Crystallography Open Database
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|---|---|---|---|---|---|---|
| 1513717 | CIF | C92 H162 Cr7 F8 N Ni O35 | C 1 2/c 1 | 55.3514; 16.6288; 32.7345 90; 115.557; 90 | 27181.7 | Whitehead, George F. S.; Ferrando-Soria, Jesùs; Christie, Lorna G.; Chilton, Nicholas F.; Timco, Grigore A.; Moro, Fabrizio; Winpenny, Richard E. P. The acid test: the chemistry of carboxylic acid functionalised {Cr7Ni} rings Chemical Science, 2014, 5, 235 |
| 1513718 | CIF | C94 H167 Cr7 F8 N2 Ni O34 | P 1 21/c 1 | 25.0881; 16.4808; 33.9931 90; 91.685; 90 | 14049.1 | Whitehead, George F. S.; Ferrando-Soria, Jesùs; Christie, Lorna G.; Chilton, Nicholas F.; Timco, Grigore A.; Moro, Fabrizio; Winpenny, Richard E. P. The acid test: the chemistry of carboxylic acid functionalised {Cr7Ni} rings Chemical Science, 2014, 5, 235 |
| 1513719 | CIF | C98 H175 Cr7 F8 N2 Ni O34 | P 1 21/n 1 | 16.2899; 30.037; 29.588 90; 97.377; 90 | 14357.6 | Whitehead, George F. S.; Ferrando-Soria, Jesùs; Christie, Lorna G.; Chilton, Nicholas F.; Timco, Grigore A.; Moro, Fabrizio; Winpenny, Richard E. P. The acid test: the chemistry of carboxylic acid functionalised {Cr7Ni} rings Chemical Science, 2014, 5, 235 |
| 1513720 | CIF | C359 H630 Cr28 Cu4 F32 N4 Ni4 O141 | P 4/n c c :2 | 42.289; 42.289; 31.7707 90; 90; 90 | 56817.4 | Whitehead, George F. S.; Ferrando-Soria, Jesùs; Christie, Lorna G.; Chilton, Nicholas F.; Timco, Grigore A.; Moro, Fabrizio; Winpenny, Richard E. P. The acid test: the chemistry of carboxylic acid functionalised {Cr7Ni} rings Chemical Science, 2014, 5, 235 |
| 1513721 | CIF | C549 H930 Cr42 F48 N6 Ni6 O207 Zn4 | P 1 21/n 1 | 39.9717; 48.6332; 43.5363 90; 91.283; 90 | 84611 | Whitehead, George F. S.; Ferrando-Soria, Jesùs; Christie, Lorna G.; Chilton, Nicholas F.; Timco, Grigore A.; Moro, Fabrizio; Winpenny, Richard E. P. The acid test: the chemistry of carboxylic acid functionalised {Cr7Ni} rings Chemical Science, 2014, 5, 235 |
| 1513722 | CIF | C23.5 H56 Si6 | C 1 2/c 1 | 17.135; 9.4044; 20.723 90; 101.54; 90 | 3271.9 | Tibbelin, Julius; Wallner, Andreas; Emanuelsson, Rikard; Heijkenskjöld, Filip; Rosenberg, Martin; Yamazaki, Kaoru; Nauroozi, Djawed; Karlsson, Leif; Feifel, Raimund; Pettersson, Roland; Baumgartner, Judith; Ott, Sascha; Ottosson, Henrik 1,4-Disilacyclohexa-2,5-diene: a molecular building block that allows for remarkably strong neutral cyclic cross-hyperconjugation Chemical Science, 2014, 5, 360 |
| 1513723 | CIF | C79.72 H78.59 F48 N14.86 P8 | P -1 | 16.6223; 22.9236; 29.6344 71.154; 78.075; 73.175 | 10149.1 | Hartlieb, Karel J.; Blackburn, Anthea K.; Schneebeli, Severin T.; Forgan, Ross S.; Sarjeant, Amy A.; Stern, Charlotte L.; Cao, Dennis; Stoddart, J. Fraser Topological isomerism in a chiral handcuff catenane Chemical Science, 2014, 5, 90 |
| 1513724 | CIF | C125 H139 F48 N15 O15 P8 | P -1 | 16.475; 18.609; 25.278 105.106; 99.281; 93.008 | 7348 | Hartlieb, Karel J.; Blackburn, Anthea K.; Schneebeli, Severin T.; Forgan, Ross S.; Sarjeant, Amy A.; Stern, Charlotte L.; Cao, Dennis; Stoddart, J. Fraser Topological isomerism in a chiral handcuff catenane Chemical Science, 2014, 5, 90 |
| 1513725 | CIF | C110 H118 F48 N8 O14 P8 | P 1 21/n 1 | 20.0951; 31.3942; 24.2862 90; 94.082; 90 | 15282.6 | Hartlieb, Karel J.; Blackburn, Anthea K.; Schneebeli, Severin T.; Forgan, Ross S.; Sarjeant, Amy A.; Stern, Charlotte L.; Cao, Dennis; Stoddart, J. Fraser Topological isomerism in a chiral handcuff catenane Chemical Science, 2014, 5, 90 |
| 1513726 | CIF | K19 O223.5 P8 U31 | P -4 21 c | 41; 41; 32.818 90; 90; 90 | 55167 | Qiu, Jie; Ling, Jie; Jouffret, Laurent; Thomas, Rebecca; Szymanowski, Jennifer E. S.; Burns, Peter C. Water-soluble multi-cage super tetrahedral uranyl peroxide phosphate clusters Chemical Science, 2014, 5, 303 |
| 1513727 | CIF | C42 H34 | C 1 2/c 1 | 14.515; 15.214; 13.3114 90; 99.134; 90 | 2902.3 | Miyoshi, Hirokazu; Nobusue, Shunpei; Shimizu, Akihiro; Hisaki, Ichiro; Miyata, Mikiji; Tobe, Yoshito Benz[c]indeno[2,1-a]fluorene: a 2,3-naphthoquinodimethane incorporated into an indenofluorene frame Chemical Science, 2014, 5, 163 |
| 1513728 | CIF | C50 H34 Cl2 N2 O2 | P 1 21/c 1 | 9.251; 18.592; 22.277 90; 94.409; 90 | 3820 | Miyoshi, Hirokazu; Nobusue, Shunpei; Shimizu, Akihiro; Hisaki, Ichiro; Miyata, Mikiji; Tobe, Yoshito Benz[c]indeno[2,1-a]fluorene: a 2,3-naphthoquinodimethane incorporated into an indenofluorene frame Chemical Science, 2014, 5, 163 |
| 1513729 | CIF | C45 H40 O3 | P 1 21/c 1 | 8.266; 18.71; 21.637 90; 90.739; 90 | 3346 | Miyoshi, Hirokazu; Nobusue, Shunpei; Shimizu, Akihiro; Hisaki, Ichiro; Miyata, Mikiji; Tobe, Yoshito Benz[c]indeno[2,1-a]fluorene: a 2,3-naphthoquinodimethane incorporated into an indenofluorene frame Chemical Science, 2014, 5, 163 |
| 1513730 | CIF | C90 H73 Cl | P -1 | 8.5044; 19.248; 20.4545 82.0704; 78.1032; 82.3308 | 3225.9 | Miyoshi, Hirokazu; Nobusue, Shunpei; Shimizu, Akihiro; Hisaki, Ichiro; Miyata, Mikiji; Tobe, Yoshito Benz[c]indeno[2,1-a]fluorene: a 2,3-naphthoquinodimethane incorporated into an indenofluorene frame Chemical Science, 2014, 5, 163 |
| 1513731 | CIF | C36 H33 B F6 N11 O6.5 Pd S2 | P b c a | 17.177; 19.182; 24.723 90; 90; 90 | 8146 | Brandt, Jochen R.; Lee, Eunsung; Boursalian, Gregory B.; Ritter, Tobias Mechanism of Electrophilic Fluorination with Pd(IV): Fluoride Capture and Subsequent Oxidative Fluoride Transfer(.) Chemical science (Royal Society of Chemistry : 2010), 2014, 5, 169 |
| 1513732 | CIF | C24 H27 N3 O5 | P -1 | 8.9819; 10.28; 13.008 86.49; 73.036; 79.688 | 1130.21 | Zhang, Yan; Wu, Qifan; Cui, Sunliang Rh(iii)-catalyzed C–H activation–desymmetrization of diazabicycles with arenes: facile synthesis of functionalized cyclopentenes Chemical Science, 2014, 5, 297 |
| 1513762 | CIF | C34 H33 Cl3 N2 Pd | P 1 n 1 | 11.7926; 9.4147; 14.555 90; 101.906; 90 | 1581.19 | Huo, Ping; Liu, Wanyun; He, Xiaohui; Wei, Zhenhong; Chen, Yiwang Substituent effects and activation mechanism of norbornene polymerization catalyzed by three-dimensional geometry α-diimine palladium complexes Polymer Chemistry, 2014, 5, 1210 |
| 1513763 | CIF | C35 H35 Cl N2 Pd | P 1 21/n 1 | 12.0765; 19.5745; 12.7667 90; 90.899; 90 | 3017.6 | Huo, Ping; Liu, Wanyun; He, Xiaohui; Wei, Zhenhong; Chen, Yiwang Substituent effects and activation mechanism of norbornene polymerization catalyzed by three-dimensional geometry α-diimine palladium complexes Polymer Chemistry, 2014, 5, 1210 |
| 1513764 | CIF | C119 H90 Cl18 N8 Pd4 | P -1 | 9.4659; 18.1651; 18.9183 68.501; 75.588; 84.629 | 2931.4 | Huo, Ping; Liu, Wanyun; He, Xiaohui; Wei, Zhenhong; Chen, Yiwang Substituent effects and activation mechanism of norbornene polymerization catalyzed by three-dimensional geometry α-diimine palladium complexes Polymer Chemistry, 2014, 5, 1210 |
| 1513765 | CIF | C32 H30 Fe2 Ru Si2 | P -1 | 14.3465; 14.4684; 14.5968 66.44; 68.64; 86.12 | 2575.74 | Erhard, Maximilian; Lam, Kevin; Haddow, Mairi; Whittell, George R.; Geiger, William E.; Manners, Ian Polyferrocenylsilane homopolymers and diblock copolymers with pendant ruthenocenyl groups by photocontrolled ring-opening polymerisation Polymer Chemistry, 2014, 5, 1264 |
| 1513766 | CIF | C21 H20 Fe Ru Si | P 1 21/c 1 | 12.4947; 8.9461; 31.2176 90; 100.039; 90 | 3436.04 | Erhard, Maximilian; Lam, Kevin; Haddow, Mairi; Whittell, George R.; Geiger, William E.; Manners, Ian Polyferrocenylsilane homopolymers and diblock copolymers with pendant ruthenocenyl groups by photocontrolled ring-opening polymerisation Polymer Chemistry, 2014, 5, 1264 |
| 1513767 | CIF | C10 H9 Br Ru | P 1 21/m 1 | 7.1295; 8.9916; 7.2907 90; 109.503; 90 | 440.56 | Erhard, Maximilian; Lam, Kevin; Haddow, Mairi; Whittell, George R.; Geiger, William E.; Manners, Ian Polyferrocenylsilane homopolymers and diblock copolymers with pendant ruthenocenyl groups by photocontrolled ring-opening polymerisation Polymer Chemistry, 2014, 5, 1264 |
| 1513791 | CIF | C70 H66 Cl6 O4 Os P3 S | P 1 21/c 1 | 23.9712; 10.7966; 25.4621 90; 95.78; 90 | 6556.3 | Zhu, Congqing; Luo, Ming; Zhu, Qin; Zhu, Jun; Schleyer, Paul V. R.; Wu, Judy I-Chia; Lu, Xin; Xia, Haiping Planar Möbius aromatic pentalenes incorporating 16 and 18 valence electron osmiums. Nature communications, 2014, 5, 3265 |
| 1513792 | CIF | C64.5 H57 Al2 Cl12 O3 Os P3 | P 1 21/n 1 | 18.4337; 19.2879; 20.2958 90; 97.813; 90 | 7149.1 | Zhu, Congqing; Luo, Ming; Zhu, Qin; Zhu, Jun; Schleyer, Paul V. R.; Wu, Judy I-Chia; Lu, Xin; Xia, Haiping Planar Möbius aromatic pentalenes incorporating 16 and 18 valence electron osmiums. Nature communications, 2014, 5, 3265 |
| 1513793 | CIF | C66 H58 Cl3 O5 Os P3 | P 1 21/c 1 | 12.6439; 21.0196; 21.9093 90; 96.0021; 90 | 5790.91 | Zhu, Congqing; Luo, Ming; Zhu, Qin; Zhu, Jun; Schleyer, Paul V. R.; Wu, Judy I-Chia; Lu, Xin; Xia, Haiping Planar Möbius aromatic pentalenes incorporating 16 and 18 valence electron osmiums. Nature communications, 2014, 5, 3265 |
| 1513794 | CIF | C21 H29 F5 Si3 | P b c a | 11.6307; 12.5277; 33.4761 90; 90; 90 | 4877.7 | Inagaki, Yusuke; Nakamoto, Masaaki; Sekiguchi, Akira A Diels-Alder super diene breaking benzene into C2H2 and C4H4 units. Nature communications, 2014, 5, 3018 |
| 1513795 | CIF | C21 H31 F5 Si3 | P b c a | 11.6585; 12.5084; 33.328 90; 90; 90 | 4860.2 | Inagaki, Yusuke; Nakamoto, Masaaki; Sekiguchi, Akira A Diels-Alder super diene breaking benzene into C2H2 and C4H4 units. Nature communications, 2014, 5, 3018 |
| 1513796 | CIF | C21 H29 F5 Si3 | P c a 21 | 19.1914; 10.6017; 23.3513 90; 90; 90 | 4751.1 | Inagaki, Yusuke; Nakamoto, Masaaki; Sekiguchi, Akira A Diels-Alder super diene breaking benzene into C2H2 and C4H4 units. Nature communications, 2014, 5, 3018 |
| 1513797 | CIF | C25 H33 F5 Si3 | P -1 | 9.6564; 11.3871; 12.9349 72.1; 81.25; 79.77 | 1324.69 | Inagaki, Yusuke; Nakamoto, Masaaki; Sekiguchi, Akira A Diels-Alder super diene breaking benzene into C2H2 and C4H4 units. Nature communications, 2014, 5, 3018 |
| 1513798 | CIF | C11 H15 N5 O7 | P 1 21 1 | 5.6548; 27.587; 8.526 90; 95.291; 90 | 1324.4 | Zhao, Hang; Guo, Xiurong; He, Shiliang; Zeng, Xin; Zhou, Xinglong; Zhang, Chaoliang; Hu, Jing; Wu, Xiaohua; Xing, Zhihua; Chu, Liangyin; He, Yang; Chen, Qianming Complex self-assembly of pyrimido[4,5-d]pyrimidine nucleoside supramolecular structures. Nature communications, 2014, 5, 3108 |
| 1513799 | CIF | C11 H13 N5 O5 | P 1 | 4.9116; 8.8528; 13.96 105.332; 93.529; 91.847 | 583.54 | Zhao, Hang; Guo, Xiurong; He, Shiliang; Zeng, Xin; Zhou, Xinglong; Zhang, Chaoliang; Hu, Jing; Wu, Xiaohua; Xing, Zhihua; Chu, Liangyin; He, Yang; Chen, Qianming Complex self-assembly of pyrimido[4,5-d]pyrimidine nucleoside supramolecular structures. Nature communications, 2014, 5, 3108 |
| 1513839 | CIF | C27 H37 N2 P | C 1 2/c 1 | 20.0613; 6.9855; 38.187 90; 102.741; 90 | 5219.7 | Tondreau, Aaron M.; Benkő, Zoltán; Harmer, Jeffrey R.; Grützmacher, Hansjörg Sodium phosphaethynolate, Na(OCP), as a “P” transfer reagent for the synthesis of N-heterocyclic carbene supported P3 and PAsP radicals Chemical Science, 2014, 5, 1545 |
| 1513840 | CIF | C58 H80 Cl N4 O P3 | P 1 21/c 1 | 17.0305; 21.4738; 16.7809 90; 115.996; 90 | 5516 | Tondreau, Aaron M.; Benkő, Zoltán; Harmer, Jeffrey R.; Grützmacher, Hansjörg Sodium phosphaethynolate, Na(OCP), as a “P” transfer reagent for the synthesis of N-heterocyclic carbene supported P3 and PAsP radicals Chemical Science, 2014, 5, 1545 |
| 1513841 | CIF | C72 H116 Cl N4 O3 P7 Si2 | P 1 21/n 1 | 22.3995; 12.1255; 29.5997 90; 90.82; 90 | 8038.6 | Tondreau, Aaron M.; Benkő, Zoltán; Harmer, Jeffrey R.; Grützmacher, Hansjörg Sodium phosphaethynolate, Na(OCP), as a “P” transfer reagent for the synthesis of N-heterocyclic carbene supported P3 and PAsP radicals Chemical Science, 2014, 5, 1545 |
| 1513842 | CIF | C54 H72 N4 P3 | P -1 | 11.9151; 13.5428; 15.8914 85.68; 89.601; 79.255 | 2512.11 | Tondreau, Aaron M.; Benkő, Zoltán; Harmer, Jeffrey R.; Grützmacher, Hansjörg Sodium phosphaethynolate, Na(OCP), as a “P” transfer reagent for the synthesis of N-heterocyclic carbene supported P3 and PAsP radicals Chemical Science, 2014, 5, 1545 |
| 1513843 | CIF | C66 H96 As Cl N4 O3 P2 | C 1 2/c 1 | 24.928; 14.103; 17.8654 90; 92.468; 90 | 6274.9 | Tondreau, Aaron M.; Benkő, Zoltán; Harmer, Jeffrey R.; Grützmacher, Hansjörg Sodium phosphaethynolate, Na(OCP), as a “P” transfer reagent for the synthesis of N-heterocyclic carbene supported P3 and PAsP radicals Chemical Science, 2014, 5, 1545 |
| 1513844 | CIF | C54 H72 As N4 P2 | C 1 c 1 | 10.2682; 42.469; 24.23 90; 92.756; 90 | 10554 | Tondreau, Aaron M.; Benkő, Zoltán; Harmer, Jeffrey R.; Grützmacher, Hansjörg Sodium phosphaethynolate, Na(OCP), as a “P” transfer reagent for the synthesis of N-heterocyclic carbene supported P3 and PAsP radicals Chemical Science, 2014, 5, 1545 |
| 1513845 | CIF | C60 H78 N4 O4 P6 | P 1 21/n 1 | 23.6782; 18.3268; 29.7342 90; 103.981; 90 | 12520.8 | Tondreau, Aaron M.; Benkő, Zoltán; Harmer, Jeffrey R.; Grützmacher, Hansjörg Sodium phosphaethynolate, Na(OCP), as a “P” transfer reagent for the synthesis of N-heterocyclic carbene supported P3 and PAsP radicals Chemical Science, 2014, 5, 1545 |
| 1513846 | CIF | C39 H40 Cl4 F6 N3 O6 P2 Pt S2 | C 1 2/c 1 | 20.729; 16.7382; 13.9693 90; 93.679; 90 | 4836.9 | Tulchinsky, Yuri; Kozuch, Sebastian; Saha, Prasenjit; Botoshansky, Mark; Shimon, Linda J. W.; Gandelman, Mark Cation‒cation bonding in nitrenium metal complexes Chemical Science, 2014, 5, 1305 |
| 1513847 | CIF | C60 H61 F12 K N3 O13 P3 Pt S4 | P -1 | 13.778; 14.772; 17.476 84.622; 82.6; 83.819 | 3495.21 | Tulchinsky, Yuri; Kozuch, Sebastian; Saha, Prasenjit; Botoshansky, Mark; Shimon, Linda J. W.; Gandelman, Mark Cation–cation bonding in nitrenium metal complexes Chemical Science, 2014, 5, 1305 |
| 1513848 | CIF | C48 H64 F12 N3 O3.5 P4 Rh | P 1 21/c 1 | 13.854; 22.376; 19.553 90; 109.609; 90 | 5709.8 | Tulchinsky, Yuri; Kozuch, Sebastian; Saha, Prasenjit; Botoshansky, Mark; Shimon, Linda J. W.; Gandelman, Mark Cation‒cation bonding in nitrenium metal complexes Chemical Science, 2014, 5, 1305 |
| 1513849 | CIF | C38 H40 Cl5 F6 N3 O6 P2 Pt S2 | C 1 2/c 1 | 26.8737; 12.5922; 16.0468 90; 120.726; 90 | 4667.93 | Tulchinsky, Yuri; Kozuch, Sebastian; Saha, Prasenjit; Botoshansky, Mark; Shimon, Linda J. W.; Gandelman, Mark Cation‒cation bonding in nitrenium metal complexes Chemical Science, 2014, 5, 1305 |
| 1513850 | CIF | C120 H126 F24 N6 O4 P10 Rh2 | P 1 21/c 1 | 15.7239; 17.5295; 23.5911 90; 106.188; 90 | 6244.7 | Tulchinsky, Yuri; Kozuch, Sebastian; Saha, Prasenjit; Botoshansky, Mark; Shimon, Linda J. W.; Gandelman, Mark Cation‒cation bonding in nitrenium metal complexes Chemical Science, 2014, 5, 1305 |
| 1513851 | CIF | C56 H44 Ca2 F12 N12 O16 S4 | P -1 | 11.2305; 12.1307; 13.8812 97.683; 111.479; 105.007 | 1643.89 | Vantomme, Ghislaine; Hafezi, Nema; Lehn, Jean-Marie A light-induced reversible phase separation and its coupling to a dynamic library of imines Chemical Science, 2014, 5, 1475 |
| 1513852 | CIF | C26 H30 Ca Cl2 N8 O | P 1 21/c 1 | 13.9231; 13.4981; 15.7366 90; 104.682; 90 | 2860.9 | Vantomme, Ghislaine; Hafezi, Nema; Lehn, Jean-Marie A light-induced reversible phase separation and its coupling to a dynamic library of imines Chemical Science, 2014, 5, 1475 |
| 1513853 | CIF | C13 H10 Ca F6 N4 O6 S2 | P -1 | 8.8738; 10.2258; 11.11 92.066; 98.016; 100.127 | 980.84 | Vantomme, Ghislaine; Hafezi, Nema; Lehn, Jean-Marie A light-induced reversible phase separation and its coupling to a dynamic library of imines Chemical Science, 2014, 5, 1475 |
| 1513854 | CIF | C33 H29 Ca Cl2 N12 O8 | C 1 2/c 1 | 11.208; 19.89; 18.423 90; 96.346; 90 | 4081.8 | Vantomme, Ghislaine; Hafezi, Nema; Lehn, Jean-Marie A light-induced reversible phase separation and its coupling to a dynamic library of imines Chemical Science, 2014, 5, 1475 |
| 1513855 | CIF | C58 H57 Ca2 N15 O8 | P -1 | 12.8935; 14.4392; 18.0468 92.81; 107.021; 114.714 | 2861 | Vantomme, Ghislaine; Hafezi, Nema; Lehn, Jean-Marie A light-induced reversible phase separation and its coupling to a dynamic library of imines Chemical Science, 2014, 5, 1475 |
| 1513856 | CIF | C11 H20 Au Cl N4 O | P -1 | 7.5169; 9.9819; 10.683 113.158; 90.038; 98.162 | 728.12 | Chen, Yong; Cheng, Gang; Li, Kai; Shelar, Deepak P.; Lu, Wei; Che, Chi-Ming Phosphorescent polymeric nanomaterials with metallophilic d10⋯d10 interactions self-assembled from [Au(NHC)2]+ and [M(CN)2]− Chemical Science, 2014, 5, 1348 |
| 1513857 | CIF | C12 H16 Au2 N6 | C 1 2/m 1 | 15.634; 6.3008; 8.0648 90; 108.223; 90 | 754.59 | Chen, Yong; Cheng, Gang; Li, Kai; Shelar, Deepak P.; Lu, Wei; Che, Chi-Ming Phosphorescent polymeric nanomaterials with metallophilic d10⋯d10 interactions self-assembled from [Au(NHC)2]+ and [M(CN)2]− Chemical Science, 2014, 5, 1348 |
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