b c a | 18.1193; 35.666; 36.498 90; 90; 90 | 23587 | Jin, Peng-Bo; Luo, Qian-Cheng; Gransbury, Gemma K.; Winpenny, Richard E. P.; Mills, David P.; Zheng, Yan-Zhen Rare earth benzene tetraanion-bridged amidinate complexes. Chemical science, 2025, 16, 1907-1924 |
| 1573562 | CIF | C27 H36 B N3 O | P 1 21/c 1 | 12.67284; 9.17962; 22.43254 90; 96.7556; 90 | 2591.5 | Tang, Jianqin; Hu, Chenyang; Crumpton, Agamemnon E.; Griffin, Liam P.; Goicoechea, Jose M.; Aldridge, Simon Metathesis chemistry of inorganic cumulenes driven by B-O bond formation. Chemical science, 2025, 16, 2231-2237 |
| 1573563 | CIF | C53 H74 B N5 P2 | P 1 21/c 1 | 12.8968; 19.8442; 40.8371 90; 96.999; 90 | 10373.4 | Tang, Jianqin; Hu, Chenyang; Crumpton, Agamemnon E.; Griffin, Liam P.; Goicoechea, Jose M.; Aldridge, Simon Metathesis chemistry of inorganic cumulenes driven by B-O bond formation. Chemical science, 2025, 16, 2231-2237 |
| 1573564 | CIF | C45 H52.4 B2 K N3 O2 | I -4 | 22.7178; 22.7178; 15.9414 90; 90; 90 | 8227.3 | Tang, Jianqin; Hu, Chenyang; Crumpton, Agamemnon E.; Griffin, Liam P.; Goicoechea, Jose M.; Aldridge, Simon Metathesis chemistry of inorganic cumulenes driven by B-O bond formation. Chemical science, 2025, 16, 2231-2237 |
| 1573565 | CIF | C33 H42 B N3 | P 1 21/n 1 | 9.7098; 16.9985; 17.7195 90; 93.843; 90 | 2918.06 | Tang, Jianqin; Hu, Chenyang; Crumpton, Agamemnon E.; Griffin, Liam P.; Goicoechea, Jose M.; Aldridge, Simon Metathesis chemistry of inorganic cumulenes driven by B-O bond formation. Chemical science, 2025, 16, 2231-2237 |
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