Crystallography Open Database
Search results
Result: there are 1914 entries in the selection
Switch to the old layout of the pageDownload all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)
Searching journal of publication like 'Chemical Science' volume of publication is 16
COD ID ![]() |
Links | Formula ![]() |
Space group ![]() |
Cell parameters | Cell volume ![]() |
Bibliography |
|---|---|---|---|---|---|---|
| 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 |
| 1573566 | CIF | C60 H81 B3 N6 O | C 1 2/c 1 | 22.2498; 13.5031; 37.4373 90; 99.081; 90 | 11106.7 | 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 |
| 1573567 | CIF | C27 H36 B N3 S | I 1 2/a 1 | 16.90996; 9.55705; 33.35081 90; 94.9584; 90 | 5369.63 | 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 |
| 1573570 | CIF | C31 H29 F2 O4 P | P -1 | 9.6234; 10.4927; 14.0802 99.31; 98.054; 100.619 | 1357.67 | Huang, Mao-Gui; Fu, Yue-Liu-Ting; Li, Jia-Wei; Liu, Yue-Jin Ruthenium-catalyzed three-component tandem remote C-H functionalization of naphthalenes: modular and concise synthesis of multifunctional naphthalenes. Chemical science, 2025, 16, 1957-1965 |
| 1573571 | CIF | C42 H40 Br4 N12 Ni2 O6 | P 1 21/c 1 | 14.4927; 9.522; 24.7089 90; 137.895; 90 | 2286.3 | Rodriguez-Lugo, Rafael E; Sander, Joan; Dietzmann, Simon; Rittner, Thomas; Rückel, Jannes; Landaeta, Vanessa R.; Park, Jiyong; Nuernberger, Patrick; Baik, Mu-Hyun; Wolf, Robert Mechanistic insights into the visible-light-driven <i>O</i>-arylation of carboxylic acids catalyzed by xanthine-based nickel complexes. Chemical science, 2025, 16, 2751-2762 |
| 1573572 | CIF | C40 H38 Br4 Cl4 N12 Ni2 O4 | P 1 21/c 1 | 13.4368; 9.1144; 20.483 90; 108.664; 90 | 2376.6 | Rodriguez-Lugo, Rafael E; Sander, Joan; Dietzmann, Simon; Rittner, Thomas; Rückel, Jannes; Landaeta, Vanessa R.; Park, Jiyong; Nuernberger, Patrick; Baik, Mu-Hyun; Wolf, Robert Mechanistic insights into the visible-light-driven <i>O</i>-arylation of carboxylic acids catalyzed by xanthine-based nickel complexes. Chemical science, 2025, 16, 2751-2762 |
| 1573573 | CIF | C20.57 H18.49 N6.86 O2.39 | I 1 2/a 1 | 13.0278; 14.7154; 34.4476 90; 99.152; 90 | 6519.86 | Rodriguez-Lugo, Rafael E; Sander, Joan; Dietzmann, Simon; Rittner, Thomas; Rückel, Jannes; Landaeta, Vanessa R.; Park, Jiyong; Nuernberger, Patrick; Baik, Mu-Hyun; Wolf, Robert Mechanistic insights into the visible-light-driven <i>O</i>-arylation of carboxylic acids catalyzed by xanthine-based nickel complexes. Chemical science, 2025, 16, 2751-2762 |
| 1573574 | CIF | C13.82 H12.36 Br0.73 N5.09 Ni0.36 O1.45 | P 1 21/c 1 | 17.1742; 13.6415; 17.8507 90; 103.715; 90 | 4062.85 | Rodriguez-Lugo, Rafael E; Sander, Joan; Dietzmann, Simon; Rittner, Thomas; Rückel, Jannes; Landaeta, Vanessa R.; Park, Jiyong; Nuernberger, Patrick; Baik, Mu-Hyun; Wolf, Robert Mechanistic insights into the visible-light-driven <i>O</i>-arylation of carboxylic acids catalyzed by xanthine-based nickel complexes. Chemical science, 2025, 16, 2751-2762 |
| 1573575 | CIF | C17 H14 N6 O2 | P -1 | 6.6161; 11.0537; 11.1219 84.188; 74.575; 88.159 | 780.03 | Rodriguez-Lugo, Rafael E; Sander, Joan; Dietzmann, Simon; Rittner, Thomas; Rückel, Jannes; Landaeta, Vanessa R.; Park, Jiyong; Nuernberger, Patrick; Baik, Mu-Hyun; Wolf, Robert Mechanistic insights into the visible-light-driven <i>O</i>-arylation of carboxylic acids catalyzed by xanthine-based nickel complexes. Chemical science, 2025, 16, 2751-2762 |
| 1573576 | CIF | C11.5 H12.5 N2.5 O2 | P 1 21/c 1 | 9.8012; 8.1826; 27.1202 90; 94.448; 90 | 2168.47 | Rodriguez-Lugo, Rafael E; Sander, Joan; Dietzmann, Simon; Rittner, Thomas; Rückel, Jannes; Landaeta, Vanessa R.; Park, Jiyong; Nuernberger, Patrick; Baik, Mu-Hyun; Wolf, Robert Mechanistic insights into the visible-light-driven <i>O</i>-arylation of carboxylic acids catalyzed by xanthine-based nickel complexes. Chemical science, 2025, 16, 2751-2762 |
| 1573577 | CIF | C39 H52 N5 Ni O4.5 | C 1 2/c 1 | 33.3183; 9.9346; 21.7721 90; 91.007; 90 | 7205.54 | Rodriguez-Lugo, Rafael E; Sander, Joan; Dietzmann, Simon; Rittner, Thomas; Rückel, Jannes; Landaeta, Vanessa R.; Park, Jiyong; Nuernberger, Patrick; Baik, Mu-Hyun; Wolf, Robert Mechanistic insights into the visible-light-driven <i>O</i>-arylation of carboxylic acids catalyzed by xanthine-based nickel complexes. Chemical science, 2025, 16, 2751-2762 |
| 1573578 | CIF | C37 H32 Br N5 Ni O3 P | P 1 21/n 1 | 19.3695; 17.6564; 19.5992 90; 93.297; 90 | 6691.75 | Rodriguez-Lugo, Rafael E; Sander, Joan; Dietzmann, Simon; Rittner, Thomas; Rückel, Jannes; Landaeta, Vanessa R.; Park, Jiyong; Nuernberger, Patrick; Baik, Mu-Hyun; Wolf, Robert Mechanistic insights into the visible-light-driven <i>O</i>-arylation of carboxylic acids catalyzed by xanthine-based nickel complexes. Chemical science, 2025, 16, 2751-2762 |
| 1573584 | CIF | C24 O13 Zn4 | F m -3 m | 25.415; 25.415; 25.415 90; 90; 90 | 16416.1 | Kim, Hyunyong; Cohen, Seth M. Metal-organic frameworks generated from oligomeric ligands with functionalized tethers. Chemical science, 2025, 16, 2344-2350 |
| 1573585 | CIF | C24 O13 Zn4 | P m -3 m | 12.8235; 12.8235; 12.8235 90; 90; 90 | 2108.7 | Kim, Hyunyong; Cohen, Seth M. Metal-organic frameworks generated from oligomeric ligands with functionalized tethers. Chemical science, 2025, 16, 2344-2350 |
| 1573586 | CIF | C96 O64 Zn16 | F m -3 m | 25.6171; 25.6171; 25.6171 90; 90; 90 | 16810.9 | Kim, Hyunyong; Cohen, Seth M. Metal-organic frameworks generated from oligomeric ligands with functionalized tethers. Chemical science, 2025, 16, 2344-2350 |
| 1573587 | CIF | C96 O64 Zn16 | F m -3 m | 25.6455; 25.6455; 25.6455 90; 90; 90 | 16866.8 | Kim, Hyunyong; Cohen, Seth M. Metal-organic frameworks generated from oligomeric ligands with functionalized tethers. Chemical science, 2025, 16, 2344-2350 |
| 1573588 | CIF | C96 O64 Zn16 | F m -3 m | 25.6396; 25.6396; 25.6396 90; 90; 90 | 16855.2 | Kim, Hyunyong; Cohen, Seth M. Metal-organic frameworks generated from oligomeric ligands with functionalized tethers. Chemical science, 2025, 16, 2344-2350 |
| 1573589 | CIF | C96 O64 Zn16 | F m -3 m | 25.6309; 25.6309; 25.6309 90; 90; 90 | 16838 | Kim, Hyunyong; Cohen, Seth M. Metal-organic frameworks generated from oligomeric ligands with functionalized tethers. Chemical science, 2025, 16, 2344-2350 |
| 1573590 | CIF | C14 N O5 Zn | C 1 2/c 1 | 13.6279; 16.9199; 19.7799 90; 91.635; 90 | 4559 | Kim, Hyunyong; Cohen, Seth M. Metal-organic frameworks generated from oligomeric ligands with functionalized tethers. Chemical science, 2025, 16, 2344-2350 |
| 1573591 | CIF | C96 O64 Zn16 | F m -3 m | 25.6731; 25.6731; 25.6731 90; 90; 90 | 16921.3 | Kim, Hyunyong; Cohen, Seth M. Metal-organic frameworks generated from oligomeric ligands with functionalized tethers. Chemical science, 2025, 16, 2344-2350 |
| 1573592 | CIF | C96 O64 Zn16 | F m -3 m | 25.6846; 25.6846; 25.6846 90; 90; 90 | 16944.1 | Kim, Hyunyong; Cohen, Seth M. Metal-organic frameworks generated from oligomeric ligands with functionalized tethers. Chemical science, 2025, 16, 2344-2350 |
| 1573593 | CIF | C96 O64 Zn16 | F m -3 m | 25.6483; 25.6483; 25.6483 90; 90; 90 | 16872.4 | Kim, Hyunyong; Cohen, Seth M. Metal-organic frameworks generated from oligomeric ligands with functionalized tethers. Chemical science, 2025, 16, 2344-2350 |
| 1573594 | CIF | C29 H17 N3 O3 | P 1 21/c 1 | 7.2038; 11.3027; 26.8583 90; 92.223; 90 | 2185.2 | Sneddon, Dorian S.; Kevorkian, Paul V.; Hoye, Thomas R. Rapid (≤25 °C) cycloisomerization of anhydride-tethered triynes to benzynes - origin of a remarkable anhydride linker-induced rate enhancement. Chemical science, 2025, 16, 2898-2906 |
| 1573595 | CIF | C47 H41 N5 O5 | P 1 21/n 1 | 13.0754; 19.067; 15.68 90; 104.258; 90 | 3788.7 | Bae, Sungryul; Jeong, Younjae; Lee, Dongwhan Mutually antagonistic molecular clips: symmetry-breaking non-covalent bonds at the chiral-nonchiral interface. Chemical science, 2025, 16, 3459-3469 |
| 1573596 | CIF | C56 H42 N6 O5 | P -1 | 8.418; 12.809; 40.083 91.42; 92.29; 106.79 | 4131.5 | Bae, Sungryul; Jeong, Younjae; Lee, Dongwhan Mutually antagonistic molecular clips: symmetry-breaking non-covalent bonds at the chiral-nonchiral interface. Chemical science, 2025, 16, 3459-3469 |
| 1573597 | CIF | C44 H36 N4 O3 | P b c a | 15.283; 14.723; 30.471 90; 90; 90 | 6856 | Bae, Sungryul; Jeong, Younjae; Lee, Dongwhan Mutually antagonistic molecular clips: symmetry-breaking non-covalent bonds at the chiral-nonchiral interface. Chemical science, 2025, 16, 3459-3469 |
| 1573598 | CIF | C84 H69 N9 O8 | P 21 21 21 | 14.434; 15.041; 30.493 90; 90; 90 | 6620 | Bae, Sungryul; Jeong, Younjae; Lee, Dongwhan Mutually antagonistic molecular clips: symmetry-breaking non-covalent bonds at the chiral-nonchiral interface. Chemical science, 2025, 16, 3459-3469 |
| 1573599 | CIF | C13 H16 I N O2 | P -1 | 5.4287; 8.9764; 13.4695 96.706; 95.087; 90.122 | 649.26 | Shiels, Oisin J.; Brydon, Samuel C.; Poad, Berwyck L. J.; Marshall, David L.; Houston, Sevan D.; Xing, Hui; Bernhardt, Paul V.; Savage, G. Paul; Williams, Craig M.; Harman, David G.; Kirk, Benjamin B.; da Silva, Gabriel; Blanksby, Stephen J.; Trevitt, Adam J. Electrostatically tuning radical addition and atom abstraction reactions with distonic radical ions. Chemical science, 2025, 16, 2861-2878 |
| 1573617 | CIF | C29 H22 O | C 1 2/c 1 | 26.9512; 9.4305; 17.329 90; 111.921; 90 | 4086 | Wang, Shiyin; Liu, Haichao; Zhao, Shuaiqiang; Wu, Qiaolin; Yang, Zhiqiang; Yang, Daojie; Lv, Yingbo; Su, Qing; Zhang, Shi-Tong; Yang, Bing A comparative investigation on excimer fluorescence toward its bright future. Chemical science, 2025, 16, 3275-3284 |
| 1573618 | CIF | C43 H30 O | P -1 | 9.1255; 17.9972; 18.3091 90.153; 90.817; 94.909 | 2995.6 | Wang, Shiyin; Liu, Haichao; Zhao, Shuaiqiang; Wu, Qiaolin; Yang, Zhiqiang; Yang, Daojie; Lv, Yingbo; Su, Qing; Zhang, Shi-Tong; Yang, Bing A comparative investigation on excimer fluorescence toward its bright future. Chemical science, 2025, 16, 3275-3284 |
| 1573620 | CIF | C54 H67 Cu K N6 O9 | P -1 | 9.0901; 13.3962; 22.3177 77.196; 86.431; 82.887 | 2628.01 | Das, Soumadip; Roy, Aritra; Chakrabarti, Navonil; Mukhopadhyay, Narottam; Sarkar, Aniruddha; Sen Gupta, Sayam Self-sensitized Cu(ii)-complex catalyzed solar driven CO<sub>2</sub> reduction. Chemical science, 2025, 16, 3114-3123 |
| 1573621 | CIF | C44 H48 Cl Cu N7 O3 | P -1 | 9.6787; 10.7885; 20.4415 96.743; 90.805; 99.865 | 2087.09 | Das, Soumadip; Roy, Aritra; Chakrabarti, Navonil; Mukhopadhyay, Narottam; Sarkar, Aniruddha; Sen Gupta, Sayam Self-sensitized Cu(ii)-complex catalyzed solar driven CO<sub>2</sub> reduction. Chemical science, 2025, 16, 3114-3123 |
| 1573622 | CIF | C98 H118 F6 N6 O2 S4 | C 1 2/c 1 | 25.2111; 22.7564; 33.5239 90; 108.292; 90 | 18261.3 | Wang, Yan-Bo; Tsai, Chia-Lin; Xue, Yung-Jing; Jiang, Bing-Huang; Lu, Han-Cheng; Hong, Jun-Cheng; Huang, Yu-Chi; Huang, Kuo-Hsiu; Chien, Su-Ying; Chen, Chih-Ping; Cheng, Yen-Ju Fluorinated and methylated <i>ortho</i>-benzodipyrrole-based acceptors suppressing charge recombination and minimizing energy loss in organic photovoltaics. Chemical science, 2025, 16, 3259-3274 |
| 1573623 | CIF | C100 H124 F4 N6 O2 S4 | P -1 | 21.223; 21.3687; 32.1128 91.951; 91.3666; 103.586 | 14140.1 | Wang, Yan-Bo; Tsai, Chia-Lin; Xue, Yung-Jing; Jiang, Bing-Huang; Lu, Han-Cheng; Hong, Jun-Cheng; Huang, Yu-Chi; Huang, Kuo-Hsiu; Chien, Su-Ying; Chen, Chih-Ping; Cheng, Yen-Ju Fluorinated and methylated <i>ortho</i>-benzodipyrrole-based acceptors suppressing charge recombination and minimizing energy loss in organic photovoltaics. Chemical science, 2025, 16, 3259-3274 |
| 1573677 | CIF | C11 H15 B F2 I N O6 | C 1 2/c 1 | 51.208; 7.1184; 31.56 90; 126.597; 90 | 9236.1 | Wu, Hengbo; Luo, Ruitong; Peng, Jingjing; Han, Zijian; Zhang, Renjie; Xu, Zhijian; Zhu, Weiliang; Liu, Hong; Li, Chunpu B(MIDA)-directed site-selective intermolecular halofluoroalkylation of alkenes: synthesis of diversely functionalized building blocks. Chemical science, 2025, 16, 2710-2717 |
| 1573678 | CIF | Cu10 S13 Te4 | I -4 3 m | 10.2609; 10.2609; 10.2609 90; 90; 90 | 1080.33 | Zhang, Bo; Zhou, Sheng-Hua; Li, Bing-Xuan; Wu, Xin-Tao; Lin, Hua; Zhu, Qi-Long Exploring new horizons in mid-to-far infrared nonlinear optical crystals: the significant potential of trigonal pyramidal [TeS<sub>3</sub>]<sup>2-</sup> functional units. Chemical science, 2025, 16, 3218-3227 |
| 1573686 | CIF | C126 H160 K O6 | C m c 21 | 26.623; 12.2818; 36.081 90; 90; 90 | 11797.7 | Zhu, Yikun; Borstelmann, Jan; Neiss, Christian; Wei, Zheng; Görling, Andreas; Kivala, Milan; Petrukhina, Marina A. Stepwise reduction of an asymmetric π-expanded pyracylene towards the crystalline radical trianion. Chemical science, 2025, 16, 3211-3217 |
| 1573687 | CIF | C186 H270 N6 O25.5 Rb3 | P -1 | 14.192; 23.883; 28.136 88.137; 80.21; 77.124 | 9161 | Zhu, Yikun; Borstelmann, Jan; Neiss, Christian; Wei, Zheng; Görling, Andreas; Kivala, Milan; Petrukhina, Marina A. Stepwise reduction of an asymmetric π-expanded pyracylene towards the crystalline radical trianion. Chemical science, 2025, 16, 3211-3217 |
| 1573688 | CIF | C136 H170 O14.5 Rb2 | I 41/a :2 | 27.4995; 27.4995; 70.8136 90; 90; 90 | 53550.8 | Zhu, Yikun; Borstelmann, Jan; Neiss, Christian; Wei, Zheng; Görling, Andreas; Kivala, Milan; Petrukhina, Marina A. Stepwise reduction of an asymmetric π-expanded pyracylene towards the crystalline radical trianion. Chemical science, 2025, 16, 3211-3217 |
| 1573689 | CIF | C30 H29 B N2 O3 | P 1 21/n 1 | 11.04999; 23.491; 22.4123 90; 100.772; 90 | 5715.2 | Qin, Hao-Ni; Jiang, Hao-Wen; Zhao, Yi; Qurban, Saira; Wang, Ke-Chun; Xu, Peng-Fei Photocatalytic [3 + 2]-annulation <i>via</i> sodium tetraarylborate: a fundamental approach for synthesizing 1,4,2-diazaborole analogs. Chemical science, 2025, 16, 2837-2842 |
| 1573690 | CIF | C21 H34 I N O5 Si | P 21 21 21 | 8.9672; 14.2728; 19.4271 90; 90; 90 | 2486.42 | Seo, Seung Mo; Kim, Dongwook; Kim, Taewan; Han, Sunkyu Total synthesis of (-)-flueggenine A and (-)-15'-<i>epi</i>-flueggenine D. Chemical science, 2025, 16, 1216-1221 |
| 1573691 | CIF | C24 H26 N2 O4 | P 1 21 1 | 11.95; 6.4623; 13.674 90; 103.465; 90 | 1026.9 | Seo, Seung Mo; Kim, Dongwook; Kim, Taewan; Han, Sunkyu Total synthesis of (-)-flueggenine A and (-)-15'-<i>epi</i>-flueggenine D. Chemical science, 2025, 16, 1216-1221 |
| 1573692 | CIF | C24 H45 N O5 Si2 | P 1 21 1 | 6.8112; 9.0531; 23.2935 90; 95.8682; 90 | 1428.81 | Seo, Seung Mo; Kim, Dongwook; Kim, Taewan; Han, Sunkyu Total synthesis of (-)-flueggenine A and (-)-15'-<i>epi</i>-flueggenine D. Chemical science, 2025, 16, 1216-1221 |
| 1573693 | CIF | C23 H35 I N O5 Si | P 21 21 2 | 8.5047; 46.069; 6.8117 90; 90; 90 | 2668.8 | Seo, Seung Mo; Kim, Dongwook; Kim, Taewan; Han, Sunkyu Total synthesis of (-)-flueggenine A and (-)-15'-<i>epi</i>-flueggenine D. Chemical science, 2025, 16, 1216-1221 |
| 1573694 | CIF | C36 H50 N2 O12 | P 1 21 1 | 17.7153; 5.8663; 18.0482 90; 99.613; 90 | 1849.3 | Seo, Seung Mo; Kim, Dongwook; Kim, Taewan; Han, Sunkyu Total synthesis of (-)-flueggenine A and (-)-15'-<i>epi</i>-flueggenine D. Chemical science, 2025, 16, 1216-1221 |
| 1573695 | CIF | C7 H9 Br2 N7 O Zn | I -4 3 m | 16.77164; 16.77164; 16.77164 90; 90; 90 | 4717.66 | Liang, Zi-Jun; Dong, Fang-Di; Ye, Le; Zheng, Kai; Hu, Ding-Yi; Feng, Xi; Su, Wen-Yu; Wang, Zhi-Shuo; Zhou, Mu-Yang; Fang, Zi-Luo; Zhou, Dong-Dong; Zhang, Jie-Peng; Chen, Xiao-Ming Introducing halogen-bonded gates into zeolitic frameworks for efficient benzene/cyclohexene/cyclohexane separation. Chemical science, 2025, 16, 3307-3312 |
| 1573696 | CIF | C10.96 H8.96 Br2 N6 Zn | I -4 3 m | 16.7719; 16.7719; 16.7719 90; 90; 90 | 4717.88 | Liang, Zi-Jun; Dong, Fang-Di; Ye, Le; Zheng, Kai; Hu, Ding-Yi; Feng, Xi; Su, Wen-Yu; Wang, Zhi-Shuo; Zhou, Mu-Yang; Fang, Zi-Luo; Zhou, Dong-Dong; Zhang, Jie-Peng; Chen, Xiao-Ming Introducing halogen-bonded gates into zeolitic frameworks for efficient benzene/cyclohexene/cyclohexane separation. Chemical science, 2025, 16, 3307-3312 |
| 1573697 | CIF | O7 S Te Ti | P 1 21 1 | 4.9516; 7.6029; 7.1865 90; 105.062; 90 | 261.25 | Li, Zhenhua; Liang, Zhengli; Wan, Jiahao; Liu, Lehui; Wu, Chunxiang; Wang, Ping; Jiang, Xingxing; Lin, Zheshuai; Liu, Hongming Different p-block elements induce C<sub>3</sub>[111] octahedral distortion in titanium to generate an intense nonlinear effect. Chemical science, 2025, 16, 3329-3335 |
| 1573703 | CIF | C72 H54 F3 N5 O4 S2 | P -1 | 11.823; 13.6657; 23.0648 100.582; 94.663; 108.17 | 3442.01 | Liu, Junxiang; Wang, Kangmin; Wan, Liqiu; Yang, Xianhui; Li, Bijin Ruthenium-catalyzed C-H bond activation and annulation of phenothiazine-3-carbaldehydes: facile access to dual-emission materials. Chemical science, 2025, 16, 3107-3113 |
| 1573704 | CIF | C21 H20 F3 N Zr | P 1 21/n 1 | 8.1766; 15.5546; 14.6671 90; 99.429; 90 | 1840.21 | Bonfante, Sara; Tanner, Theo F. N.; Lorber, Christian; Lynam, Jason M.; Simonneau, Antoine; Slattery, John M. Zirconium-mediated carbon-fluorine bond functionalisation through cyclohexyne "umpolung". Chemical science, 2025, 16, 3552-3559 |
| 1573706 | CIF | C15 H15 N3 O S | P 1 21/n 1 | 9.889; 23.89; 12.335 90; 98.52; 90 | 2882 | Sentürk, Bengi; Butschke, Burkhard; Eisenreich, Fabian Thiosemicarbazones as versatile photoswitches with light-controllable supramolecular activity. Chemical science, 2025, 16, 3130-3140 |
| 1573707 | CIF | C14 H13 N3 S | P -1 | 5.9879; 10.235; 11.312 66.744; 82.452; 86.562 | 631.4 | Sentürk, Bengi; Butschke, Burkhard; Eisenreich, Fabian Thiosemicarbazones as versatile photoswitches with light-controllable supramolecular activity. Chemical science, 2025, 16, 3130-3140 |
| 1573708 | CIF | C14 H11 Cl2 N3 S | P -1 | 7.866; 8.231; 11.963 92.336; 96.812; 111.933 | 710.4 | Sentürk, Bengi; Butschke, Burkhard; Eisenreich, Fabian Thiosemicarbazones as versatile photoswitches with light-controllable supramolecular activity. Chemical science, 2025, 16, 3130-3140 |
| 1573709 | CIF | C14 H14 N4 O S | P 21 21 21 | 6.643; 7.435; 28.49 90; 90; 90 | 1407 | Sentürk, Bengi; Butschke, Burkhard; Eisenreich, Fabian Thiosemicarbazones as versatile photoswitches with light-controllable supramolecular activity. Chemical science, 2025, 16, 3130-3140 |
| 1573710 | CIF | C12 H11 N3 S2 | P -1 | 5.689; 10.012; 11.393 71.163; 82.543; 87.953 | 609 | Sentürk, Bengi; Butschke, Burkhard; Eisenreich, Fabian Thiosemicarbazones as versatile photoswitches with light-controllable supramolecular activity. Chemical science, 2025, 16, 3130-3140 |
| 1573711 | CIF | C12 H11 N3 O S | P -1 | 5.823; 9.744; 11.011 70.013; 83.399; 88.167 | 583.2 | Sentürk, Bengi; Butschke, Burkhard; Eisenreich, Fabian Thiosemicarbazones as versatile photoswitches with light-controllable supramolecular activity. Chemical science, 2025, 16, 3130-3140 |
| 1573712 | CIF | C14 H8 F5 N3 S | C 1 2/c 1 | 28.98; 6.951; 14.974 90; 110.329; 90 | 2828.5 | Sentürk, Bengi; Butschke, Burkhard; Eisenreich, Fabian Thiosemicarbazones as versatile photoswitches with light-controllable supramolecular activity. Chemical science, 2025, 16, 3130-3140 |
| 1573713 | CIF | C27 H19 F3 O2 Si | P -1 | 8.589; 9.902; 14.679 106.882; 94.204; 111.756 | 1086.3 | Matsuo, Tomotoki; Sano, Masaki; Sumida, Yuto; Ohmiya, Hirohisa Organic photoredox-catalyzed unimolecular PCET of benzylic alcohols. Chemical science, 2025, 16, 3150-3156 |
| 1573725 | CIF | C29 H17 N | P 1 21/n 1 | 10.4701; 8.8984; 19.622 90; 99.531; 90 | 1802.89 | Maekawa, Takehisa; Itami, Kenichiro Rapid access to functionalized nanographenes through a palladium-catalyzed multi-annulation sequence. Chemical science, 2025, 16, 3092-3098 |
| 1573732 | CIF | C79 H80 B5 F24 N5 O2 Sn | P -1 | 15.245; 17.2704; 17.6243 92.495; 102.397; 112.807 | 4136.1 | Niu, Dechuang; Kostenko, Arseni; Kelly, John A.; Sarkar, Debotra; Xu, Huihui; Inoue, Shigeyoshi CO<sub>2</sub> hydrosilylation catalyzed by an N-heterocyclic carbene (NHC)-stabilized stannyliumylidene. Chemical science, 2025, 16, 4014-4022 |
| 1573733 | CIF | C70.01 H61 B F24 N4 Sn | P -1 | 13.4232; 17.0569; 18.5469 102.535; 101.839; 109.969 | 3711.1 | Niu, Dechuang; Kostenko, Arseni; Kelly, John A.; Sarkar, Debotra; Xu, Huihui; Inoue, Shigeyoshi CO<sub>2</sub> hydrosilylation catalyzed by an N-heterocyclic carbene (NHC)-stabilized stannyliumylidene. Chemical science, 2025, 16, 4014-4022 |
| 1573734 | CIF | C72 H61 B F24 N4 O4 Sn | P -1 | 10.4739; 16.089; 23.3384 109.831; 92.107; 102.86 | 3579.7 | Niu, Dechuang; Kostenko, Arseni; Kelly, John A.; Sarkar, Debotra; Xu, Huihui; Inoue, Shigeyoshi CO<sub>2</sub> hydrosilylation catalyzed by an N-heterocyclic carbene (NHC)-stabilized stannyliumylidene. Chemical science, 2025, 16, 4014-4022 |
| 1573735 | CIF | C70 H86 Cl2 Cu6 F9 N7 O7 S4 | P n m a | 36.1356; 16.4719; 28.0985 90; 90; 90 | 16724.8 | Das, Saikat; Sakai, Jin; Nakatani, Riki; Kondo, Ayumu; Tomioka, Rina; Das, Subhabrata; Takahashi, Shuntaro; Kawawaki, Tokuhisa; Biswas, Sourav; Negishi, Yuichi Tunable structural rearrangement in Cu cluster assemblies through linker and solvent alterations. Chemical science, 2025, 16, 2600-2608 |
| 1573736 | CIF | C124 H178.5 Cu6 N18.5 O10.5 S4 | P a -3 | 30.937; 30.937; 30.937 90; 90; 90 | 29609.7 | Das, Saikat; Sakai, Jin; Nakatani, Riki; Kondo, Ayumu; Tomioka, Rina; Das, Subhabrata; Takahashi, Shuntaro; Kawawaki, Tokuhisa; Biswas, Sourav; Negishi, Yuichi Tunable structural rearrangement in Cu cluster assemblies through linker and solvent alterations. Chemical science, 2025, 16, 2600-2608 |
| 1573737 | CIF | C82 H99 Cu7 F9 N15 O15 S4 | C 1 2/c 1 | 40.186; 17.9336; 43.303 90; 108.171; 90 | 29651 | Das, Saikat; Sakai, Jin; Nakatani, Riki; Kondo, Ayumu; Tomioka, Rina; Das, Subhabrata; Takahashi, Shuntaro; Kawawaki, Tokuhisa; Biswas, Sourav; Negishi, Yuichi Tunable structural rearrangement in Cu cluster assemblies through linker and solvent alterations. Chemical science, 2025, 16, 2600-2608 |
| 1573738 | CIF | C3.21 H3.97 Cl0.49 Cu0.48 F0.57 N0.19 O0.38 S0.29 | P -1 | 13.4577; 13.9427; 13.9994 82.041; 82.058; 75.543 | 2504.4 | Das, Saikat; Sakai, Jin; Nakatani, Riki; Kondo, Ayumu; Tomioka, Rina; Das, Subhabrata; Takahashi, Shuntaro; Kawawaki, Tokuhisa; Biswas, Sourav; Negishi, Yuichi Tunable structural rearrangement in Cu cluster assemblies through linker and solvent alterations. Chemical science, 2025, 16, 2600-2608 |
| 1573739 | CIF | C42.5 H48 Cl5 Cu6 F3 N4 O2 S8 | I m m a | 24.6205; 17.0084; 22.4482 90; 90; 90 | 9400.3 | Das, Saikat; Sakai, Jin; Nakatani, Riki; Kondo, Ayumu; Tomioka, Rina; Das, Subhabrata; Takahashi, Shuntaro; Kawawaki, Tokuhisa; Biswas, Sourav; Negishi, Yuichi Tunable structural rearrangement in Cu cluster assemblies through linker and solvent alterations. Chemical science, 2025, 16, 2600-2608 |
| 1573740 | CIF | C27 H37 Cl2 Cu5 F6 N4 O4 S3 | P 1 21/c 1 | 13.9234; 11.9576; 23.9446 90; 91.901; 90 | 3984.4 | Das, Saikat; Sakai, Jin; Nakatani, Riki; Kondo, Ayumu; Tomioka, Rina; Das, Subhabrata; Takahashi, Shuntaro; Kawawaki, Tokuhisa; Biswas, Sourav; Negishi, Yuichi Tunable structural rearrangement in Cu cluster assemblies through linker and solvent alterations. Chemical science, 2025, 16, 2600-2608 |
| 1573741 | CIF | C2.8 H3.28 Cl0.16 Cu0.4 F0.48 N0.16 O0.32 S0.4 | P 1 21/c 1 | 20.5359; 15.906; 18.1932 90; 102.802; 90 | 5795 | Das, Saikat; Sakai, Jin; Nakatani, Riki; Kondo, Ayumu; Tomioka, Rina; Das, Subhabrata; Takahashi, Shuntaro; Kawawaki, Tokuhisa; Biswas, Sourav; Negishi, Yuichi Tunable structural rearrangement in Cu cluster assemblies through linker and solvent alterations. Chemical science, 2025, 16, 2600-2608 |
| 1573742 | CIF | C50 H42 B2 N2 O2 | C 1 2/c 1 | 17.9182; 19.9055; 13.5411 90; 127.513; 90 | 3831 | Xue, Zhuixing; Xiao, Zhengqi; Zou, Yang; Chen, Zhanxiang; Liu, Jiahui; Huang, Zhongyan; Yang, Chuluo A mesityl-functionalized double-boron-nitrogen-oxygen-embedded multi-resonance framework achieves anti-quenching narrowband deep-blue electroluminescence with EQE over 30% and CIE <sub><i>y</i></sub> of 0.046. Chemical science, 2025, 16, 3655-3661 |
| 1573743 | CIF | C68 H62 B2 N2 O2 | P -1 | 16.4777; 19.3715; 19.7104 82.656; 89.376; 77.021 | 6079.5 | Xue, Zhuixing; Xiao, Zhengqi; Zou, Yang; Chen, Zhanxiang; Liu, Jiahui; Huang, Zhongyan; Yang, Chuluo A mesityl-functionalized double-boron-nitrogen-oxygen-embedded multi-resonance framework achieves anti-quenching narrowband deep-blue electroluminescence with EQE over 30% and CIE <sub><i>y</i></sub> of 0.046. Chemical science, 2025, 16, 3655-3661 |
| 1573744 | CIF | C312 H372 N36 O42 S24 Ti12 | P -1 | 20.926; 20.984; 21.932 64.82; 76.693; 77.002 | 8393 | Meng, Ru-Xin; Zhao, Lan-Cheng; Luo, Li-Pan; Tian, Yi-Qi; Shao, Yong-Liang; Tang, Qing; Wang, Likai; Yan, Jun; Liu, Chao Atomic-level engineering of single Ag1+ site distribution on titanium–oxo cluster surfaces to boost CO2 electroreduction Chemical Science, 2025, 16, 6845-6852 |
| 1573745 | CIF | C82 H90.68 Ag2 N O11 S8 Ti2 | I 1 2/m 1 | 16.0181; 18.7809; 30.2892 90; 92.8776; 90 | 9100.5 | Meng, Ru-Xin; Zhao, Lan-Cheng; Luo, Li-Pan; Tian, Yi-Qi; Shao, Yong-Liang; Tang, Qing; Wang, Likai; Yan, Jun; Liu, Chao Atomic-level engineering of single Ag1+ site distribution on titanium–oxo cluster surfaces to boost CO2 electroreduction Chemical Science, 2025, 16, 6845-6852 |
| 1573746 | CIF | C265.64 H306.46 Ag4.51 N12.82 O42.76 S24 Ti12 | P 1 21/n 1 | 21.329; 34.611; 23.413 90; 116.73; 90 | 15437 | Meng, Ru-Xin; Zhao, Lan-Cheng; Luo, Li-Pan; Tian, Yi-Qi; Shao, Yong-Liang; Tang, Qing; Wang, Likai; Yan, Jun; Liu, Chao Atomic-level engineering of single Ag1+ site distribution on titanium–oxo cluster surfaces to boost CO2 electroreduction Chemical Science, 2025, 16, 6845-6852 |
| 1573747 | CIF | C200 H221.72 Na O36 S20 Ti8 | P 1 21/c 1 | 33.1669; 21.7916; 35.921 90; 91.759; 90 | 25950 | Meng, Ru-Xin; Zhao, Lan-Cheng; Luo, Li-Pan; Tian, Yi-Qi; Shao, Yong-Liang; Tang, Qing; Wang, Likai; Yan, Jun; Liu, Chao Atomic-level engineering of single Ag1+ site distribution on titanium–oxo cluster surfaces to boost CO2 electroreduction Chemical Science, 2025, 16, 6845-6852 |
| 1573748 | CIF | C2.95 H5.9 In0.1 N0.29 O0.38 | P -1 | 11.919; 12.4961; 13.0349 61.504; 89.234; 89.801 | 1706.07 | Riu, Martin-Louis Y; Shan, Jing-Ran; Houk, K. N.; Nava, Matthew Metal-ligand cooperativity enables zero-valent metal transfer. Chemical science, 2025, 16, 3888-3894 |
| 1573749 | CIF | C31 H62 Al N3 O4 | P -1 | 11.7623; 12.4407; 12.9344 118.532; 91.442; 90.128 | 1662.09 | Riu, Martin-Louis Y; Shan, Jing-Ran; Houk, K. N.; Nava, Matthew Metal-ligand cooperativity enables zero-valent metal transfer. Chemical science, 2025, 16, 3888-3894 |
| 1573750 | CIF | C31 H62 Ga N3 O4 | P -1 | 11.7627; 12.4302; 12.9451 118.425; 91.211; 90.139 | 1664.01 | Riu, Martin-Louis Y; Shan, Jing-Ran; Houk, K. N.; Nava, Matthew Metal-ligand cooperativity enables zero-valent metal transfer. Chemical science, 2025, 16, 3888-3894 |
| 1573751 | CIF | C18 H36 In2 N2 O2 | C m c e | 12.4969; 9.4605; 18.0744 90; 90; 90 | 2136.9 | Riu, Martin-Louis Y; Shan, Jing-Ran; Houk, K. N.; Nava, Matthew Metal-ligand cooperativity enables zero-valent metal transfer. Chemical science, 2025, 16, 3888-3894 |
| 1573752 | CIF | C27 H56 Ga N3 O3 | P 1 21/n 1 | 12.0657; 12.8632; 19.2485 90; 94.979; 90 | 2976.2 | Riu, Martin-Louis Y; Shan, Jing-Ran; Houk, K. N.; Nava, Matthew Metal-ligand cooperativity enables zero-valent metal transfer. Chemical science, 2025, 16, 3888-3894 |
| 1573755 | CIF | C27 H31 N O2 | P 1 21/n 1 | 12.5383; 9.5231; 18.69 90; 97.104; 90 | 2214.52 | Meng, Huan; Jia, Jun-Song; Yang, Peng-Fei; Li, Yu-Long; Yu, Qiong; Shu, Wei Ni-catalyzed regioselective and site-divergent reductive arylalkylations of allylic amines. Chemical science, 2025, 16, 4442-4449 |
| 1573756 | CIF | C27 H28 N2 O | C 1 c 1 | 13.8063; 17.9373; 9.9554 90; 113.319; 90 | 2264.04 | Meng, Huan; Jia, Jun-Song; Yang, Peng-Fei; Li, Yu-Long; Yu, Qiong; Shu, Wei Ni-catalyzed regioselective and site-divergent reductive arylalkylations of allylic amines. Chemical science, 2025, 16, 4442-4449 |
| 1573757 | CIF | C3 H10 I3 N O Pb | P 21 21 21 | 4.5931; 11.6051; 22.0202 90; 90; 90 | 1173.75 | Li, Hongxu; Cao, Rui; Tao, Min; Jiang, Jiawei; Xiao, Yin Chiral perovskites with a unique 1D chain structure: impact of chiral ligand geometry on local inversion asymmetry and chiral-induced spin selectivity. Chemical science, 2025, 16, 4057-4065 |
| 1573758 | CIF | C3 H10 I3 N O Pb | P 21 21 21 | 4.5899; 11.5987; 22.0076 90; 90; 90 | 1171.62 | Li, Hongxu; Cao, Rui; Tao, Min; Jiang, Jiawei; Xiao, Yin Chiral perovskites with a unique 1D chain structure: impact of chiral ligand geometry on local inversion asymmetry and chiral-induced spin selectivity. Chemical science, 2025, 16, 4057-4065 |
| 1573759 | CIF | C21 H22 N2 O3 S | P 1 21/c 1 | 9.0752; 20.3258; 11.2289 90; 111.107; 90 | 1932.33 | Lai, Ze-Min; Xie, Ying; Huang, Le-Le; Guo, Jing; Lu, Gui Catalytic enantioselective synthesis of α-C chiral sulfones enabled by merging photoactive electron donor-acceptor complexes with nickel catalysis. Chemical science, 2025, 16, 4352-4359 |
| 1573760 | CIF | C24 H25 I N2 O | P -1 | 8.6576; 11.4823; 11.8769 70.882; 79.329; 82.137 | 1092.57 | Wootton, Jack M.; Roper, Natalie J.; Morris, Catrin E.; Maguire, Victoria E.; Duff, Lee C.; Waddell, Paul G.; Whitwood, Adrian C.; Gammons, Richard J.; Miah, Afjal H.; Lynam, Jason M.; Armstrong, Roly J.; Unsworth, William P. Stereoselective synthesis of atropisomeric amides enabled by intramolecular acyl transfer. Chemical science, 2025, 16, 3938-3945 |
| 1573761 | CIF | C28 H28 N2 O2 | P 1 21/c 1 | 8.3156; 15.8552; 17.6204 90; 101.442; 90 | 2277 | Wootton, Jack M.; Roper, Natalie J.; Morris, Catrin E.; Maguire, Victoria E.; Duff, Lee C.; Waddell, Paul G.; Whitwood, Adrian C.; Gammons, Richard J.; Miah, Afjal H.; Lynam, Jason M.; Armstrong, Roly J.; Unsworth, William P. Stereoselective synthesis of atropisomeric amides enabled by intramolecular acyl transfer. Chemical science, 2025, 16, 3938-3945 |
| 1573762 | CIF | C30 H30 N2 O | P 1 21/c 1 | 11.85289; 23.3855; 8.96547 90; 104.164; 90 | 2409.55 | Wootton, Jack M.; Roper, Natalie J.; Morris, Catrin E.; Maguire, Victoria E.; Duff, Lee C.; Waddell, Paul G.; Whitwood, Adrian C.; Gammons, Richard J.; Miah, Afjal H.; Lynam, Jason M.; Armstrong, Roly J.; Unsworth, William P. Stereoselective synthesis of atropisomeric amides enabled by intramolecular acyl transfer. Chemical science, 2025, 16, 3938-3945 |
| 1573763 | CIF | C29 H36 N2 O | P 1 21 1 | 8.7877; 13.2804; 10.4903 90; 93.628; 90 | 1221.81 | Wootton, Jack M.; Roper, Natalie J.; Morris, Catrin E.; Maguire, Victoria E.; Duff, Lee C.; Waddell, Paul G.; Whitwood, Adrian C.; Gammons, Richard J.; Miah, Afjal H.; Lynam, Jason M.; Armstrong, Roly J.; Unsworth, William P. Stereoselective synthesis of atropisomeric amides enabled by intramolecular acyl transfer. Chemical science, 2025, 16, 3938-3945 |
| 1573764 | CIF | C25 H28 N2 O | P -1 | 9.0247; 13.2322; 18.6064 100.728; 100.909; 105.883 | 2030.78 | Wootton, Jack M.; Roper, Natalie J.; Morris, Catrin E.; Maguire, Victoria E.; Duff, Lee C.; Waddell, Paul G.; Whitwood, Adrian C.; Gammons, Richard J.; Miah, Afjal H.; Lynam, Jason M.; Armstrong, Roly J.; Unsworth, William P. Stereoselective synthesis of atropisomeric amides enabled by intramolecular acyl transfer. Chemical science, 2025, 16, 3938-3945 |
| 1573765 | CIF | C30 H30 N2 O | P -1 | 9.0232; 10.8445; 12.5529 95.795; 99.084; 96.98 | 1194.85 | Wootton, Jack M.; Roper, Natalie J.; Morris, Catrin E.; Maguire, Victoria E.; Duff, Lee C.; Waddell, Paul G.; Whitwood, Adrian C.; Gammons, Richard J.; Miah, Afjal H.; Lynam, Jason M.; Armstrong, Roly J.; Unsworth, William P. Stereoselective synthesis of atropisomeric amides enabled by intramolecular acyl transfer. Chemical science, 2025, 16, 3938-3945 |
| 1573766 | CIF | C20 H24 B10 O | P -1 | 10.5221; 12.1599; 18.0206 73.817; 78.768; 78.192 | 2144.08 | Wang, Zhen; Yu, Jiahui; Zhang, Jie; Zhang, Dengsong; Qiu, Zaozao; Xie, Zuowei Palladium-catalyzed intramolecular aerobic oxidative cross-coupling of BH/CH between <i>o</i>-carborane and arenes. Chemical science, 2025, 16, 3705-3712 |
| 1573767 | CIF | C26 H24 B10 | P -1 | 10.8412; 19.4475; 23.3896 75.392; 80.868; 87.318 | 4711.3 | Wang, Zhen; Yu, Jiahui; Zhang, Jie; Zhang, Dengsong; Qiu, Zaozao; Xie, Zuowei Palladium-catalyzed intramolecular aerobic oxidative cross-coupling of BH/CH between <i>o</i>-carborane and arenes. Chemical science, 2025, 16, 3705-3712 |
| 1573768 | CIF | C14 H18 B10 | P 1 21/c 1 | 9.9506; 13.287; 12.6971 90; 101.393; 90 | 1645.65 | Wang, Zhen; Yu, Jiahui; Zhang, Jie; Zhang, Dengsong; Qiu, Zaozao; Xie, Zuowei Palladium-catalyzed intramolecular aerobic oxidative cross-coupling of BH/CH between <i>o</i>-carborane and arenes. Chemical science, 2025, 16, 3705-3712 |
| 1573769 | CIF | C13 H18 B10 O | P 1 21/n 1 | 7.1385; 22.1234; 10.2306 90; 95.391; 90 | 1608.6 | Wang, Zhen; Yu, Jiahui; Zhang, Jie; Zhang, Dengsong; Qiu, Zaozao; Xie, Zuowei Palladium-catalyzed intramolecular aerobic oxidative cross-coupling of BH/CH between <i>o</i>-carborane and arenes. Chemical science, 2025, 16, 3705-3712 |
| 1573770 | CIF | C14 H18 B10 | P 1 21/c 1 | 11.0634; 14.0548; 20.6273 90; 92.773; 90 | 3203.66 | Wang, Zhen; Yu, Jiahui; Zhang, Jie; Zhang, Dengsong; Qiu, Zaozao; Xie, Zuowei Palladium-catalyzed intramolecular aerobic oxidative cross-coupling of BH/CH between <i>o</i>-carborane and arenes. Chemical science, 2025, 16, 3705-3712 |
| 1573771 | CIF | C19 H20 B10 | C 1 2/c 1 | 24.0114; 8.3879; 19.3844 90; 99.3; 90 | 3852.8 | Wang, Zhen; Yu, Jiahui; Zhang, Jie; Zhang, Dengsong; Qiu, Zaozao; Xie, Zuowei Palladium-catalyzed intramolecular aerobic oxidative cross-coupling of BH/CH between <i>o</i>-carborane and arenes. Chemical science, 2025, 16, 3705-3712 |
| 1573772 | CIF | C18 H28 B10 Si | P 1 21/n 1 | 10.7343; 15.469; 13.0999 90; 94.563; 90 | 2168.33 | Wang, Zhen; Yu, Jiahui; Zhang, Jie; Zhang, Dengsong; Qiu, Zaozao; Xie, Zuowei Palladium-catalyzed intramolecular aerobic oxidative cross-coupling of BH/CH between <i>o</i>-carborane and arenes. Chemical science, 2025, 16, 3705-3712 |
| 1573773 | CIF | C21 H24 B10 | P b c a | 17.6926; 7.5803; 31.0434 90; 90; 90 | 4163.39 | Wang, Zhen; Yu, Jiahui; Zhang, Jie; Zhang, Dengsong; Qiu, Zaozao; Xie, Zuowei Palladium-catalyzed intramolecular aerobic oxidative cross-coupling of BH/CH between <i>o</i>-carborane and arenes. Chemical science, 2025, 16, 3705-3712 |
| 1573774 | CIF | C26 H28 B10 O | P 21 21 21 | 10.1324; 15.565; 16.148 90; 90; 90 | 2546.71 | Wang, Zhen; Yu, Jiahui; Zhang, Jie; Zhang, Dengsong; Qiu, Zaozao; Xie, Zuowei Palladium-catalyzed intramolecular aerobic oxidative cross-coupling of BH/CH between <i>o</i>-carborane and arenes. Chemical science, 2025, 16, 3705-3712 |
| 1573775 | CIF | C22 H20 B10 | P 1 21 1 | 7.4914; 17.9215; 16.097 90; 90.673; 90 | 2160.99 | Wang, Zhen; Yu, Jiahui; Zhang, Jie; Zhang, Dengsong; Qiu, Zaozao; Xie, Zuowei Palladium-catalyzed intramolecular aerobic oxidative cross-coupling of BH/CH between <i>o</i>-carborane and arenes. Chemical science, 2025, 16, 3705-3712 |
| 1573776 | CIF | C22 H20 B10 | P -1 | 11.4881; 13.9932; 14.0464 80.467; 79.395; 71.939 | 2095.8 | Wang, Zhen; Yu, Jiahui; Zhang, Jie; Zhang, Dengsong; Qiu, Zaozao; Xie, Zuowei Palladium-catalyzed intramolecular aerobic oxidative cross-coupling of BH/CH between <i>o</i>-carborane and arenes. Chemical science, 2025, 16, 3705-3712 |
| 1573777 | CIF | C28 H28 B10 O | P 1 21/c 1 | 15.0683; 18.877; 18.5211 90; 90.849; 90 | 5267.6 | Wang, Zhen; Yu, Jiahui; Zhang, Jie; Zhang, Dengsong; Qiu, Zaozao; Xie, Zuowei Palladium-catalyzed intramolecular aerobic oxidative cross-coupling of BH/CH between <i>o</i>-carborane and arenes. Chemical science, 2025, 16, 3705-3712 |
| 1573779 | CIF | C64 H60 O2 | C 1 2/c 1 | 15.8746; 19.1113; 17.1888 90; 97.354; 90 | 5171.9 | Xu, Xiang; Ma, Hao-Ran; Cui, Jian-Fang; Peng, Xiao-Shui; Wong, Henry N. C. Regioselective late-stage functionalization of tetraphenylenes: rapid construction of double helical architectures and potential hole transport materials. Chemical science, 2025, 16, 4342-4351 |
| 1573780 | CIF | C17 H18 N2 O2 S | P -1 | 6.0084; 9.2515; 15.0308 102.542; 99.903; 102.191 | 776.13 | Erchinger, Johannes E.; Lenz, Madina; Mukherjee, Poulami; Li, Yan-Bo; Suresh, Adhya; Daniliuc, Constantin G.; Gutierrez, Osvaldo; Glorius, Frank Mechanistic insights into the regiodivergent insertion of bicyclo[1.1.0]butanes towards carbocycle-tethered N-heteroarenes. Chemical science, 2025, 16, 4006-4013 |
| 1573781 | CIF | C17 H18 N2 O2 S | P 1 21/c 1 | 5.7579; 16.2633; 16.7223 90; 95.874; 90 | 1557.7 | Erchinger, Johannes E.; Lenz, Madina; Mukherjee, Poulami; Li, Yan-Bo; Suresh, Adhya; Daniliuc, Constantin G.; Gutierrez, Osvaldo; Glorius, Frank Mechanistic insights into the regiodivergent insertion of bicyclo[1.1.0]butanes towards carbocycle-tethered N-heteroarenes. Chemical science, 2025, 16, 4006-4013 |
| 1573782 | CIF | C17 H15 N3 O S2 | P b c a | 10.758; 7.7718; 38.4713 90; 90; 90 | 3216.5 | Erchinger, Johannes E.; Lenz, Madina; Mukherjee, Poulami; Li, Yan-Bo; Suresh, Adhya; Daniliuc, Constantin G.; Gutierrez, Osvaldo; Glorius, Frank Mechanistic insights into the regiodivergent insertion of bicyclo[1.1.0]butanes towards carbocycle-tethered N-heteroarenes. Chemical science, 2025, 16, 4006-4013 |
| 1573783 | CIF | C27 H41 Cl2 N2 P Si | P 1 21/n 1 | 8.9802; 15.5193; 21.2731 90; 100.955; 90 | 2910.7 | Phang, Si Jia Isabel; Zhang, Zheng-Feng; Wu, Chi-Shiun; Wong, Zhen Xuan; Su, Ming-Der; So, Cheuk-Wai A silicon analogue of a fused bicyclic borirene derivative. Chemical science, 2025, 16, 4512-4518 |
| 1573784 | CIF | C54 H80 B2 N4 P2 Si2 | P 1 21/n 1 | 9.951; 24.2287; 11.914 90; 114.187; 90 | 2620.29 | Phang, Si Jia Isabel; Zhang, Zheng-Feng; Wu, Chi-Shiun; Wong, Zhen Xuan; Su, Ming-Der; So, Cheuk-Wai A silicon analogue of a fused bicyclic borirene derivative. Chemical science, 2025, 16, 4512-4518 |
| 1573785 | CIF | C27 H40 Cl N2 P Si | P n a 21 | 15.8487; 10.8456; 16.0281 90; 90; 90 | 2755.05 | Phang, Si Jia Isabel; Zhang, Zheng-Feng; Wu, Chi-Shiun; Wong, Zhen Xuan; Su, Ming-Der; So, Cheuk-Wai A silicon analogue of a fused bicyclic borirene derivative. Chemical science, 2025, 16, 4512-4518 |
| 1573786 | CIF | C61 H88 B2 Cl2.03 I1.97 N4 P2 Si2 | P -1 | 10.922; 12.04; 13.307 105.263; 106.255; 95.783 | 1591.7 | Phang, Si Jia Isabel; Zhang, Zheng-Feng; Wu, Chi-Shiun; Wong, Zhen Xuan; Su, Ming-Der; So, Cheuk-Wai A silicon analogue of a fused bicyclic borirene derivative. Chemical science, 2025, 16, 4512-4518 |
| 1573787 | CIF | C27 H40 B Cl I3 N2 P Si | P 1 21/n 1 | 9.1943; 20.6319; 17.5682 90; 98.264; 90 | 3298 | Phang, Si Jia Isabel; Zhang, Zheng-Feng; Wu, Chi-Shiun; Wong, Zhen Xuan; Su, Ming-Der; So, Cheuk-Wai A silicon analogue of a fused bicyclic borirene derivative. Chemical science, 2025, 16, 4512-4518 |
| 1573788 | CIF | C31 H48 B Cl3 N2 O P Si | P 21 21 21 | 11.1528; 22.0855; 27.2759 90; 90; 90 | 6718.5 | Phang, Si Jia Isabel; Zhang, Zheng-Feng; Wu, Chi-Shiun; Wong, Zhen Xuan; Su, Ming-Der; So, Cheuk-Wai A silicon analogue of a fused bicyclic borirene derivative. Chemical science, 2025, 16, 4512-4518 |
| 1573801 | CIF | C24 H20 | P 21 21 21 | 8.421; 13.116; 15.113 90; 90; 90 | 1669.2 | Martinez-Fernandez, L; Wu, Peicong; Bao, Lin-Tao; Wang, Xueli; Zhang, Rui-Hua; Wang, Wei; Yang, Hai-Bo; Chen, Jinquan; Improta, R. On the nature of the triplet electronic states of naphthalene dimers. Chemical science, 2025, 16, 4469-4479 |
| 1573802 | CIF | C24 H20 | P 1 21/c 1 | 8.4113; 11.9596; 8.1538 90; 105.735; 90 | 789.5 | Martinez-Fernandez, L; Wu, Peicong; Bao, Lin-Tao; Wang, Xueli; Zhang, Rui-Hua; Wang, Wei; Yang, Hai-Bo; Chen, Jinquan; Improta, R. On the nature of the triplet electronic states of naphthalene dimers. Chemical science, 2025, 16, 4469-4479 |
| 1573803 | CIF | C24 H20 | P 1 21 1 | 8.4807; 8.4592; 11.4471 90; 96.815; 90 | 815.41 | Martinez-Fernandez, L; Wu, Peicong; Bao, Lin-Tao; Wang, Xueli; Zhang, Rui-Hua; Wang, Wei; Yang, Hai-Bo; Chen, Jinquan; Improta, R. On the nature of the triplet electronic states of naphthalene dimers. Chemical science, 2025, 16, 4469-4479 |
| 1573804 | CIF | C24 H20 | P 43 21 2 | 8.9248; 8.9248; 20.831 90; 90; 90 | 1659.23 | Martinez-Fernandez, L; Wu, Peicong; Bao, Lin-Tao; Wang, Xueli; Zhang, Rui-Hua; Wang, Wei; Yang, Hai-Bo; Chen, Jinquan; Improta, R. On the nature of the triplet electronic states of naphthalene dimers. Chemical science, 2025, 16, 4469-4479 |
| 1573805 | CIF | C30 H20 Br N3 O3 | P 1 21/c 1 | 15.7313; 13.606; 24.1199 90; 108.505; 90 | 4895.7 | Luo, Wenjun; Zheng, Xinghua; Lin, Hehua; Fu, Li; Long, Lipeng; Yu, Daohong; Chen, Zhengwang; Yang, Min; Wang, Zhong-Xia Discovery of intermolecular cascade annulation for dihydrobenzo[<i>b</i>][1,8]naphthyridine-ylidene-pyrrolidinetriones. Chemical science, 2025, 16, 4119-4126 |
| 1573806 | CIF | C69.07 H62 Cl6 O4 P2 S2 | P 1 21/n 1 | 13.3952; 7.8096; 30.55 90; 95.775; 90 | 3179.7 | Dadgaryeganeh, Reza; LeBlanc, Jesse; Pradhan, Ekadashi; Miao, Dandan; Hussein, Amaar; Hunter, Howard N.; Zeng, Tao; Romero-Nieto, Carlos; Baumgartner, Thomas From flat to twisted - multifunctional phosphacyclic nanocarbons based on Vat Orange 3. Chemical science, 2025, 16, 3680-3692 |
| 1573807 | CIF | C72 H76 Cl6 O4 P2 | P -1 | 8.2286; 11.7231; 17.5716 92.692; 93.084; 108.449 | 1601.93 | Dadgaryeganeh, Reza; LeBlanc, Jesse; Pradhan, Ekadashi; Miao, Dandan; Hussein, Amaar; Hunter, Howard N.; Zeng, Tao; Romero-Nieto, Carlos; Baumgartner, Thomas From flat to twisted - multifunctional phosphacyclic nanocarbons based on Vat Orange 3. Chemical science, 2025, 16, 3680-3692 |
| 1573808 | CIF | C70 H80.01 O7 P2 | C 1 2/c 1 | 22.2953; 32.7948; 8.1542 90; 101.91; 90 | 5833.8 | Dadgaryeganeh, Reza; LeBlanc, Jesse; Pradhan, Ekadashi; Miao, Dandan; Hussein, Amaar; Hunter, Howard N.; Zeng, Tao; Romero-Nieto, Carlos; Baumgartner, Thomas From flat to twisted - multifunctional phosphacyclic nanocarbons based on Vat Orange 3. Chemical science, 2025, 16, 3680-3692 |
| 1573809 | CIF | C35 H37 O2 P | P c c n | 18.8221; 34.2599; 8.6524 90; 90; 90 | 5579.4 | Dadgaryeganeh, Reza; LeBlanc, Jesse; Pradhan, Ekadashi; Miao, Dandan; Hussein, Amaar; Hunter, Howard N.; Zeng, Tao; Romero-Nieto, Carlos; Baumgartner, Thomas From flat to twisted - multifunctional phosphacyclic nanocarbons based on Vat Orange 3. Chemical science, 2025, 16, 3680-3692 |
| 1573810 | CIF | C70 H71.53 O4 P2 | C 1 2/c 1 | 58.8812; 8.3047; 34.7288 90; 97.344; 90 | 16842.7 | Dadgaryeganeh, Reza; LeBlanc, Jesse; Pradhan, Ekadashi; Miao, Dandan; Hussein, Amaar; Hunter, Howard N.; Zeng, Tao; Romero-Nieto, Carlos; Baumgartner, Thomas From flat to twisted - multifunctional phosphacyclic nanocarbons based on Vat Orange 3. Chemical science, 2025, 16, 3680-3692 |
| 1573816 | CIF | C109 H108 Cl2 N8 Pd6 Si2 | P -1 | 16.1964; 18.6192; 18.8234 83.984; 80.702; 73.139 | 5351 | Mitomo, Taiga; Wada, Yoshimasa; Suda, Tetsuro; Tamura, Atsushi; Yagi, Shunsuke; Kikkawa, Soichi; Yamazoe, Seiji; Sunada, Yusuke A coordination polymer with a silylene-supported Pd<sub>6</sub> core as an efficient heterogeneous hydrogenation catalyst. Chemical science, 2025, 16, 4450-4455 |
| 1573833 | CIF | C18 H33 F6 N2 O6 P | P 1 21/n 1 | 11.9665; 10.5773; 19.8113 90; 100.165; 90 | 2468.2 | Zhu, Ming; Huang, Pei-Zhi; Li, Lin-Mei; Yang, Yi-Xuan; Pan, Lei; Wang, Zhi-Jie; Ni, Hao-Fei; Zhang, Feng-Wen; Teri, Gele; Zhang, Zhi-Xu; Liu, Zunqi; Fu, Da-Wei; Zhang, Yi Thermal-responsive luminescence/dielectric responses with reversibly shifted light emissions. Chemical science, 2025, 16, 4101-4108 |
| 1573834 | CIF | C12 H18 F6 N4 P | P 1 21/c 1 | 7.8459; 9.828; 10.5087 90; 92.439; 90 | 809.6 | Zhu, Ming; Huang, Pei-Zhi; Li, Lin-Mei; Yang, Yi-Xuan; Pan, Lei; Wang, Zhi-Jie; Ni, Hao-Fei; Zhang, Feng-Wen; Teri, Gele; Zhang, Zhi-Xu; Liu, Zunqi; Fu, Da-Wei; Zhang, Yi Thermal-responsive luminescence/dielectric responses with reversibly shifted light emissions. Chemical science, 2025, 16, 4101-4108 |
| 1573835 | CIF | C18 H33 F6 N2 O6 P | P 1 21/n 1 | 12.022; 10.629; 19.921 90; 100.318; 90 | 2504.4 | Zhu, Ming; Huang, Pei-Zhi; Li, Lin-Mei; Yang, Yi-Xuan; Pan, Lei; Wang, Zhi-Jie; Ni, Hao-Fei; Zhang, Feng-Wen; Teri, Gele; Zhang, Zhi-Xu; Liu, Zunqi; Fu, Da-Wei; Zhang, Yi Thermal-responsive luminescence/dielectric responses with reversibly shifted light emissions. Chemical science, 2025, 16, 4101-4108 |
| 1573836 | CIF | C18 H33 F6 N2 O6 P | P 1 21/n 1 | 11.994; 10.463; 19.815 90; 100.89; 90 | 2441.9 | Zhu, Ming; Huang, Pei-Zhi; Li, Lin-Mei; Yang, Yi-Xuan; Pan, Lei; Wang, Zhi-Jie; Ni, Hao-Fei; Zhang, Feng-Wen; Teri, Gele; Zhang, Zhi-Xu; Liu, Zunqi; Fu, Da-Wei; Zhang, Yi Thermal-responsive luminescence/dielectric responses with reversibly shifted light emissions. Chemical science, 2025, 16, 4101-4108 |
| 1573837 | CIF | C18 H33 F6 N2 O6 P | P 1 21/n 1 | 12.137; 10.6827; 20.015 90; 100.751; 90 | 2549.5 | Zhu, Ming; Huang, Pei-Zhi; Li, Lin-Mei; Yang, Yi-Xuan; Pan, Lei; Wang, Zhi-Jie; Ni, Hao-Fei; Zhang, Feng-Wen; Teri, Gele; Zhang, Zhi-Xu; Liu, Zunqi; Fu, Da-Wei; Zhang, Yi Thermal-responsive luminescence/dielectric responses with reversibly shifted light emissions. Chemical science, 2025, 16, 4101-4108 |
| 1573838 | CIF | C18 H33 F6 N2 O6 P | P 1 21/n 1 | 11.985; 10.522; 19.813 90; 100.634; 90 | 2455.6 | Zhu, Ming; Huang, Pei-Zhi; Li, Lin-Mei; Yang, Yi-Xuan; Pan, Lei; Wang, Zhi-Jie; Ni, Hao-Fei; Zhang, Feng-Wen; Teri, Gele; Zhang, Zhi-Xu; Liu, Zunqi; Fu, Da-Wei; Zhang, Yi Thermal-responsive luminescence/dielectric responses with reversibly shifted light emissions. Chemical science, 2025, 16, 4101-4108 |
| 1573839 | CIF | C27 H9 O18 Th2 | F d -3 m :2 | 13.6682; 13.6682; 13.6682 90; 90; 90 | 2553.49 | Gaidimas, Madeleine A.; Smoljan, Courtney S.; Ye, Zi-Ming; Stern, Charlotte L.; Malliakas, Christos D.; Kirlikovali, Kent O.; Farha, Omar K. Thorium metal-organic framework crystallization for efficient recovery from rare earth element mixtures. Chemical science, 2025, 16, 3895-3903 |
| 1573840 | CIF | C10 H6 O4 | F d d 2 | 14.617; 30.092; 3.6052 90; 90; 90 | 1585.8 | Dunning, Samuel G.; Hari, Anirudh; Zhu, Li; Chen, Bo; Cody, George D.; Romi, Sebastiano; Zhang, Dongzhou; Strobel, Timothy A. Double-core nanothread formation from α-furil <i>via</i> a pressure-induced planarization pathway. Chemical science, 2025, 16, 4144-4151 |
| 1573841 | CIF | C10 H6 O4 | P 1 21/n 1 | 14.586; 7.0535; 3.4512 90; 93.132; 90 | 354.54 | Dunning, Samuel G.; Hari, Anirudh; Zhu, Li; Chen, Bo; Cody, George D.; Romi, Sebastiano; Zhang, Dongzhou; Strobel, Timothy A. Double-core nanothread formation from α-furil <i>via</i> a pressure-induced planarization pathway. Chemical science, 2025, 16, 4144-4151 |
| 1573842 | CIF | C10 H6 O4 | P 1 21/n 1 | 3.313; 6.957; 14.228 90; 94.48; 90 | 326.9 | Dunning, Samuel G.; Hari, Anirudh; Zhu, Li; Chen, Bo; Cody, George D.; Romi, Sebastiano; Zhang, Dongzhou; Strobel, Timothy A. Double-core nanothread formation from α-furil <i>via</i> a pressure-induced planarization pathway. Chemical science, 2025, 16, 4144-4151 |
| 1573843 | CIF | Hg3 N2 O16 Te4 | P n m a | 9.2209; 8.3046; 19.3943 90; 90; 90 | 1485.14 | Tang, Ru-Ling; Lv, Yi-Lei; Ma, Liang; Miao, Bing-Wei; Liu, Wenlong; Guo, Sheng-Ping "All-four-in-one": a novel mercury tellurite-nitrate Hg<sub>3</sub>(TeO<sub>3</sub>)(Te<sub>3</sub>O<sub>7</sub>)(NO<sub>3</sub>)<sub>2</sub> exhibiting exceptional optical anisotropy. Chemical science, 2025, 16, 4749-4754 |
| 1573844 | CIF | C18 H20 O7 | P 1 21 1 | 7.2202; 13.9741; 9.0021 90; 111.683; 90 | 844.01 | Paciorek, Jan; Steinborn, Christian; Gordiy, Igor; Plangger, Immanuel; Schmutzler, Dirk; Barber, David M.; Wurst, Klaus; Riniker, Sereina; Magauer, Thomas Asymmetric total synthesis of glauconic and glaucanic acid. Chemical science, 2025, 16, 4159-4166 |
| 1573846 | CIF | C57 H68 Br Cu N4 | P -1 | 12.3872; 15.6834; 16.433 90.934; 111.881; 110.488 | 2735.3 | Zhou, Jiajing; Zhang, Zhiqiang; Cao, Yan; Xie, Weilong Multiligand-enabled, copper-catalyzed Hiyama coupling of arylsilanes with unactivated secondary alkyl halides: reaction development and mechanistic insights. Chemical science, 2025, 16, 5109-5117 |
| 1573847 | CIF | C23 H21 B3 N2 O3 | P b c a | 6.81856; 18.79523; 32.85532 90; 90; 90 | 4210.62 | Procter, Richard J.; Alamillo-Ferrer, Carla; Shabbir, Usman; Britton, Phyllida; Bučar, Dejan-Krešimir; Dumon, Alexandre S.; Rzepa, Henry S.; Burés, Jordi; Whiting, Andrew; Sheppard, Tom D. Borate-catalysed direct amidation reactions of coordinating substrates. Chemical science, 2025, 16, 4718-4724 |
| 1573849 | CIF | C10 H11 N3 O3 S | P b c n | 7.2257; 13.4248; 24.382 90; 90; 90 | 2365.1 | Lu, Jiachen; Ok, Kang Min Synergistic engineering of ultraviolet metal-free crystals with exceptional birefringence <i>via</i> pyridine-derived dimers. Chemical science, 2025, 16, 4703-4709 |
| 1573850 | CIF | C15 H15 N3 O5 S | P 1 21/c 1 | 17.5972; 7.0455; 12.8268 90; 90.881; 90 | 1590.09 | Lu, Jiachen; Ok, Kang Min Synergistic engineering of ultraviolet metal-free crystals with exceptional birefringence <i>via</i> pyridine-derived dimers. Chemical science, 2025, 16, 4703-4709 |
| 1573851 | CIF | C122 H170 Mg4 N8 P8 | P 1 21/c 1 | 26.4049; 18.7396; 27.4993 90; 118.57; 90 | 11950.2 | Thum, Stefan; Townrow, Oliver P. E.; Langer, Jens; Harder, Sjoerd Tuning the selectivity of P<sub>4</sub> reduction at alkaline-earth metal centres. Chemical science, 2025, 16, 4528-4536 |
| 1573852 | CIF | C74 H114 Mg2 N4 P4 | P n m a | 26.1211; 21.8425; 12.8482 90; 90; 90 | 7330.5 | Thum, Stefan; Townrow, Oliver P. E.; Langer, Jens; Harder, Sjoerd Tuning the selectivity of P<sub>4</sub> reduction at alkaline-earth metal centres. Chemical science, 2025, 16, 4528-4536 |
| 1573853 | CIF | C90 H154 Ca2 N4 O4 P4 | P 1 21/c 1 | 13.4588; 23.0603; 15.7858 90; 111.861; 90 | 4547.04 | Thum, Stefan; Townrow, Oliver P. E.; Langer, Jens; Harder, Sjoerd Tuning the selectivity of P<sub>4</sub> reduction at alkaline-earth metal centres. Chemical science, 2025, 16, 4528-4536 |
| 1573854 | CIF | C97 H146 B2 Ca2 N4 | P -1 | 12.7375; 16.5295; 21.8122 106.025; 90.612; 98.438 | 4359.87 | Thum, Stefan; Townrow, Oliver P. E.; Langer, Jens; Harder, Sjoerd Tuning the selectivity of P<sub>4</sub> reduction at alkaline-earth metal centres. Chemical science, 2025, 16, 4528-4536 |
| 1573855 | CIF | C131 H211 Ca3 N6 O4 P7 | P -1 | 20.4699; 20.4809; 21.4594 70.084; 81.755; 64.564 | 7638.6 | Thum, Stefan; Townrow, Oliver P. E.; Langer, Jens; Harder, Sjoerd Tuning the selectivity of P<sub>4</sub> reduction at alkaline-earth metal centres. Chemical science, 2025, 16, 4528-4536 |
| 1573868 | CIF | C25 H10 Cl10 N | P -1 | 8.305; 8.8068; 19.111 97.232; 96.934; 95.16 | 1368.7 | Gao, Shengxiang; Wu, Chunxiao; Zhang, Ming; Li, Feng Stable luminescent diphenylamine biphenylmethyl radicals with α-type D<sub>0</sub> → D<sub>1</sub> transition and antiferromagnetic properties. Chemical science, 2025, 16, 4668-4675 |
| 1573869 | CIF | C25 H14 Cl6 N | P 1 21/c 1 | 16.4717; 8.3566; 17.0028 90; 103.423; 90 | 2276.5 | Gao, Shengxiang; Wu, Chunxiao; Zhang, Ming; Li, Feng Stable luminescent diphenylamine biphenylmethyl radicals with α-type D<sub>0</sub> → D<sub>1</sub> transition and antiferromagnetic properties. Chemical science, 2025, 16, 4668-4675 |
| 1573870 | CIF | C7 H2.4 O6.2 V | I m m a | 16.342; 6.8717; 10.284 90; 90; 90 | 1154.9 | Smoljan, Courtney S.; Formalik, Filip; Barsoum, Michael L.; Fahy, Kira M.; Gaidimas, Madeleine A.; Son, Florencia A.; Xie, Haomiao; Idrees, Karam B.; Farha, Omar K.; Snurr, Randall Q. Exceeding flexpectations: a combined experimental and computational investigation of structural flexibility in 3-dimensional linker-based metal-organic frameworks. Chemical science, 2025, 16, 4831-4841 |
| 1573879 | CIF | C48 H68 N2 Ni S4 | P -1 | 8.8358; 9.0954; 14.2686 94.49; 97.731; 97.231 | 1121.94 | Luff, Martin S.; Filipovic, Tin M.; Corsei, Celine S.; Oppel, Kai; Krummenacher, Ivo; Bertermann, Rüdiger; Finze, Maik; Braunschweig, Holger; Radius, Udo Azolium-2-dithiocarboxylates as redox active ligands in nickel chemistry. Chemical science, 2025, 16, 5142-5154 |
| 1573880 | CIF | C11 H12 Cl2 N2 S2 | P n m a | 14.5441; 6.8348; 13.3132 90; 90; 90 | 1323.41 | Luff, Martin S.; Filipovic, Tin M.; Corsei, Celine S.; Oppel, Kai; Krummenacher, Ivo; Bertermann, Rüdiger; Finze, Maik; Braunschweig, Holger; Radius, Udo Azolium-2-dithiocarboxylates as redox active ligands in nickel chemistry. Chemical science, 2025, 16, 5142-5154 |
| 1573881 | CIF | C64 H88 N4 Ni O2 S4 | P 1 21/n 1 | 10.3602; 22.0224; 13.6369 90; 91.721; 90 | 3109.94 | Luff, Martin S.; Filipovic, Tin M.; Corsei, Celine S.; Oppel, Kai; Krummenacher, Ivo; Bertermann, Rüdiger; Finze, Maik; Braunschweig, Holger; Radius, Udo Azolium-2-dithiocarboxylates as redox active ligands in nickel chemistry. Chemical science, 2025, 16, 5142-5154 |
| 1573882 | CIF | C39 H63 N5 Ni S2 | P 1 21/c 1 | 14.4786; 13.8664; 19.8298 90; 94.856; 90 | 3966.86 | Luff, Martin S.; Filipovic, Tin M.; Corsei, Celine S.; Oppel, Kai; Krummenacher, Ivo; Bertermann, Rüdiger; Finze, Maik; Braunschweig, Holger; Radius, Udo Azolium-2-dithiocarboxylates as redox active ligands in nickel chemistry. Chemical science, 2025, 16, 5142-5154 |
| 1573883 | CIF | C14 H18 N2 S2 | P 1 21/n 1 | 11.8352; 8.4874; 15.0477 90; 107.19; 90 | 1444.02 | Luff, Martin S.; Filipovic, Tin M.; Corsei, Celine S.; Oppel, Kai; Krummenacher, Ivo; Bertermann, Rüdiger; Finze, Maik; Braunschweig, Holger; Radius, Udo Azolium-2-dithiocarboxylates as redox active ligands in nickel chemistry. Chemical science, 2025, 16, 5142-5154 |
| 1573884 | CIF | C44 H66 N6 Ni O S2 | P 21 21 21 | 12.6464; 14.4357; 24.9817 90; 90; 90 | 4560.65 | Luff, Martin S.; Filipovic, Tin M.; Corsei, Celine S.; Oppel, Kai; Krummenacher, Ivo; Bertermann, Rüdiger; Finze, Maik; Braunschweig, Holger; Radius, Udo Azolium-2-dithiocarboxylates as redox active ligands in nickel chemistry. Chemical science, 2025, 16, 5142-5154 |
| 1573885 | CIF | C62 H66 N4 Ni S4 | P 1 21/c 1 | 16.3996; 12.5018; 14.1711 90; 101.833; 90 | 2843.68 | Luff, Martin S.; Filipovic, Tin M.; Corsei, Celine S.; Oppel, Kai; Krummenacher, Ivo; Bertermann, Rüdiger; Finze, Maik; Braunschweig, Holger; Radius, Udo Azolium-2-dithiocarboxylates as redox active ligands in nickel chemistry. Chemical science, 2025, 16, 5142-5154 |
| 1573886 | CIF | C52 H74 N6 Ni S2 | P -1 | 12.2463; 13.0402; 18.3208 84.384; 76.105; 64.184 | 2556.58 | Luff, Martin S.; Filipovic, Tin M.; Corsei, Celine S.; Oppel, Kai; Krummenacher, Ivo; Bertermann, Rüdiger; Finze, Maik; Braunschweig, Holger; Radius, Udo Azolium-2-dithiocarboxylates as redox active ligands in nickel chemistry. Chemical science, 2025, 16, 5142-5154 |
| 1573887 | CIF | C116 H176 N24 Ni4 O S8 | R -3 :H | 41.9148; 41.9148; 19.7374 90; 90; 120 | 30030 | Luff, Martin S.; Filipovic, Tin M.; Corsei, Celine S.; Oppel, Kai; Krummenacher, Ivo; Bertermann, Rüdiger; Finze, Maik; Braunschweig, Holger; Radius, Udo Azolium-2-dithiocarboxylates as redox active ligands in nickel chemistry. Chemical science, 2025, 16, 5142-5154 |
| 1573888 | CIF | C68 H96 K N4 Ni O3 S4 | P 21 21 21 | 12.2516; 19.8503; 27.2496 90; 90; 90 | 6627.05 | Luff, Martin S.; Filipovic, Tin M.; Corsei, Celine S.; Oppel, Kai; Krummenacher, Ivo; Bertermann, Rüdiger; Finze, Maik; Braunschweig, Holger; Radius, Udo Azolium-2-dithiocarboxylates as redox active ligands in nickel chemistry. Chemical science, 2025, 16, 5142-5154 |
| 1573889 | CIF | C54 H86 K N2 Ni O3 S4 | P 1 21/n 1 | 11.042; 30.096; 34.2823 90; 96.44; 90 | 11320.8 | Luff, Martin S.; Filipovic, Tin M.; Corsei, Celine S.; Oppel, Kai; Krummenacher, Ivo; Bertermann, Rüdiger; Finze, Maik; Braunschweig, Holger; Radius, Udo Azolium-2-dithiocarboxylates as redox active ligands in nickel chemistry. Chemical science, 2025, 16, 5142-5154 |
| 1573890 | CIF | C136 H150 Al8 Dy2 N16 Na2 O67 | P 4 n c | 17.1664; 17.1664; 15.3325 90; 90; 90 | 4518.3 | Yan, Han; Calado, Claudia M. S.; Wang, Hao; Murugesu, Muralee; Sun, Wen-Bin A novel Ln<sup>3+</sup>/Al<sup>3+</sup> metallacrown multifunctional material for latent fingerprint detection, luminescent thermometers and luminescent sensors. Chemical science, 2025, 16, 4821-4830 |
| 1573891 | CIF | C38 H26 F8 N2 O2 | P -1 | 9.4208; 9.893; 9.9488 87.466; 62.402; 89.609 | 820.83 | Górski, Krzysztof; Shelton, Steve; Lingagouder, Jaijanarthanan; Data, Przemyslaw; Jacquemin, Denis; Gryko, Daniel T. 1,4-Dihydropyrrolo[3,2-<i>b</i>]pyrrole modified with dibenzoxazepine: a highly efficient core for charge-transfer-based OLED emitters. Chemical science, 2025, 16, 5223-5233 |
| 1573902 | CIF | C56 H72 Au2 N4 | P -1 | 9.3309; 12.6622; 14.2997 72.396; 72.255; 82.124 | 1531.89 | Cayuela-Castillo, Juan; Fernández-de-Córdova, Francisco J; See, Matthew S.; Fernández, Israel; Ríos, Pablo Stepwise alkyne insertion in Au(i) acetylides: influence of the nuclearity. Chemical science, 2025, 16, 4684-4694 |
| 1573903 | CIF | C32.5 H42 Au N4 S | P 1 21/n 1 | 10.7024; 27.593; 12.0247 90; 92.657; 90 | 3547.2 | Cayuela-Castillo, Juan; Fernández-de-Córdova, Francisco J; See, Matthew S.; Fernández, Israel; Ríos, Pablo Stepwise alkyne insertion in Au(i) acetylides: influence of the nuclearity. Chemical science, 2025, 16, 4684-4694 |
| 1573904 | CIF | C72 H108 Au2 N4 O4 | P 1 21/n 1 | 12.7986; 15.2227; 18.1384 90; 101.827; 90 | 3458.9 | Cayuela-Castillo, Juan; Fernández-de-Córdova, Francisco J; See, Matthew S.; Fernández, Israel; Ríos, Pablo Stepwise alkyne insertion in Au(i) acetylides: influence of the nuclearity. Chemical science, 2025, 16, 4684-4694 |
| 1573905 | CIF | C32 H45 Au N2 Si | P -1 | 9.0241; 12.0583; 15.9337 80.824; 89.441; 78.132 | 1674.58 | Cayuela-Castillo, Juan; Fernández-de-Córdova, Francisco J; See, Matthew S.; Fernández, Israel; Ríos, Pablo Stepwise alkyne insertion in Au(i) acetylides: influence of the nuclearity. Chemical science, 2025, 16, 4684-4694 |
| 1573906 | CIF | C48 H55 Au N2 O4 | P 1 21/n 1 | 18.4242; 13.8027; 18.9461 90; 109.094; 90 | 4553 | Cayuela-Castillo, Juan; Fernández-de-Córdova, Francisco J; See, Matthew S.; Fernández, Israel; Ríos, Pablo Stepwise alkyne insertion in Au(i) acetylides: influence of the nuclearity. Chemical science, 2025, 16, 4684-4694 |
| 1573907 | CIF | C150 H178 Au4 N8 O4 | P -1 | 13.4415; 29.354; 36.128 93.781; 94.261; 100.703 | 13922 | Cayuela-Castillo, Juan; Fernández-de-Córdova, Francisco J; See, Matthew S.; Fernández, Israel; Ríos, Pablo Stepwise alkyne insertion in Au(i) acetylides: influence of the nuclearity. Chemical science, 2025, 16, 4684-4694 |
| 1573908 | CIF | C38 H51 Au N2 O4 Si | P 1 21/n 1 | 12.7366; 15.5654; 19.9574 90; 92.718; 90 | 3952.1 | Cayuela-Castillo, Juan; Fernández-de-Córdova, Francisco J; See, Matthew S.; Fernández, Israel; Ríos, Pablo Stepwise alkyne insertion in Au(i) acetylides: influence of the nuclearity. Chemical science, 2025, 16, 4684-4694 |
| 1573909 | CIF | C62 H78 Au2 N4 O4 | P c c a | 36.539; 12.2149; 29.581 90; 90; 90 | 13202.6 | Cayuela-Castillo, Juan; Fernández-de-Córdova, Francisco J; See, Matthew S.; Fernández, Israel; Ríos, Pablo Stepwise alkyne insertion in Au(i) acetylides: influence of the nuclearity. Chemical science, 2025, 16, 4684-4694 |
| 1573910 | CIF | C84 H108 Au3 F3 N6 O3 S | P 1 21/n 1 | 16.3416; 20.8456; 30.6473 90; 100.38; 90 | 10269.2 | Cayuela-Castillo, Juan; Fernández-de-Córdova, Francisco J; See, Matthew S.; Fernández, Israel; Ríos, Pablo Stepwise alkyne insertion in Au(i) acetylides: influence of the nuclearity. Chemical science, 2025, 16, 4684-4694 |
| 1573911 | CIF | C15 H13 Cl2 N3 O2 S | P 1 21/c 1 | 15.203; 14.457; 7.3056 90; 95.595; 90 | 1598 | Datta, Paramita; Maji, Subir; Biswas, Prativa; Jain, Divya; Dey, Partha Protim; Mandal, Swadhin K. An organophotocatalytic redox-neutral strategy for late-stage drug functionalization with SO<sub>2</sub> gas. Chemical science, 2025, 16, 5064-5075 |
| 1573912 | CIF | C11 H13 N O2 S | P 1 21/n 1 | 9.744; 8.942; 12.444 90; 99.429; 90 | 1069.6 | Datta, Paramita; Maji, Subir; Biswas, Prativa; Jain, Divya; Dey, Partha Protim; Mandal, Swadhin K. An organophotocatalytic redox-neutral strategy for late-stage drug functionalization with SO<sub>2</sub> gas. Chemical science, 2025, 16, 5064-5075 |
| 1573913 | CIF | C19 H21 B N2 O4 S | P 1 21/c 1 | 10.87; 7.36; 24.2055 90; 102.98; 90 | 1887 | Datta, Paramita; Maji, Subir; Biswas, Prativa; Jain, Divya; Dey, Partha Protim; Mandal, Swadhin K. An organophotocatalytic redox-neutral strategy for late-stage drug functionalization with SO<sub>2</sub> gas. Chemical science, 2025, 16, 5064-5075 |
| 1573914 | CIF | C24 H26 O4 S | P 21 21 21 | 6.1887; 15.3738; 21.416 90; 90; 90 | 2037.6 | Datta, Paramita; Maji, Subir; Biswas, Prativa; Jain, Divya; Dey, Partha Protim; Mandal, Swadhin K. An organophotocatalytic redox-neutral strategy for late-stage drug functionalization with SO<sub>2</sub> gas. Chemical science, 2025, 16, 5064-5075 |
| 1573915 | CIF | C14 H12 O5 S | P -1 | 8.5144; 11.3398; 13.7819 91.78; 101.702; 90.986 | 1302 | Datta, Paramita; Maji, Subir; Biswas, Prativa; Jain, Divya; Dey, Partha Protim; Mandal, Swadhin K. An organophotocatalytic redox-neutral strategy for late-stage drug functionalization with SO<sub>2</sub> gas. Chemical science, 2025, 16, 5064-5075 |
| 1573916 | CIF | C16 H20 N6 O2 S2 | P 1 21/c 1 | 7.0417; 21.4946; 12.9761 90; 104.119; 90 | 1904.71 | Datta, Paramita; Maji, Subir; Biswas, Prativa; Jain, Divya; Dey, Partha Protim; Mandal, Swadhin K. An organophotocatalytic redox-neutral strategy for late-stage drug functionalization with SO<sub>2</sub> gas. Chemical science, 2025, 16, 5064-5075 |
| 1573917 | CIF | C18 H20 N2 O4 S | P 1 21/c 1 | 11.72; 13.2505; 11.8575 90; 111.107; 90 | 1717.9 | Datta, Paramita; Maji, Subir; Biswas, Prativa; Jain, Divya; Dey, Partha Protim; Mandal, Swadhin K. An organophotocatalytic redox-neutral strategy for late-stage drug functionalization with SO<sub>2</sub> gas. Chemical science, 2025, 16, 5064-5075 |
| 1573918 | CIF | C23 H20 Cl N3 O3 S | P b c a | 16.5203; 11.144; 23.4626 90; 90; 90 | 4319.52 | Datta, Paramita; Maji, Subir; Biswas, Prativa; Jain, Divya; Dey, Partha Protim; Mandal, Swadhin K. An organophotocatalytic redox-neutral strategy for late-stage drug functionalization with SO<sub>2</sub> gas. Chemical science, 2025, 16, 5064-5075 |
| 1573919 | CIF | C17 H17 Cl N O3 S | P 1 21/c 1 | 11.096; 10.649; 14.752 90; 107.211; 90 | 1665.1 | Datta, Paramita; Maji, Subir; Biswas, Prativa; Jain, Divya; Dey, Partha Protim; Mandal, Swadhin K. An organophotocatalytic redox-neutral strategy for late-stage drug functionalization with SO<sub>2</sub> gas. Chemical science, 2025, 16, 5064-5075 |
| 1573920 | CIF | C47 H46 N3 O10 S2 | P -1 | 9.952; 12.022; 18.755 78.612; 77.456; 84.925 | 2144.8 | Datta, Paramita; Maji, Subir; Biswas, Prativa; Jain, Divya; Dey, Partha Protim; Mandal, Swadhin K. An organophotocatalytic redox-neutral strategy for late-stage drug functionalization with SO<sub>2</sub> gas. Chemical science, 2025, 16, 5064-5075 |
| 1573921 | CIF | C17 H18 N3 O2 S2 | P 1 21/n 1 | 13.3042; 15.8775; 16.5955 90; 110.243; 90 | 3289.1 | Datta, Paramita; Maji, Subir; Biswas, Prativa; Jain, Divya; Dey, Partha Protim; Mandal, Swadhin K. An organophotocatalytic redox-neutral strategy for late-stage drug functionalization with SO<sub>2</sub> gas. Chemical science, 2025, 16, 5064-5075 |
| 1573924 | CIF | C270 H210 N30 O18 Zn3 | P 63/m | 26.4305; 26.4305; 28.419 90; 90; 120 | 17192.9 | Xu, Ziwei; Ying, Xinwen; Li, Yi; Dong, Xiaoyan; Liu, Jiyong; Wang, Shuping; Little, Marc A.; Zhang, Dahao; Xie, Yongshu; Zhang, Zibin; Yu, Ling; Huang, Feihe; Li, Shijun Template-directed self-assembly of porphyrin nanorings through an imine condensation reaction. Chemical science, 2025, 16, 5166-5173 |
| 1573927 | CIF | C20 H21 F2 N O3 | P 1 21/c 1 | 10.45569; 18.57018; 10.44754 90; 115.809; 90 | 1826.19 | Fu, Hong; Wang, Zuo-Shuai; Li, Si-Jia; Zhu, Lin-Yuan; Wang, Xiao-Jian; Wang, Hong-Chen; Han, Bing Photocatalytic 1,3-difluoroalkylcarboxylation of alkenes by triple kinetic-controlled radical self-ordering. Chemical science, 2025, 16, 5849-5856 |
| 1573928 | CIF | C22 H23 F2 N O3 | P -1 | 9.938; 10.9753; 11.084 108.444; 102.977; 113.996 | 956.77 | Fu, Hong; Wang, Zuo-Shuai; Li, Si-Jia; Zhu, Lin-Yuan; Wang, Xiao-Jian; Wang, Hong-Chen; Han, Bing Photocatalytic 1,3-difluoroalkylcarboxylation of alkenes by triple kinetic-controlled radical self-ordering. Chemical science, 2025, 16, 5849-5856 |
| 1573929 | CIF | C47 H70 F3 Gd N6 O20 S | P 1 21/c 1 | 16.8352; 17.2648; 18.6772 90; 94.3; 90 | 5413.37 | Bodman, Samantha E.; Stachelek, Patrycja; Rehman, Umatur; Plasser, Felix; Pal, Robert; Butler, Stephen J. A switch-on luminescent europium(iii) probe for selective and time-resolved detection of adenosine diphosphate (ADP). Chemical science, 2025, 16, 5602-5612 |
| 1573930 | CIF | C22 H19 Cl O | P b c a | 11.8872; 10.1609; 28.5346 90; 90; 90 | 3446.5 | Wang, Yue; Miao, Junhao; Dong, Honglin; Zhang, Dongliang; Chen, Bei; Guan, Meihui; Zhang, Ge; Zhang, Qian A photo- and cobalt-catalyzed highly selective and divergent hydrofunctionalization of 1,3-dienes with phenols. Chemical science, 2025, 16, 5640-5650 |
| 1573931 | CIF | C69 H37.5 Au B F20 N4.5 | P 1 21/c 1 | 29.74; 16.255; 24.079 90; 98.901; 90 | 11500 | Haketa, Yohei; Nakajima, Ryoya; Maruyama, Yuto; Tanaka, Hiroki; Choi, Wookjin; Seki, Shu; Sato, Shunsuke; Baba, Hitomi; Ishii, Yoshiki; Watanabe, Go; Bulgarevich, Kirill; Takimiya, Kazuo; Deguchi, Kenzo; Ohki, Shinobu; Hashi, Kenjiro; Nakanishi, Takashi; Ishibashi, Yukihide; Asahi, Tsuyoshi; Ohta, Kazuchika; Maeda, Hiromitsu Electrically conductive charge-segregated pseudo-polymorphs comprising highly planar expanded π-electronic cations. Chemical science, 2025, 16, 4998-5006 |
| 1573932 | CIF | C46 H20 Au N9 | P b c a | 7.2275; 29.8407; 30.6964 90; 90; 90 | 6620.4 | Haketa, Yohei; Nakajima, Ryoya; Maruyama, Yuto; Tanaka, Hiroki; Choi, Wookjin; Seki, Shu; Sato, Shunsuke; Baba, Hitomi; Ishii, Yoshiki; Watanabe, Go; Bulgarevich, Kirill; Takimiya, Kazuo; Deguchi, Kenzo; Ohki, Shinobu; Hashi, Kenjiro; Nakanishi, Takashi; Ishibashi, Yukihide; Asahi, Tsuyoshi; Ohta, Kazuchika; Maeda, Hiromitsu Electrically conductive charge-segregated pseudo-polymorphs comprising highly planar expanded π-electronic cations. Chemical science, 2025, 16, 4998-5006 |
| 1573933 | CIF | C60 H20 Au B F20 N4 | P n n a | 7.6381; 27.9614; 28.9791 90; 90; 90 | 6189.1 | Haketa, Yohei; Nakajima, Ryoya; Maruyama, Yuto; Tanaka, Hiroki; Choi, Wookjin; Seki, Shu; Sato, Shunsuke; Baba, Hitomi; Ishii, Yoshiki; Watanabe, Go; Bulgarevich, Kirill; Takimiya, Kazuo; Deguchi, Kenzo; Ohki, Shinobu; Hashi, Kenjiro; Nakanishi, Takashi; Ishibashi, Yukihide; Asahi, Tsuyoshi; Ohta, Kazuchika; Maeda, Hiromitsu Electrically conductive charge-segregated pseudo-polymorphs comprising highly planar expanded π-electronic cations. Chemical science, 2025, 16, 4998-5006 |
| 1573934 | CIF | C80 H54 Au B F24 N6 | C 1 2/c 1 | 35.803; 21.342; 20.798 90; 116.122; 90 | 14269 | Haketa, Yohei; Nakajima, Ryoya; Maruyama, Yuto; Tanaka, Hiroki; Choi, Wookjin; Seki, Shu; Sato, Shunsuke; Baba, Hitomi; Ishii, Yoshiki; Watanabe, Go; Bulgarevich, Kirill; Takimiya, Kazuo; Deguchi, Kenzo; Ohki, Shinobu; Hashi, Kenjiro; Nakanishi, Takashi; Ishibashi, Yukihide; Asahi, Tsuyoshi; Ohta, Kazuchika; Maeda, Hiromitsu Electrically conductive charge-segregated pseudo-polymorphs comprising highly planar expanded π-electronic cations. Chemical science, 2025, 16, 4998-5006 |
| 1573935 | CIF | C70.67 H36 Au B Cl4 F24 N4 | C 1 2/c 1 | 25.853; 37.935; 20.488 90; 90.017; 90 | 20093 | Haketa, Yohei; Nakajima, Ryoya; Maruyama, Yuto; Tanaka, Hiroki; Choi, Wookjin; Seki, Shu; Sato, Shunsuke; Baba, Hitomi; Ishii, Yoshiki; Watanabe, Go; Bulgarevich, Kirill; Takimiya, Kazuo; Deguchi, Kenzo; Ohki, Shinobu; Hashi, Kenjiro; Nakanishi, Takashi; Ishibashi, Yukihide; Asahi, Tsuyoshi; Ohta, Kazuchika; Maeda, Hiromitsu Electrically conductive charge-segregated pseudo-polymorphs comprising highly planar expanded π-electronic cations. Chemical science, 2025, 16, 4998-5006 |
| 1573936 | CIF | C48 H40 O12 P4 Te2 | P -1 | 9.41547; 10.53235; 23.2502 93.7232; 99.2727; 91.1692 | 2269.61 | Xue, Miaomiao; Ye, Guigui; Zhang, Lei; Dong, Qiang; Lee, Chun-Sing; Li, Zhen; Zhang, Qichun Preparation, single-crystal structure and room-temperature phosphorescence of a covalent organic polymer containing Te-O-P bonds. Chemical science, 2025, 16, 5260-5265 |
| 1573937 | CIF | C38 H38 N2 O2 | P 1 21/n 1 | 13.536; 5.5532; 21.084 90; 92.725; 90 | 1583.1 | Zhao, Zhenxiang; Wang, Senhao; Shi, Xiaomei; Fu, Hongbing; Wang, Long Multiple effects of aromatic substituents on excited-state properties and singlet fission process in azaquinodimethane systems. Chemical science, 2025, 16, 5565-5572 |
| 1573938 | CIF | C34 H34 N2 O2 S2 | P -1 | 11.0327; 12.2831; 24.7672 77.396; 89.959; 64.379 | 2936.6 | Zhao, Zhenxiang; Wang, Senhao; Shi, Xiaomei; Fu, Hongbing; Wang, Long Multiple effects of aromatic substituents on excited-state properties and singlet fission process in azaquinodimethane systems. Chemical science, 2025, 16, 5565-5572 |
| 1573939 | CIF | C30 H24 N2 O | C 1 2/c 1 | 39.3453; 6.1691; 22.6081 90; 116.888; 90 | 4894.3 | Liao, Huijuan; Dong, Jianyang; Zhou, Xuechen; Jiang, Qin; Lv, Zishan; Lei, Fang; Xue, Dong Silver-mediated formal [4π + 2<i>σ</i>] cycloaddition reactions of bicyclobutanes with nitrile imines: access to 2,3-diazobicyclo[3.1.1]heptenes. Chemical science, 2025, 16, 4654-4660 |
| 1573940 | CIF | C54 H60.7 Cu F6 N4.4 O6.55 P | P -1 | 11.8395; 14.4553; 15.7362 70.349; 82.732; 88.868 | 2515.2 | Saeednia, Borna; Sragow, Aria M.; Lin, Yannan; Sheehan, Colton J.; Metlay, Amy S.; Gau, Michael R.; Dye, Samantha A.; O'Konski, Sarah P; Mallouk, Thomas E.; Dmochowski, Ivan J. Unusually air-stable copper(i) complexes showing high selectivity for carbon monoxide. Chemical science, 2025, 16, 5058-5063 |
| 1573941 | CIF | C62 H69.5 Cu F6 N7.5 O12.5 S2 | P 21 21 21 | 15.4717; 18.0548; 22.9196 90; 90; 90 | 6402.3 | Saeednia, Borna; Sragow, Aria M.; Lin, Yannan; Sheehan, Colton J.; Metlay, Amy S.; Gau, Michael R.; Dye, Samantha A.; O'Konski, Sarah P; Mallouk, Thomas E.; Dmochowski, Ivan J. Unusually air-stable copper(i) complexes showing high selectivity for carbon monoxide. Chemical science, 2025, 16, 5058-5063 |
| 1573942 | CIF | C56 H61 Cu F3 N8 O9 S | P 1 21/c 1 | 18.0509; 16.2265; 20.4026 90; 115.111; 90 | 5411.2 | Saeednia, Borna; Sragow, Aria M.; Lin, Yannan; Sheehan, Colton J.; Metlay, Amy S.; Gau, Michael R.; Dye, Samantha A.; O'Konski, Sarah P; Mallouk, Thomas E.; Dmochowski, Ivan J. Unusually air-stable copper(i) complexes showing high selectivity for carbon monoxide. Chemical science, 2025, 16, 5058-5063 |
| 1573948 | CIF | C10 H16 Ca N2 O10 S2 | P -1 | 6.986; 11.274; 11.59 67.534; 89.112; 88.67 | 843.3 | Xu, Longyun; Li, Conggang; Li, Shuaifeng; Zhao, Huijian; Kong, Xianghao; Qu, Zaixin; Feng, Wenjie; Xu, Kaidong; Ye, Ning; Hu, Zhanggui Hydrogen bonding regulation-oriented design of pyridine sulfonate as a promising UV birefringent crystal characterized by enhanced structural anisotropy. Chemical science, 2025, 16, 5186-5193 |
| 1573949 | CIF | C41 H48 Cr F9 N12 O9 S3 | P 1 21/c 1 | 21.2505; 11.5885; 20.6086 90; 92.21; 90 | 5071.3 | Ye, Yating; Poncet, Maxime; Yaltseva, Polina; Salcedo-Abraira, Pablo; Rodríguez-Diéguez, Antonio; Martín, Javier Heredia; Cuevas-Contreras, Laura; Cruz, Carlos M.; Doistau, Benjamin; Piguet, Claude; Wenger, Oliver S.; Herrera, Juan Manuel; Jiménez, Juan-Ramón Modulating the spin-flip rates and emission energies through ligand design in chromium(iii) molecular rubies. Chemical science, 2025, 16, 5205-5213 |
| 1573950 | CIF | C45 H54 Cr F9 N10 O19 S3 | P n a 21 | 24.8078; 21.0257; 11.4987 90; 90; 90 | 5997.7 | Ye, Yating; Poncet, Maxime; Yaltseva, Polina; Salcedo-Abraira, Pablo; Rodríguez-Diéguez, Antonio; Martín, Javier Heredia; Cuevas-Contreras, Laura; Cruz, Carlos M.; Doistau, Benjamin; Piguet, Claude; Wenger, Oliver S.; Herrera, Juan Manuel; Jiménez, Juan-Ramón Modulating the spin-flip rates and emission energies through ligand design in chromium(iii) molecular rubies. Chemical science, 2025, 16, 5205-5213 |
| 1573951 | CIF | C43 H51 Cr F9 I4 N11 O10 S3 | P 1 21/n 1 | 11.8195; 22.8812; 22.7016 90; 100.664; 90 | 6033.5 | Ye, Yating; Poncet, Maxime; Yaltseva, Polina; Salcedo-Abraira, Pablo; Rodríguez-Diéguez, Antonio; Martín, Javier Heredia; Cuevas-Contreras, Laura; Cruz, Carlos M.; Doistau, Benjamin; Piguet, Claude; Wenger, Oliver S.; Herrera, Juan Manuel; Jiménez, Juan-Ramón Modulating the spin-flip rates and emission energies through ligand design in chromium(iii) molecular rubies. Chemical science, 2025, 16, 5205-5213 |
| 1573953 | CIF | C41 H26 N4 O | P -1 | 10.327; 11.0712; 13.0992 93.047; 92.234; 102.161 | 1460.1 | Chu, Lizhi; Ma, Chenglin; Zhang, Li; Zhou, Yannan; Song, Jingru; Sun, Qikun; Zhang, Shi-Tong; Yang, Wenjun; Xue, Shanfeng Multifunctional oxadiazole-based ultraviolet-emitting materials used as hosts for multicolor phosphorescence. Chemical science, 2025, 16, 5252-5259 |
| 1573954 | CIF | C41 H26 N4 O | P 1 21/n 1 | 5.505; 19.8183; 27.3727 90; 95.443; 90 | 2972.89 | Chu, Lizhi; Ma, Chenglin; Zhang, Li; Zhou, Yannan; Song, Jingru; Sun, Qikun; Zhang, Shi-Tong; Yang, Wenjun; Xue, Shanfeng Multifunctional oxadiazole-based ultraviolet-emitting materials used as hosts for multicolor phosphorescence. Chemical science, 2025, 16, 5252-5259 |
| 1573955 | CIF | C32 H21 N3 O | C 1 2/c 1 | 53.653; 9.11; 11.0235 90; 95.524; 90 | 5363 | Chu, Lizhi; Ma, Chenglin; Zhang, Li; Zhou, Yannan; Song, Jingru; Sun, Qikun; Zhang, Shi-Tong; Yang, Wenjun; Xue, Shanfeng Multifunctional oxadiazole-based ultraviolet-emitting materials used as hosts for multicolor phosphorescence. Chemical science, 2025, 16, 5252-5259 |
| 1573956 | CIF | C16 H18 F4 I4 N8 Pb | P n m a | 12.9388; 30.291; 6.6444 90; 90; 90 | 2604.1 | Maufort, Arthur; Van Landeghem, Melissa; Deutsch, Maxime; Banks, Peter; La Magna, Paola; Van Hecke, Kristof; Cerdá, Jesús; Lutsen, Laurence; Vanderzande, Dirk; Quarti, Claudio; Beljonne, David; Pillet, Sébastien; Vandewal, Koen; Van Gompel, Wouter T. M. Structural rigidity, thermochromism and piezochromism of layered hybrid perovskites containing an interdigitated organic bilayer. Chemical science, 2025, 16, 5662-5675 |
| 1573957 | CIF | C16 H18 F4 I4 N8 Pb | P n m a | 12.8444; 29.723; 6.5815 90; 90; 90 | 2512.6 | Maufort, Arthur; Van Landeghem, Melissa; Deutsch, Maxime; Banks, Peter; La Magna, Paola; Van Hecke, Kristof; Cerdá, Jesús; Lutsen, Laurence; Vanderzande, Dirk; Quarti, Claudio; Beljonne, David; Pillet, Sébastien; Vandewal, Koen; Van Gompel, Wouter T. M. Structural rigidity, thermochromism and piezochromism of layered hybrid perovskites containing an interdigitated organic bilayer. Chemical science, 2025, 16, 5662-5675 |
| 1573958 | CIF | C16 H18 F4 I4 N8 Pb | P n m a | 12.4841; 27.931; 6.2972 90; 90; 90 | 2195.8 | Maufort, Arthur; Van Landeghem, Melissa; Deutsch, Maxime; Banks, Peter; La Magna, Paola; Van Hecke, Kristof; Cerdá, Jesús; Lutsen, Laurence; Vanderzande, Dirk; Quarti, Claudio; Beljonne, David; Pillet, Sébastien; Vandewal, Koen; Van Gompel, Wouter T. M. Structural rigidity, thermochromism and piezochromism of layered hybrid perovskites containing an interdigitated organic bilayer. Chemical science, 2025, 16, 5662-5675 |
| 1573959 | CIF | C16 H18 F4 I4 N8 Pb | P n m a | 12.5017; 27.526; 6.2872 90; 90; 90 | 2163.6 | Maufort, Arthur; Van Landeghem, Melissa; Deutsch, Maxime; Banks, Peter; La Magna, Paola; Van Hecke, Kristof; Cerdá, Jesús; Lutsen, Laurence; Vanderzande, Dirk; Quarti, Claudio; Beljonne, David; Pillet, Sébastien; Vandewal, Koen; Van Gompel, Wouter T. M. Structural rigidity, thermochromism and piezochromism of layered hybrid perovskites containing an interdigitated organic bilayer. Chemical science, 2025, 16, 5662-5675 |
| 1573960 | CIF | C16 H18 F4 I4 N8 Pb | P n m a | 12.6989; 28.912; 6.47 90; 90; 90 | 2375.5 | Maufort, Arthur; Van Landeghem, Melissa; Deutsch, Maxime; Banks, Peter; La Magna, Paola; Van Hecke, Kristof; Cerdá, Jesús; Lutsen, Laurence; Vanderzande, Dirk; Quarti, Claudio; Beljonne, David; Pillet, Sébastien; Vandewal, Koen; Van Gompel, Wouter T. M. Structural rigidity, thermochromism and piezochromism of layered hybrid perovskites containing an interdigitated organic bilayer. Chemical science, 2025, 16, 5662-5675 |
| 1573961 | CIF | C16 H18 F4 I4 N8 Pb | P n m a | 12.5029; 27.709; 6.2997 90; 90; 90 | 2182.5 | Maufort, Arthur; Van Landeghem, Melissa; Deutsch, Maxime; Banks, Peter; La Magna, Paola; Van Hecke, Kristof; Cerdá, Jesús; Lutsen, Laurence; Vanderzande, Dirk; Quarti, Claudio; Beljonne, David; Pillet, Sébastien; Vandewal, Koen; Van Gompel, Wouter T. M. Structural rigidity, thermochromism and piezochromism of layered hybrid perovskites containing an interdigitated organic bilayer. Chemical science, 2025, 16, 5662-5675 |
| 1573962 | CIF | C16 H18 F4 I4 N8 Pb | P n m a | 12.699; 28.928; 6.4727 90; 90; 90 | 2377.8 | Maufort, Arthur; Van Landeghem, Melissa; Deutsch, Maxime; Banks, Peter; La Magna, Paola; Van Hecke, Kristof; Cerdá, Jesús; Lutsen, Laurence; Vanderzande, Dirk; Quarti, Claudio; Beljonne, David; Pillet, Sébastien; Vandewal, Koen; Van Gompel, Wouter T. M. Structural rigidity, thermochromism and piezochromism of layered hybrid perovskites containing an interdigitated organic bilayer. Chemical science, 2025, 16, 5662-5675 |
| 1573963 | CIF | C16 H18 F4 I4 N8 Pb | P n m a | 12.9028; 30.077; 6.6218 90; 90; 90 | 2569.8 | Maufort, Arthur; Van Landeghem, Melissa; Deutsch, Maxime; Banks, Peter; La Magna, Paola; Van Hecke, Kristof; Cerdá, Jesús; Lutsen, Laurence; Vanderzande, Dirk; Quarti, Claudio; Beljonne, David; Pillet, Sébastien; Vandewal, Koen; Van Gompel, Wouter T. M. Structural rigidity, thermochromism and piezochromism of layered hybrid perovskites containing an interdigitated organic bilayer. Chemical science, 2025, 16, 5662-5675 |
| 1573964 | CIF | C16 H18 F4 I4 N8 Pb | P n m a | 12.5704; 28.337; 6.3725 90; 90; 90 | 2269.9 | Maufort, Arthur; Van Landeghem, Melissa; Deutsch, Maxime; Banks, Peter; La Magna, Paola; Van Hecke, Kristof; Cerdá, Jesús; Lutsen, Laurence; Vanderzande, Dirk; Quarti, Claudio; Beljonne, David; Pillet, Sébastien; Vandewal, Koen; Van Gompel, Wouter T. M. Structural rigidity, thermochromism and piezochromism of layered hybrid perovskites containing an interdigitated organic bilayer. Chemical science, 2025, 16, 5662-5675 |
| 1573965 | CIF | C16 H18 F4 I4 N8 Pb | P n m a | 12.5155; 28.112; 6.3307 90; 90; 90 | 2227.37 | Maufort, Arthur; Van Landeghem, Melissa; Deutsch, Maxime; Banks, Peter; La Magna, Paola; Van Hecke, Kristof; Cerdá, Jesús; Lutsen, Laurence; Vanderzande, Dirk; Quarti, Claudio; Beljonne, David; Pillet, Sébastien; Vandewal, Koen; Van Gompel, Wouter T. M. Structural rigidity, thermochromism and piezochromism of layered hybrid perovskites containing an interdigitated organic bilayer. Chemical science, 2025, 16, 5662-5675 |
| 1573966 | CIF | C16 H18 F4 I4 N8 Pb | P n m a | 12.6346; 28.617; 6.4221 90; 90; 90 | 2322 | Maufort, Arthur; Van Landeghem, Melissa; Deutsch, Maxime; Banks, Peter; La Magna, Paola; Van Hecke, Kristof; Cerdá, Jesús; Lutsen, Laurence; Vanderzande, Dirk; Quarti, Claudio; Beljonne, David; Pillet, Sébastien; Vandewal, Koen; Van Gompel, Wouter T. M. Structural rigidity, thermochromism and piezochromism of layered hybrid perovskites containing an interdigitated organic bilayer. Chemical science, 2025, 16, 5662-5675 |
| 1573967 | CIF | C16 H18 F4 I4 N8 Pb | P n m a | 12.7582; 29.234; 6.5183 90; 90; 90 | 2431.2 | Maufort, Arthur; Van Landeghem, Melissa; Deutsch, Maxime; Banks, Peter; La Magna, Paola; Van Hecke, Kristof; Cerdá, Jesús; Lutsen, Laurence; Vanderzande, Dirk; Quarti, Claudio; Beljonne, David; Pillet, Sébastien; Vandewal, Koen; Van Gompel, Wouter T. M. Structural rigidity, thermochromism and piezochromism of layered hybrid perovskites containing an interdigitated organic bilayer. Chemical science, 2025, 16, 5662-5675 |
| 1573968 | CIF | C15 H12 N2 | P 1 21/c 1 | 5.5513; 9.0805; 22.6176 90; 93.832; 90 | 1137.57 | Shaydullin, Ruslan R.; Galushko, Alexey S.; Ilyushenkova, Valentina V.; Vlasova, Yulia S.; Ananikov, Valentine P. Are activation barriers of 50-70 kcal mol<sup>-1</sup> accessible for transformations in organic synthesis in solution? Chemical science, 2025, 16, 5289-5298 |
| 1573969 | CIF | C123 H94 B2 Cl6 N6 Zn | C 1 2/c 1 | 27.5951; 13.4831; 29.7605 90; 114.537; 90 | 10073 | Janetzki, Jett T.; Brown, Dominic S.; Daumann, Florian; Ismail, I. Haseena; Gable, Robert W.; Hay, Moya A.; Mulder, Roger J.; Starikova, Alyona A.; Weber, Birgit; Giansiracusa, Marcus J.; Boskovic, Colette Thermal- and light-induced valence tautomerism with a concerted spin transition in an iron tris(diimine) complex. Chemical science, 2025, 16, 5857-5871 |
| 1573970 | CIF | C132 H116 B2 Fe N6 O2 | C 1 2/c 1 | 27.51; 13.52; 30.45 90; 113.67; 90 | 10373 | Janetzki, Jett T.; Brown, Dominic S.; Daumann, Florian; Ismail, I. Haseena; Gable, Robert W.; Hay, Moya A.; Mulder, Roger J.; Starikova, Alyona A.; Weber, Birgit; Giansiracusa, Marcus J.; Boskovic, Colette Thermal- and light-induced valence tautomerism with a concerted spin transition in an iron tris(diimine) complex. Chemical science, 2025, 16, 5857-5871 |
| 1573971 | CIF | C132 H116 B2 Fe N6 O2 | C 1 2/c 1 | 27.79; 13.68; 30.56 90; 113.4; 90 | 10662 | Janetzki, Jett T.; Brown, Dominic S.; Daumann, Florian; Ismail, I. Haseena; Gable, Robert W.; Hay, Moya A.; Mulder, Roger J.; Starikova, Alyona A.; Weber, Birgit; Giansiracusa, Marcus J.; Boskovic, Colette Thermal- and light-induced valence tautomerism with a concerted spin transition in an iron tris(diimine) complex. Chemical science, 2025, 16, 5857-5871 |
| 1573972 | CIF | C132 H116 B2 Fe N6 O2 | C 1 2/c 1 | 27.31; 13.37; 30.17 90; 114.31; 90 | 10039 | Janetzki, Jett T.; Brown, Dominic S.; Daumann, Florian; Ismail, I. Haseena; Gable, Robert W.; Hay, Moya A.; Mulder, Roger J.; Starikova, Alyona A.; Weber, Birgit; Giansiracusa, Marcus J.; Boskovic, Colette Thermal- and light-induced valence tautomerism with a concerted spin transition in an iron tris(diimine) complex. Chemical science, 2025, 16, 5857-5871 |
| 1573973 | CIF | C132 H116 B2 Fe N6 O2 | C 1 2/c 1 | 27.71; 13.64; 30.55 90; 113.46; 90 | 10592 | Janetzki, Jett T.; Brown, Dominic S.; Daumann, Florian; Ismail, I. Haseena; Gable, Robert W.; Hay, Moya A.; Mulder, Roger J.; Starikova, Alyona A.; Weber, Birgit; Giansiracusa, Marcus J.; Boskovic, Colette Thermal- and light-induced valence tautomerism with a concerted spin transition in an iron tris(diimine) complex. Chemical science, 2025, 16, 5857-5871 |
| 1573974 | CIF | C133 H118 B2 Cl2 Co N6 O2 | C 1 2/c 1 | 27.429; 13.479; 29.817 90; 114.3; 90 | 10047 | Janetzki, Jett T.; Brown, Dominic S.; Daumann, Florian; Ismail, I. Haseena; Gable, Robert W.; Hay, Moya A.; Mulder, Roger J.; Starikova, Alyona A.; Weber, Birgit; Giansiracusa, Marcus J.; Boskovic, Colette Thermal- and light-induced valence tautomerism with a concerted spin transition in an iron tris(diimine) complex. Chemical science, 2025, 16, 5857-5871 |
| 1573975 | CIF | C132 H116 B2 Fe N6 O2 | C 1 2/c 1 | 27.35; 13.4; 30.24 90; 114.19; 90 | 10110 | Janetzki, Jett T.; Brown, Dominic S.; Daumann, Florian; Ismail, I. Haseena; Gable, Robert W.; Hay, Moya A.; Mulder, Roger J.; Starikova, Alyona A.; Weber, Birgit; Giansiracusa, Marcus J.; Boskovic, Colette Thermal- and light-induced valence tautomerism with a concerted spin transition in an iron tris(diimine) complex. Chemical science, 2025, 16, 5857-5871 |
| 1573976 | CIF | C132 H116 B2 Fe N6 O2 | C 1 2/c 1 | 27.38; 13.44; 30.33 90; 113.99; 90 | 10197 | Janetzki, Jett T.; Brown, Dominic S.; Daumann, Florian; Ismail, I. Haseena; Gable, Robert W.; Hay, Moya A.; Mulder, Roger J.; Starikova, Alyona A.; Weber, Birgit; Giansiracusa, Marcus J.; Boskovic, Colette Thermal- and light-induced valence tautomerism with a concerted spin transition in an iron tris(diimine) complex. Chemical science, 2025, 16, 5857-5871 |
| 1573977 | CIF | C132 H116 B2 Fe N6 O2 | C 1 2/c 1 | 27.44; 13.47; 30.39 90; 113.83; 90 | 10275 | Janetzki, Jett T.; Brown, Dominic S.; Daumann, Florian; Ismail, I. Haseena; Gable, Robert W.; Hay, Moya A.; Mulder, Roger J.; Starikova, Alyona A.; Weber, Birgit; Giansiracusa, Marcus J.; Boskovic, Colette Thermal- and light-induced valence tautomerism with a concerted spin transition in an iron tris(diimine) complex. Chemical science, 2025, 16, 5857-5871 |
| 1573978 | CIF | C132 H116 B2 Fe N6 O2 | C 1 2/c 1 | 27.64; 13.59; 30.52 90; 113.51; 90 | 10513 | Janetzki, Jett T.; Brown, Dominic S.; Daumann, Florian; Ismail, I. Haseena; Gable, Robert W.; Hay, Moya A.; Mulder, Roger J.; Starikova, Alyona A.; Weber, Birgit; Giansiracusa, Marcus J.; Boskovic, Colette Thermal- and light-induced valence tautomerism with a concerted spin transition in an iron tris(diimine) complex. Chemical science, 2025, 16, 5857-5871 |
| 1573979 | CIF | C129 H109 B2 Mn N6 O1.5 | P -1 | 17.0314; 17.0463; 21.0901 80.916; 69.604; 60.143 | 4976.4 | Janetzki, Jett T.; Brown, Dominic S.; Daumann, Florian; Ismail, I. Haseena; Gable, Robert W.; Hay, Moya A.; Mulder, Roger J.; Starikova, Alyona A.; Weber, Birgit; Giansiracusa, Marcus J.; Boskovic, Colette Thermal- and light-induced valence tautomerism with a concerted spin transition in an iron tris(diimine) complex. Chemical science, 2025, 16, 5857-5871 |
| 1573980 | CIF | C40 H29 N O2 | P 21 21 21 | 7.7089; 24.161; 30.34 90; 90; 90 | 5650.97 | Sun, Haodong; Xiao, Yuxin; He, Yunfei; Wei, Xiaoyu; Zou, Jindou; Luo, Yuanda; Wu, Yazhang; Zhao, Jiaxin; Au, Vonika Ka-Man; Yu, Tao 3D printable organic room-temperature phosphorescent materials and printed real-time sensing and display devices. Chemical science, 2025, 16, 5299-5309 |
| 1573981 | CIF | C33 H23 Cl2 N O2 | P 1 21/c 1 | 12.8697; 26.1356; 7.9805 90; 107.143; 90 | 2565.04 | Sun, Haodong; Xiao, Yuxin; He, Yunfei; Wei, Xiaoyu; Zou, Jindou; Luo, Yuanda; Wu, Yazhang; Zhao, Jiaxin; Au, Vonika Ka-Man; Yu, Tao 3D printable organic room-temperature phosphorescent materials and printed real-time sensing and display devices. Chemical science, 2025, 16, 5299-5309 |
| 1573982 | CIF | C44 H29 N O2 | P 1 21/c 1 | 15.739; 16.068; 13.9254 90; 107.433; 90 | 3359.9 | Sun, Haodong; Xiao, Yuxin; He, Yunfei; Wei, Xiaoyu; Zou, Jindou; Luo, Yuanda; Wu, Yazhang; Zhao, Jiaxin; Au, Vonika Ka-Man; Yu, Tao 3D printable organic room-temperature phosphorescent materials and printed real-time sensing and display devices. Chemical science, 2025, 16, 5299-5309 |
| 1573985 | CIF | C12 H33 B11 N2 O2 | P n m a | 10.0719; 10.9585; 18.5142 90; 90; 90 | 2043.47 | Sun, Wanqi; Jin, Yujie; Wang, Yongtao; Wen, Zeyu; Sun, Jizeng; Yao, Jia; Duttwyler, Simon; Li, Haoran Oxidation-induced nucleophilic substitution at the electron-rich B(12) vertex in [CB<sub>11</sub>H<sub>12</sub>]<sup>-</sup> under catalyst-free conditions. Chemical science, 2025, 16, 5942-5947 |
| 1573986 | CIF | C24 H55 B11 N2 O7 | P -1 | 10.4232; 11.4832; 14.7581 93.391; 94.642; 91.388 | 1756.8 | Sun, Wanqi; Jin, Yujie; Wang, Yongtao; Wen, Zeyu; Sun, Jizeng; Yao, Jia; Duttwyler, Simon; Li, Haoran Oxidation-induced nucleophilic substitution at the electron-rich B(12) vertex in [CB<sub>11</sub>H<sub>12</sub>]<sup>-</sup> under catalyst-free conditions. Chemical science, 2025, 16, 5942-5947 |
| 1573987 | CIF | C21 H53 B11 Cl6 N2 O2 | P 1 21/c 1 | 23.2378; 9.4437; 17.9211 90; 109.429; 90 | 3708.8 | Sun, Wanqi; Jin, Yujie; Wang, Yongtao; Wen, Zeyu; Sun, Jizeng; Yao, Jia; Duttwyler, Simon; Li, Haoran Oxidation-induced nucleophilic substitution at the electron-rich B(12) vertex in [CB<sub>11</sub>H<sub>12</sub>]<sup>-</sup> under catalyst-free conditions. Chemical science, 2025, 16, 5942-5947 |
| 1573988 | CIF | C21 H54 B11 N3 O2 | P 1 21/c 1 | 13.1967; 22.4636; 20.8837 90; 92.836; 90 | 6183.3 | Sun, Wanqi; Jin, Yujie; Wang, Yongtao; Wen, Zeyu; Sun, Jizeng; Yao, Jia; Duttwyler, Simon; Li, Haoran Oxidation-induced nucleophilic substitution at the electron-rich B(12) vertex in [CB<sub>11</sub>H<sub>12</sub>]<sup>-</sup> under catalyst-free conditions. Chemical science, 2025, 16, 5942-5947 |
| 1573989 | CIF | C18 H15 Br Fe O2 | P 1 | 7.613; 8.5829; 12.8193 80.36; 73.628; 82.082 | 788.68 | Hang, Nan-Nan; Tong, En-Guang; Qi, Ting; Sun, Chao; Ming, Jialin Asymmetric synthesis of metallocenes with planar and central chirality by rhodium-catalyzed desymmetrization reactions. Chemical science, 2025, 16, 5880-5886 |
| 1573990 | CIF | C10 H17 N2 O4 Re S2 | P 1 21/c 1 | 7.79663; 10.5671; 18.0745 90; 101.425; 90 | 1459.61 | Melis, Diana R.; Segers, Charlotte; Wellens, Jasmien; Van de Voorde, Michiel; Blacque, Olivier; Ooms, Maarten; Gasser, Gilles; Opsomer, Tomas Cysteine-selective [<sup>188</sup>Re]Re(v) radiolabelling of a Nanobody® for targeted radionuclide therapy using a "chelate-then-click" approach. Chemical science, 2025, 16, 6089-6098 |
| 1573991 | CIF | C8 H13 N2 O4 Re S2 | F d d 2 | 27.8226; 20.249; 8.86174 90; 90; 90 | 4992.53 | Melis, Diana R.; Segers, Charlotte; Wellens, Jasmien; Van de Voorde, Michiel; Blacque, Olivier; Ooms, Maarten; Gasser, Gilles; Opsomer, Tomas Cysteine-selective [<sup>188</sup>Re]Re(v) radiolabelling of a Nanobody® for targeted radionuclide therapy using a "chelate-then-click" approach. Chemical science, 2025, 16, 6089-6098 |
| 1573992 | CIF | C42 H42 Co F3 N2 P4 | P 1 21/c 1 | 11.0941; 22.838; 15.192 90; 93.182; 90 | 3843.2 | Fitzsimmons, Matthew C.; Seith, Maria C.; Moore, Curtis E.; Thomas, Christine M. Efficient and selective hydroboration of alkenes catalyzed by an air-stable (PP<sup>CF3</sup>P)CoI<sub>2</sub> precatalyst. Chemical science, 2025, 16, 5717-5725 |
| 1573993 | CIF | C41.5 H37 Cl5 Co F3 I2 N2 P3 | P -1 | 12.5715; 13.3397; 15.6881 87.496; 73.663; 62.081 | 2218.77 | Fitzsimmons, Matthew C.; Seith, Maria C.; Moore, Curtis E.; Thomas, Christine M. Efficient and selective hydroboration of alkenes catalyzed by an air-stable (PP<sup>CF3</sup>P)CoI<sub>2</sub> precatalyst. Chemical science, 2025, 16, 5717-5725 |
| 1573994 | CIF | C55 H57 Co F3 N2 O2 P3 | P c a 21 | 24.0754; 12.3634; 34.026 90; 90; 90 | 10128 | Fitzsimmons, Matthew C.; Seith, Maria C.; Moore, Curtis E.; Thomas, Christine M. Efficient and selective hydroboration of alkenes catalyzed by an air-stable (PP<sup>CF3</sup>P)CoI<sub>2</sub> precatalyst. Chemical science, 2025, 16, 5717-5725 |
| 1573995 | CIF | C23 H18 N2 O3 S | P 1 21/c 1 | 11.0055; 12.1682; 14.8532 90; 104.525; 90 | 1925.52 | Gu, Jun; Zhang, Li-Hong; Zhuang, Hong-Feng; He, Ying Atroposelective [4+1] annulation for the synthesis of isotopic isoindolinones bearing both central and axial chirality. Chemical science, 2025, 16, 5735-5744 |
| 1573996 | CIF | C23 H20 N2 O3 S | P 21 21 21 | 8.843; 12.33; 18.0497 90; 90; 90 | 1968.03 | Gu, Jun; Zhang, Li-Hong; Zhuang, Hong-Feng; He, Ying Atroposelective [4+1] annulation for the synthesis of isotopic isoindolinones bearing both central and axial chirality. Chemical science, 2025, 16, 5735-5744 |
| 1573997 | CIF | C23 H18 N2 O3 S | P 1 21 1 | 8.3879; 12.8676; 9.7824 90; 111.619; 90 | 981.56 | Gu, Jun; Zhang, Li-Hong; Zhuang, Hong-Feng; He, Ying Atroposelective [4+1] annulation for the synthesis of isotopic isoindolinones bearing both central and axial chirality. Chemical science, 2025, 16, 5735-5744 |
| 1573998 | CIF | C23 H18 N2 O3 S | P 1 21 1 | 8.3907; 12.8791; 9.7624 90; 111.393; 90 | 982.28 | Gu, Jun; Zhang, Li-Hong; Zhuang, Hong-Feng; He, Ying Atroposelective [4+1] annulation for the synthesis of isotopic isoindolinones bearing both central and axial chirality. Chemical science, 2025, 16, 5735-5744 |
| 1573999 | CIF | C10 H15.5 Ag2 F3 N O3.25 S | P n -3 :2 | 20.9199; 20.9199; 20.9199 90; 90; 90 | 9155.4 | Chandrashekar, Priyanka; Karmakar, Arun; Aparna, Ravari Kandy; Singh, Laddi; Mondal, Pradip Kumar; Kundu, Subrata; Bhattacharyya, Kalishankar; Mandal, Sukhendu Linker driven site-specific catalysis in atomically precise silver cluster assemblies. Chemical science, 2025, 16, 5726-5734 |
| 1574000 | CIF | C45 H58 Ag6 F9 N4 O7 S3 | C 1 2/c 1 | 25.337; 24.666; 19.661 90; 109.96; 90 | 11549 | Chandrashekar, Priyanka; Karmakar, Arun; Aparna, Ravari Kandy; Singh, Laddi; Mondal, Pradip Kumar; Kundu, Subrata; Bhattacharyya, Kalishankar; Mandal, Sukhendu Linker driven site-specific catalysis in atomically precise silver cluster assemblies. Chemical science, 2025, 16, 5726-5734 |
| 1574001 | CIF | C42 H52 Ag6 F9 N7 O7 S3 | C 1 2/c 1 | 26.994; 14.021; 29.259 90; 92.57; 90 | 11063 | Chandrashekar, Priyanka; Karmakar, Arun; Aparna, Ravari Kandy; Singh, Laddi; Mondal, Pradip Kumar; Kundu, Subrata; Bhattacharyya, Kalishankar; Mandal, Sukhendu Linker driven site-specific catalysis in atomically precise silver cluster assemblies. Chemical science, 2025, 16, 5726-5734 |
| 1574002 | CIF | C39 H45 Ag6 F9 N3 O6 S3 | P n n m | 22.946; 27.85; 18.982 90; 90; 90 | 12130 | Chandrashekar, Priyanka; Karmakar, Arun; Aparna, Ravari Kandy; Singh, Laddi; Mondal, Pradip Kumar; Kundu, Subrata; Bhattacharyya, Kalishankar; Mandal, Sukhendu Linker driven site-specific catalysis in atomically precise silver cluster assemblies. Chemical science, 2025, 16, 5726-5734 |
| 1574010 | CIF | C30 H42 B N O | P 1 21/c 1 | 9.1568; 11.115; 26.1678 90; 95.763; 90 | 2649.84 | Michel, Maximilian; Endres, Lukas; Fantuzzi, Felipe; Krummenacher, Ivo; Braunschweig, Holger Harnessing transient CAAC-stabilized mesitylborylenes for chalcogen activation. Chemical science, 2025, 16, 5632-5639 |
| 1574011 | CIF | C33 H50 B N O Se | P n a 21 | 14.2386; 14.0447; 15.3868 90; 90; 90 | 3077 | Michel, Maximilian; Endres, Lukas; Fantuzzi, Felipe; Krummenacher, Ivo; Braunschweig, Holger Harnessing transient CAAC-stabilized mesitylborylenes for chalcogen activation. Chemical science, 2025, 16, 5632-5639 |
| 1574012 | CIF | C32 H51 B N P | P -1 | 9.6984; 11.0467; 14.5864 96.819; 105.427; 92.382 | 1491.38 | Michel, Maximilian; Endres, Lukas; Fantuzzi, Felipe; Krummenacher, Ivo; Braunschweig, Holger Harnessing transient CAAC-stabilized mesitylborylenes for chalcogen activation. Chemical science, 2025, 16, 5632-5639 |
| 1574013 | CIF | C45 H74 B Li2 N O4 Se | P -1 | 10.7762; 16.8779; 24.5726 81.439; 86.226; 88.794 | 4409.59 | Michel, Maximilian; Endres, Lukas; Fantuzzi, Felipe; Krummenacher, Ivo; Braunschweig, Holger Harnessing transient CAAC-stabilized mesitylborylenes for chalcogen activation. Chemical science, 2025, 16, 5632-5639 |
| 1574014 | CIF | C58 H84 B2 N2 Te2 | P -1 | 10.1565; 10.3469; 14.2245 69.78; 80.935; 81.899 | 1379.14 | Michel, Maximilian; Endres, Lukas; Fantuzzi, Felipe; Krummenacher, Ivo; Braunschweig, Holger Harnessing transient CAAC-stabilized mesitylborylenes for chalcogen activation. Chemical science, 2025, 16, 5632-5639 |
| 1574015 | CIF | C64 H88 B2 F7.79 N2 P0.96 Te2 | P -1 | 12.7992; 16.2783; 17.3761 106.637; 94.029; 96.39 | 3427.31 | Michel, Maximilian; Endres, Lukas; Fantuzzi, Felipe; Krummenacher, Ivo; Braunschweig, Holger Harnessing transient CAAC-stabilized mesitylborylenes for chalcogen activation. Chemical science, 2025, 16, 5632-5639 |
| 1574016 | CIF | C29 H42 B N S | P 1 21/c 1 | 18.006; 8.4637; 17.399 90; 93.337; 90 | 2647.07 | Michel, Maximilian; Endres, Lukas; Fantuzzi, Felipe; Krummenacher, Ivo; Braunschweig, Holger Harnessing transient CAAC-stabilized mesitylborylenes for chalcogen activation. Chemical science, 2025, 16, 5632-5639 |
| 1574017 | CIF | C74 H116 B2 Li2 N2 O4 S2 | P -1 | 10.5609; 13.0367; 14.8835 82.383; 79.577; 68.461 | 1869.7 | Michel, Maximilian; Endres, Lukas; Fantuzzi, Felipe; Krummenacher, Ivo; Braunschweig, Holger Harnessing transient CAAC-stabilized mesitylborylenes for chalcogen activation. Chemical science, 2025, 16, 5632-5639 |
| 1574018 | CIF | C70 H108 B2 Li4 N2 O3 S2 | P 1 21 1 | 10.6514; 21.0348; 16.8392 90; 106.025; 90 | 3626.22 | Michel, Maximilian; Endres, Lukas; Fantuzzi, Felipe; Krummenacher, Ivo; Braunschweig, Holger Harnessing transient CAAC-stabilized mesitylborylenes for chalcogen activation. Chemical science, 2025, 16, 5632-5639 |
| 1574019 | CIF | C45 H74 B Li2 N O4 Te | P -1 | 10.7784; 16.9121; 24.8131 82.133; 86.65; 88.61 | 4472.24 | Michel, Maximilian; Endres, Lukas; Fantuzzi, Felipe; Krummenacher, Ivo; Braunschweig, Holger Harnessing transient CAAC-stabilized mesitylborylenes for chalcogen activation. Chemical science, 2025, 16, 5632-5639 |
| 1574024 | CIF | C18 H18 B N3 | P 1 21/n 1 | 13.9391; 11.2303; 20.3661 90; 104.938; 90 | 3080.4 | Parui, Retwik; Roy, Hirakjyoti; Meher, Niranjan; Ghosh, Siddhartha Sankar; Iyer, Parameswar Krishnan Mechanistic investigation on cellular internalization triggering structure-induced conformational modulation of boron-nitrogen luminogens. Chemical science, 2025, 16, 6023-6034 |
| 1574025 | CIF | C16 H12 B Cl N2 | P 1 21 1 | 4.7299; 10.3015; 13.5889 90; 96.628; 90 | 657.69 | Parui, Retwik; Roy, Hirakjyoti; Meher, Niranjan; Ghosh, Siddhartha Sankar; Iyer, Parameswar Krishnan Mechanistic investigation on cellular internalization triggering structure-induced conformational modulation of boron-nitrogen luminogens. Chemical science, 2025, 16, 6023-6034 |
| 1574026 | CIF | C16 H12 B F N2 | I -4 | 22.7941; 22.7941; 5.0803 90; 90; 90 | 2639.6 | Parui, Retwik; Roy, Hirakjyoti; Meher, Niranjan; Ghosh, Siddhartha Sankar; Iyer, Parameswar Krishnan Mechanistic investigation on cellular internalization triggering structure-induced conformational modulation of boron-nitrogen luminogens. Chemical science, 2025, 16, 6023-6034 |
| 1574027 | CIF | C16 H12 B Br N2 | P 1 21/n 1 | 12.963; 6.412; 16.767 90; 92.356; 90 | 1392.5 | Parui, Retwik; Roy, Hirakjyoti; Meher, Niranjan; Ghosh, Siddhartha Sankar; Iyer, Parameswar Krishnan Mechanistic investigation on cellular internalization triggering structure-induced conformational modulation of boron-nitrogen luminogens. Chemical science, 2025, 16, 6023-6034 |
| 1574028 | CIF | C17 H12 B N3 | P 1 21/n 1 | 8.2259; 26.151; 19.2586 90; 95.282; 90 | 4125.2 | Parui, Retwik; Roy, Hirakjyoti; Meher, Niranjan; Ghosh, Siddhartha Sankar; Iyer, Parameswar Krishnan Mechanistic investigation on cellular internalization triggering structure-induced conformational modulation of boron-nitrogen luminogens. Chemical science, 2025, 16, 6023-6034 |
| 1574039 | CIF | C20 H17 Cl N2 O3 | P 1 | 5.872; 7.735; 20.137 98.57; 97.62; 91.31 | 895.6 | Tian, Jiabao; Ling, Jiahao; Wang, Yanan; Zhou, Lei Blue light-induced diazo cross-coupling: synthesis of allyldiazo compounds through reshuffling of functionalities. Chemical science, 2025, 16, 5701-5706 |
| 1574040 | CIF | C20 H17 Cl N2 O3 | P c a 21 | 7.6916; 5.838; 40.645 90; 90; 90 | 1825.11 | Tian, Jiabao; Ling, Jiahao; Wang, Yanan; Zhou, Lei Blue light-induced diazo cross-coupling: synthesis of allyldiazo compounds through reshuffling of functionalities. Chemical science, 2025, 16, 5701-5706 |
| 1574041 | CIF | C21 H19 Cl N2 O3 | C 1 c 1 | 20.171; 9.765; 39.079 90; 99.308; 90 | 7596 | Tian, Jiabao; Ling, Jiahao; Wang, Yanan; Zhou, Lei Blue light-induced diazo cross-coupling: synthesis of allyldiazo compounds through reshuffling of functionalities. Chemical science, 2025, 16, 5701-5706 |
| 1574042 | CIF | C18 H22 N O P | P 21 21 21 | 9.9528; 10.6897; 16.8353 90; 90; 90 | 1791.15 | Zhang, Jialiang; Guo, Jiajia; Xu, Ruhui; Zheng, Di; Lian, Kai; Zhang, Zhaoxia; Cao, Shanshan; Jiang, Zhiyong Asymmetric copper-catalyzed hydrophosphinylation of ethynylazaarenes to access <i>P</i>-chiral 2-azaaryl-ethylphosphine oxides. Chemical science, 2025, 16, 5957-5966 |
| 1574043 | CIF | C31 H48 O4 | P 21 21 21 | 7.5983; 14.6061; 25.287 90; 90; 90 | 2806.39 | Dethe, Dattatraya H.; Siddiqui, Salman A.; Singha, Chirantan Biomimetic syntheses of kadcoccitane H and kadcotrione C methyl ester. Chemical science, 2025, 16, 6099-6103 |
| 1574044 | CIF | C9.82 H5.45 Ce0.36 O2.18 | P 1 21/c 1 | 12.1955; 27.6141; 7.7042 90; 93.382; 90 | 2590 | Gómez-Muñoz, Iván; Hu, Ziqi; Vitórica-Yrezábal, Iñigo J; Coronado, Eugenio; Mínguez Espallargas, Guillermo Implementing magnetic properties on demand with a dynamic lanthanoid-organic framework. Chemical science, 2025, 16, 2879-2885 |
| 1574045 | CIF | C27 H15.8 La O6.4 | P 1 21/c 1 | 12.1008; 27.7464; 7.8237 90; 93.673; 90 | 2621.44 | Gómez-Muñoz, Iván; Hu, Ziqi; Vitórica-Yrezábal, Iñigo J; Coronado, Eugenio; Mínguez Espallargas, Guillermo Implementing magnetic properties on demand with a dynamic lanthanoid-organic framework. Chemical science, 2025, 16, 2879-2885 |
| 1574046 | CIF | C36 H37 Dy N3 O9.5 | P 1 21 1 | 8.0212; 26.89; 16.3817 90; 92.297; 90 | 3530.5 | Gómez-Muñoz, Iván; Hu, Ziqi; Vitórica-Yrezábal, Iñigo J; Coronado, Eugenio; Mínguez Espallargas, Guillermo Implementing magnetic properties on demand with a dynamic lanthanoid-organic framework. Chemical science, 2025, 16, 2879-2885 |
| 1574047 | CIF | C35.26 H34.26 La N2.75 O8.75 | P 1 21/c 1 | 16.7495; 26.5927; 8.4965 90; 95.014; 90 | 3769.98 | Gómez-Muñoz, Iván; Hu, Ziqi; Vitórica-Yrezábal, Iñigo J; Coronado, Eugenio; Mínguez Espallargas, Guillermo Implementing magnetic properties on demand with a dynamic lanthanoid-organic framework. Chemical science, 2025, 16, 2879-2885 |
| 1574048 | CIF | C33.3 H29.7 La N2.1 O8.1 | P 1 21/c 1 | 15.0013; 27.7449; 16.1774 90; 97.287; 90 | 6678.8 | Gómez-Muñoz, Iván; Hu, Ziqi; Vitórica-Yrezábal, Iñigo J; Coronado, Eugenio; Mínguez Espallargas, Guillermo Implementing magnetic properties on demand with a dynamic lanthanoid-organic framework. Chemical science, 2025, 16, 2879-2885 |
| 1574049 | CIF | C31.5 H27.5 N1.5 O8.5 Pr | P 1 21/c 1 | 15.0438; 28.0476; 16.0831 90; 97.259; 90 | 6731.8 | Gómez-Muñoz, Iván; Hu, Ziqi; Vitórica-Yrezábal, Iñigo J; Coronado, Eugenio; Mínguez Espallargas, Guillermo Implementing magnetic properties on demand with a dynamic lanthanoid-organic framework. Chemical science, 2025, 16, 2879-2885 |
| 1574050 | CIF | C32.55 H27.95 Ce N1.85 O7.85 | P 1 21/c 1 | 15.0927; 27.9263; 16.165 90; 97.249; 90 | 6758.8 | Gómez-Muñoz, Iván; Hu, Ziqi; Vitórica-Yrezábal, Iñigo J; Coronado, Eugenio; Mínguez Espallargas, Guillermo Implementing magnetic properties on demand with a dynamic lanthanoid-organic framework. Chemical science, 2025, 16, 2879-2885 |
| 1574051 | CIF | C28.32 H21.49 La N0.44 O8.15 | P 1 21/n 1 | 15.4232; 20.5544; 32.285 90; 94.546; 90 | 10202.6 | Gómez-Muñoz, Iván; Hu, Ziqi; Vitórica-Yrezábal, Iñigo J; Coronado, Eugenio; Mínguez Espallargas, Guillermo Implementing magnetic properties on demand with a dynamic lanthanoid-organic framework. Chemical science, 2025, 16, 2879-2885 |
| 1574052 | CIF | C28.5 H19 Ce N0.5 O6.75 | P 1 21/n 1 | 15.3286; 20.5857; 32.2184 90; 94.423; 90 | 10136.2 | Gómez-Muñoz, Iván; Hu, Ziqi; Vitórica-Yrezábal, Iñigo J; Coronado, Eugenio; Mínguez Espallargas, Guillermo Implementing magnetic properties on demand with a dynamic lanthanoid-organic framework. Chemical science, 2025, 16, 2879-2885 |
| 1574053 | CIF | C30 H27 N O2 | P 1 21 1 | 8.6278; 12.3083; 10.9519 90; 95.711; 90 | 1157.25 | He, Ze-Liang; Li, Li; Chen, Zhi-Chao; Du, Wei; Chen, Ying-Chun Palladium-catalysed asymmetric cascade transformations of 4-alken-2-ynyl carbonates to construct complex frameworks. Chemical science, 2025, 16, 3124-3129 |
| 1574054 | CIF | C29 H28 N2 O4 S | P -1 | 7.4687; 12.636; 14.057 86.841; 76.742; 75.308 | 1249 | He, Ze-Liang; Li, Li; Chen, Zhi-Chao; Du, Wei; Chen, Ying-Chun Palladium-catalysed asymmetric cascade transformations of 4-alken-2-ynyl carbonates to construct complex frameworks. Chemical science, 2025, 16, 3124-3129 |
| 1574055 | CIF | C28 H20 F3 N O2 | P -1 | 9.9196; 9.9973; 11.8824 91.791; 104.104; 102.384 | 1111.91 | He, Ze-Liang; Li, Li; Chen, Zhi-Chao; Du, Wei; Chen, Ying-Chun Palladium-catalysed asymmetric cascade transformations of 4-alken-2-ynyl carbonates to construct complex frameworks. Chemical science, 2025, 16, 3124-3129 |
| 1574056 | CIF | C36 H32 N2 O3 S | P 43 21 2 | 12.4257; 12.4257; 42.988 90; 90; 90 | 6637.3 | He, Ze-Liang; Li, Li; Chen, Zhi-Chao; Du, Wei; Chen, Ying-Chun Palladium-catalysed asymmetric cascade transformations of 4-alken-2-ynyl carbonates to construct complex frameworks. Chemical science, 2025, 16, 3124-3129 |
| 1574057 | CIF | C43 H34 N2 O4 | C 1 2/c 1 | 21.731; 9.151; 34.748 90; 107.204; 90 | 6601 | He, Ze-Liang; Li, Li; Chen, Zhi-Chao; Du, Wei; Chen, Ying-Chun Palladium-catalysed asymmetric cascade transformations of 4-alken-2-ynyl carbonates to construct complex frameworks. Chemical science, 2025, 16, 3124-3129 |
| 1574060 | CIF | C14 H17 O7 P | P 1 | 6.35385; 7.76034; 16.0686 92.9757; 90.6187; 101.846 | 774.2 | Platt, Ffion M.; Wang, Yihong; Cordes, David B.; McKay, Aidan P.; Slawin, Alexandra M. Z.; Panchal, Heena; Smith, Andrew D. Isothiourea-catalysed enantioselective synthesis of phosphonate-functionalised β-lactones Chemical Science, 2025, 16, 6828-6836 |
| 1574061 | CIF | C16 H17 O5 P | P 21 21 21 | 6.279; 8.1645; 30.231 90; 90; 90 | 1549.79 | Platt, Ffion M.; Wang, Yihong; Cordes, David B.; McKay, Aidan P.; Slawin, Alexandra M. Z.; Panchal, Heena; Smith, Andrew D. Isothiourea-catalysed enantioselective synthesis of phosphonate-functionalised β-lactones Chemical Science, 2025, 16, 6828-6836 |
| 1574062 | CIF | C19 H17 O5 P S | P 1 21 1 | 10.3633; 7.8457; 12.019 90; 110.666; 90 | 914.35 | Platt, Ffion M.; Wang, Yihong; Cordes, David B.; McKay, Aidan P.; Slawin, Alexandra M. Z.; Panchal, Heena; Smith, Andrew D. Isothiourea-catalysed enantioselective synthesis of phosphonate-functionalised β-lactones Chemical Science, 2025, 16, 6828-6836 |
| 1574063 | CIF | C84 H69 Cs4 O3 | P -1 | 12.3931; 13.0388; 22.218 75.614; 85.704; 77.205 | 3390.55 | Shen, Yongbing; Cui, Mengxing; Zhang, Haitao; Guo, Hanjie; Nakamura, Jumpei G.; Embs, Jan Peter; Zhao, Jinkui; Yamashita, Masahiro; Fu, Zhendong Signatures of the quantum spin liquid state in triangular-based zig-zag polyaromatic hydrocarbon radicals Chemical Science, 2025, 16, 6345-6354 |
| 1574064 | CIF | C12 H18 Cd2 Cl5 N O2 | P 1 21/c 1 | 7.5573; 15.3477; 16.6274 90; 94.566; 90 | 1922.4 | Zhang, Ke; Qi, Zhikai; Zhang, Nan; Zhao, Xingxing; Fan, Yanli; Sun, Long; Zhou, Guojun; Li, Shi-Li; Zhang, Xian-Ming Efficient energy transfer from organic triplet states to Mn<sup>2+</sup> dopants for dynamic tunable multicolor afterglow in 1D hybrid cadmium chloride. Chemical science, 2025, 16, 6104-6113 |
| 1574073 | CIF | C32 H56 B10 Ga I2 N4 Si2 | C m c m | 23.2436; 18.9817; 13.9956 90; 90; 90 | 6174.9 | Saddington, Artemis; Yao, Shenglai; Lorent, Christian; Driess, Matthias Redox non-innocent bis-silylene aluminium complexes with a carborane backbone Chemical Science, 2025, 16, 6383-6391 |
| 1574074 | CIF | C32 H56 Al2 B10 I3 N4 Si2 | P -1 | 12.2257; 13.2295; 17.0355 109.939; 102.833; 100.765 | 2419.65 | Saddington, Artemis; Yao, Shenglai; Lorent, Christian; Driess, Matthias Redox non-innocent bis-silylene aluminium complexes with a carborane backbone Chemical Science, 2025, 16, 6383-6391 |
| 1574075 | CIF | C46 H72 Al B10 I2 N4 Si2 | P -1 | 14.6482; 14.829; 18.4781 105.669; 106.625; 100.731 | 3548.9 | Saddington, Artemis; Yao, Shenglai; Lorent, Christian; Driess, Matthias Redox non-innocent bis-silylene aluminium complexes with a carborane backbone Chemical Science, 2025, 16, 6383-6391 |
| 1574076 | CIF | C48 H96 Al B10 I2 K N4 O4 Si2 | P 1 21/n 1 | 14.7194; 30.6034; 15.2868 90; 94.863; 90 | 6861.4 | Saddington, Artemis; Yao, Shenglai; Lorent, Christian; Driess, Matthias Redox non-innocent bis-silylene aluminium complexes with a carborane backbone Chemical Science, 2025, 16, 6383-6391 |
| 1574077 | CIF | C32 H56 Al2 B10 I6 N4 Si2 | P 1 21/n 1 | 14.4094; 17.2943; 23.7145 90; 92.257; 90 | 5905.1 | Saddington, Artemis; Yao, Shenglai; Lorent, Christian; Driess, Matthias Redox non-innocent bis-silylene aluminium complexes with a carborane backbone Chemical Science, 2025, 16, 6383-6391 |
| 1574078 | CIF | C58 H100 Al B10 K N4 O2 Si2 | P 1 21/c 1 | 21.7751; 15.1015; 24.8744 90; 109.723; 90 | 7699.8 | Saddington, Artemis; Yao, Shenglai; Lorent, Christian; Driess, Matthias Redox non-innocent bis-silylene aluminium complexes with a carborane backbone Chemical Science, 2025, 16, 6383-6391 |
| 1574079 | CIF | C26 H18 N2 Pt S | P -1 | 11.2341; 13.2688; 17.1255 67.622; 89.72; 65.448 | 2111.14 | Tong, Ka-Ming; Toigo, Jessica; Wolf, Michael O. Deep-blue phosphorescence from platinum(ii) bis(acetylide) complexes with sulfur-bridged dipyridyl ligands. Chemical science, 2025, 16, 5948-5956 |
| 1574080 | CIF | C28 H22 N2 Pt S | P 1 21/n 1 | 10.8444; 11.2925; 18.702 90; 96.706; 90 | 2274.6 | Tong, Ka-Ming; Toigo, Jessica; Wolf, Michael O. Deep-blue phosphorescence from platinum(ii) bis(acetylide) complexes with sulfur-bridged dipyridyl ligands. Chemical science, 2025, 16, 5948-5956 |
| 1574081 | CIF | C26 H18 N2 O Pt S | P -1 | 7.9676; 11.994; 12.5963 117.424; 97.964; 90.392 | 1054.74 | Tong, Ka-Ming; Toigo, Jessica; Wolf, Michael O. Deep-blue phosphorescence from platinum(ii) bis(acetylide) complexes with sulfur-bridged dipyridyl ligands. Chemical science, 2025, 16, 5948-5956 |
| 1574082 | CIF | C30 H26 Cl2 N2 O2 Pt S | P 1 21/c 1 | 10.5828; 26.522; 9.987 90; 99.343; 90 | 2765.9 | Tong, Ka-Ming; Toigo, Jessica; Wolf, Michael O. Deep-blue phosphorescence from platinum(ii) bis(acetylide) complexes with sulfur-bridged dipyridyl ligands. Chemical science, 2025, 16, 5948-5956 |
| 1574083 | CIF | C28 H22 N2 O Pt S | P -1 | 9.2869; 12.7332; 21.2615 89.275; 82.262; 71.515 | 2361.6 | Tong, Ka-Ming; Toigo, Jessica; Wolf, Michael O. Deep-blue phosphorescence from platinum(ii) bis(acetylide) complexes with sulfur-bridged dipyridyl ligands. Chemical science, 2025, 16, 5948-5956 |
| 1574084 | CIF | C12 H16 I2 N4 O Sm | P 1 21/m 1 | 8.94497; 7.9358; 12.43051 90; 93.4456; 90 | 880.79 | Viborg, Anton; Dunstan, Maja A.; Yutronkie, Nathan J.; Chanda, Amit; Trier, Felix; Pryds, Nini; Wilhelm, Fabrice; Rogalev, Andrei; Pinkowicz, Dawid; Pedersen, Kasper S. Disentangling chemical pressure and superexchange effects in lanthanide–organic valence tautomerism Chemical Science, 2025, 16, 6879-6885 |
Back to the search form
Your own data is not in the COD? Deposit it, thanks!

