Crystallography Open Database

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7231040 CIFC21 H21 P S3 SeP 1 21/c 110.8302; 19.7686; 10.947
90; 112.874; 90		2159.43Davidson, Ross J.; Milan, David C.; Al-Owaedi, Oday A.; Ismael, Ali K.; Nichols, Richard J.; Higgins, Simon J.; Lambert, Colin J.; Yufit, Dmitry S.; Beeby, Andrew
Conductance of ‘bare-bones’ tripodal molecular wires
RSC Advances, 2018, 8, 23585
7231041 CIFC21 H21 O P S3P 1 21/n 110.1402; 20.3778; 10.7202
90; 114.969; 90		2008.13Davidson, Ross J.; Milan, David C.; Al-Owaedi, Oday A.; Ismael, Ali K.; Nichols, Richard J.; Higgins, Simon J.; Lambert, Colin J.; Yufit, Dmitry S.; Beeby, Andrew
Conductance of ‘bare-bones’ tripodal molecular wires
RSC Advances, 2018, 8, 23585
7231042 CIFC21 H23 N6 Na O7 PbP -110.0155; 11.6906; 11.8211
97.673; 99.525; 112.778		1228.49Wu, Xiren; Shen, Xin; Fan, Shuran; Trivedi, Manoj; Li, Boahong; Kumar, Abhinav; Liu, Jianqiang
The utilization of a stable 2D bilayer MOF for simultaneous study of luminescent and photocatalytic properties: experimental studies and theoretical analysis
RSC Advances, 2018, 8, 23529
7231053 CIFC10 H12 N6 S2 ZnP 1 21/c 111.9876; 11.6755; 11.8909
90; 109.447; 90		1569.32Di Santo, Alejandro; Pérez, Hiram; Echeverría, Gustavo A.; Piro, Oscar E.; Iglesias, Rodrigo A.; Carbonio, Raúl E.; Ben Altabef, Aida; Gil, Diego M.
Exploring weak intermolecular interactions in thiocyanate-bonded Zn(ii) and Cd(ii) complexes with methylimidazole: crystal structures, Hirshfeld surface analysis and luminescence properties
RSC Advances, 2018, 8, 23891
7231054 CIFC10 H12 N6 S2 ZnP n m a8.4322; 12.5613; 13.9647
90; 90; 90		1479.13Di Santo, Alejandro; Pérez, Hiram; Echeverría, Gustavo A.; Piro, Oscar E.; Iglesias, Rodrigo A.; Carbonio, Raúl E.; Ben Altabef, Aida; Gil, Diego M.
Exploring weak intermolecular interactions in thiocyanate-bonded Zn(ii) and Cd(ii) complexes with methylimidazole: crystal structures, Hirshfeld surface analysis and luminescence properties
RSC Advances, 2018, 8, 23891
7231055 CIFC18 H24 Cd N10 S2P -18.1914; 8.7859; 9.4685
90.962; 112.629; 104.257		604.85Di Santo, Alejandro; Pérez, Hiram; Echeverría, Gustavo A.; Piro, Oscar E.; Iglesias, Rodrigo A.; Carbonio, Raúl E.; Ben Altabef, Aida; Gil, Diego M.
Exploring weak intermolecular interactions in thiocyanate-bonded Zn(ii) and Cd(ii) complexes with methylimidazole: crystal structures, Hirshfeld surface analysis and luminescence properties
RSC Advances, 2018, 8, 23891
7231056 CIFC10 H12 Cd N6 S2C m c 2113.9249; 14.7811; 6.9732
90; 90; 90		1435.26Di Santo, Alejandro; Pérez, Hiram; Echeverría, Gustavo A.; Piro, Oscar E.; Iglesias, Rodrigo A.; Carbonio, Raúl E.; Ben Altabef, Aida; Gil, Diego M.
Exploring weak intermolecular interactions in thiocyanate-bonded Zn(ii) and Cd(ii) complexes with methylimidazole: crystal structures, Hirshfeld surface analysis and luminescence properties
RSC Advances, 2018, 8, 23891
7231064 CIFC26 H25 N O8P 1 21/c 110.147; 20.9021; 11.86
90; 109.529; 90		2370.7Huang, Ying; Huang, Yi-Xin; Sun, Jing; Yan, Chao-Guo
Diastereoselective synthesis of dispirooxindoles via [3+2] cycloaddition of azomethine ylides to 3-phenacylideneoxindoles and evaluation of their cytotoxicity
RSC Advances, 2018, 8, 23990
7231065 CIFC26 H24 F N O8P -110.1592; 13.747; 17.824
90.023; 93.75; 101.015		2438Huang, Ying; Huang, Yi-Xin; Sun, Jing; Yan, Chao-Guo
Diastereoselective synthesis of dispirooxindoles via [3+2] cycloaddition of azomethine ylides to 3-phenacylideneoxindoles and evaluation of their cytotoxicity
RSC Advances, 2018, 8, 23990
7231066 CIFC27 H27 N O9P -110.557; 11.363; 12.92
112.497; 102.659; 105.65		1285.1Huang, Ying; Huang, Yi-Xin; Sun, Jing; Yan, Chao-Guo
Diastereoselective synthesis of dispirooxindoles via [3+2] cycloaddition of azomethine ylides to 3-phenacylideneoxindoles and evaluation of their cytotoxicity
RSC Advances, 2018, 8, 23990
7231119 CIFC2 H2 N4 O2P 41 21 26.8413; 6.8413; 18.8196
90; 90; 90		880.82Zhang, Pengcheng; Zhao, Xiuxiu; Du, Yao; Gozin, Michael; Li, Shenghua; Pang, Siping
Polymorphism, phase transformation and energetic properties of 3-nitro-1,2,4-triazole
RSC Advances, 2018, 8, 24627
7231120 CIFC2 H2 N4 O2P 1 21/c 18.7895; 10.0707; 9.9645
90; 107.082; 90		843.11Zhang, Pengcheng; Zhao, Xiuxiu; Du, Yao; Gozin, Michael; Li, Shenghua; Pang, Siping
Polymorphism, phase transformation and energetic properties of 3-nitro-1,2,4-triazole
RSC Advances, 2018, 8, 24627
7231130 CIFC40 H26 Si2P -110.09473; 10.11978; 16.43719
78.2801; 76.5644; 78.9663		1580.73Tokoro, Yuichiro; Ohtsuka, Nobuhiko; Fukuzawa, Shin-ichi; Oyama, Toshiyuki
Intra- and intermolecular interaction of anthracene moieties in 7,8-disilabicyclo[3.3.0]octadienyl-bridged bisanthracenes
RSC Advances, 2018, 8, 25177
7231131 CIFC41 H28 Cl2 O Si2P -110.3826; 11.6392; 14.3255
98.55; 97.125; 107.149		1609.8Tokoro, Yuichiro; Ohtsuka, Nobuhiko; Fukuzawa, Shin-ichi; Oyama, Toshiyuki
Intra- and intermolecular interaction of anthracene moieties in 7,8-disilabicyclo[3.3.0]octadienyl-bridged bisanthracenes
RSC Advances, 2018, 8, 25177
7231132 CIFC48 H42 Si2P -110.0656; 11.6376; 17.0207
81.018; 82.595; 71.977		1865.81Tokoro, Yuichiro; Ohtsuka, Nobuhiko; Fukuzawa, Shin-ichi; Oyama, Toshiyuki
Intra- and intermolecular interaction of anthracene moieties in 7,8-disilabicyclo[3.3.0]octadienyl-bridged bisanthracenes
RSC Advances, 2018, 8, 25177
7231162 CIFC36 H22 Mg3 O20P 1 21/c 114.726; 15.126; 13.5397
90; 116.871; 90		2690.3Yang, Zhu-Xi; Qian, Yin; Yu, Jing-Wei; Zhai, Lu; Zhang, Wen-Wei; Ren, Xiao-Ming
Dimensionality of luminescent coordination polymers of magnesium ions and 1,1′-ethynebenzene-3,3′,5,5′-tetracarboxylic acid modulated by structural inducing agents
RSC Advances, 2018, 8, 25489
7231163 CIFC24 H26 Mg N2 O12P 1 21/n 18.0079; 16.83; 19.043
90; 100.254; 90		2525.5Yang, Zhu-Xi; Qian, Yin; Yu, Jing-Wei; Zhai, Lu; Zhang, Wen-Wei; Ren, Xiao-Ming
Dimensionality of luminescent coordination polymers of magnesium ions and 1,1′-ethynebenzene-3,3′,5,5′-tetracarboxylic acid modulated by structural inducing agents
RSC Advances, 2018, 8, 25489
7231164 CIFC18 H16 Mg2 O13C 1 2/c 116.8934; 14.199; 12.0673
90; 115.993; 90		2601.8Yang, Zhu-Xi; Qian, Yin; Yu, Jing-Wei; Zhai, Lu; Zhang, Wen-Wei; Ren, Xiao-Ming
Dimensionality of luminescent coordination polymers of magnesium ions and 1,1′-ethynebenzene-3,3′,5,5′-tetracarboxylic acid modulated by structural inducing agents
RSC Advances, 2018, 8, 25489
7231165 CIFC43 H31 Fe2 O8 Ru2 S2P -111.9891; 12.0802; 15.8425
92.359; 109.803; 108.441		2019.5Xu, Lei; Jiang, Liping; Li, Shasha; Zhang, Guofang; Zhang, Weiqiang; Gao, Ziwei
Reaction of FcCCC(O)R (Fc = ferrocenyl) with Ru3(CO)12 leading to unexpected nitro-group reduced ruthenoles and 1,2-CO-inserted triruthenium clusters
RSC Advances, 2018, 8, 25268
7231166 CIFC27 H12 Fe O11 Ru3 SC 1 2/c 117.659; 10.0342; 33.191
90; 101.971; 90		5753.3Xu, Lei; Jiang, Liping; Li, Shasha; Zhang, Guofang; Zhang, Weiqiang; Gao, Ziwei
Reaction of FcCCC(O)R (Fc = ferrocenyl) with Ru3(CO)12 leading to unexpected nitro-group reduced ruthenoles and 1,2-CO-inserted triruthenium clusters
RSC Advances, 2018, 8, 25268
7231167 CIFC44 H28 Fe2 O8 Ru2P 1 21/c 19.8872; 24.2002; 15.6004
90; 96.503; 90		3708.7Xu, Lei; Jiang, Liping; Li, Shasha; Zhang, Guofang; Zhang, Weiqiang; Gao, Ziwei
Reaction of FcCCC(O)R (Fc = ferrocenyl) with Ru3(CO)12 leading to unexpected nitro-group reduced ruthenoles and 1,2-CO-inserted triruthenium clusters
RSC Advances, 2018, 8, 25268
7231168 CIFC40 H24 Fe2 O8 Ru2 S2P 1 21/n 112.0452; 18.9355; 16.732
90; 107.767; 90		3634.3Xu, Lei; Jiang, Liping; Li, Shasha; Zhang, Guofang; Zhang, Weiqiang; Gao, Ziwei
Reaction of FcCCC(O)R (Fc = ferrocenyl) with Ru3(CO)12 leading to unexpected nitro-group reduced ruthenoles and 1,2-CO-inserted triruthenium clusters
RSC Advances, 2018, 8, 25268
7231169 CIFC5.03 H2.74 Fe0.23 O1.37 Ru0.34 S0.23P 1 21/n 114.508; 8.676; 34.637
90; 99.749; 90		4297Xu, Lei; Jiang, Liping; Li, Shasha; Zhang, Guofang; Zhang, Weiqiang; Gao, Ziwei
Reaction of FcCCC(O)R (Fc = ferrocenyl) with Ru3(CO)12 leading to unexpected nitro-group reduced ruthenoles and 1,2-CO-inserted triruthenium clusters
RSC Advances, 2018, 8, 25268
7231170 CIFC44 H28 Fe2 O8 Ru2P -112.42; 12.656; 14.05
94.236; 106.349; 107.077		1996Xu, Lei; Jiang, Liping; Li, Shasha; Zhang, Guofang; Zhang, Weiqiang; Gao, Ziwei
Reaction of FcCCC(O)R (Fc = ferrocenyl) with Ru3(CO)12 leading to unexpected nitro-group reduced ruthenoles and 1,2-CO-inserted triruthenium clusters
RSC Advances, 2018, 8, 25268
7231171 CIFC45 H30 Cl2 Fe2 N2 O10 Ru2P b c a22.884; 15.4397; 23.772
90; 90; 90		8399.2Xu, Lei; Jiang, Liping; Li, Shasha; Zhang, Guofang; Zhang, Weiqiang; Gao, Ziwei
Reaction of FcCCC(O)R (Fc = ferrocenyl) with Ru3(CO)12 leading to unexpected nitro-group reduced ruthenoles and 1,2-CO-inserted triruthenium clusters
RSC Advances, 2018, 8, 25268
7231172 CIFC29 H15 Fe N O11 Ru3P b c a13.995; 11.729; 34.893
90; 90; 90		5728Xu, Lei; Jiang, Liping; Li, Shasha; Zhang, Guofang; Zhang, Weiqiang; Gao, Ziwei
Reaction of FcCCC(O)R (Fc = ferrocenyl) with Ru3(CO)12 leading to unexpected nitro-group reduced ruthenoles and 1,2-CO-inserted triruthenium clusters
RSC Advances, 2018, 8, 25268
7231173 CIFC44 H30 Fe2 N2 O8 Ru2C 1 2/c 129.747; 19.893; 15.727
90; 114.924; 90		8440Xu, Lei; Jiang, Liping; Li, Shasha; Zhang, Guofang; Zhang, Weiqiang; Gao, Ziwei
Reaction of FcCCC(O)R (Fc = ferrocenyl) with Ru3(CO)12 leading to unexpected nitro-group reduced ruthenoles and 1,2-CO-inserted triruthenium clusters
RSC Advances, 2018, 8, 25268
7231185 CIFC32 H40 O5P 21 21 2114.1118; 14.5427; 15.5885
90; 90; 90		3199.13Xie, Yang-Guo; Zhang, Weiyue; Zhu, Sheng-lan; Cheng, Tao-fang; Wu, Guo-jing; Muhammad, Ishaq; Yan, Shi-kai; Zhang, Yan; Jin, Hui-zi; Zhang, Wei-dong
Xyloplains A‒F, six new guaiane-type sesquiterpenoid dimers from Xylopia vielana
RSC Advances, 2018, 8, 25719
7231186 CIFC30 H36 O4P 21 21 217.3802; 14.7759; 23.5281
90; 90; 90		2565.72Xie, Yang-Guo; Zhang, Weiyue; Zhu, Sheng-lan; Cheng, Tao-fang; Wu, Guo-jing; Muhammad, Ishaq; Yan, Shi-kai; Zhang, Yan; Jin, Hui-zi; Zhang, Wei-dong
Xyloplains A‒F, six new guaiane-type sesquiterpenoid dimers from Xylopia vielana
RSC Advances, 2018, 8, 25719
7231187 CIFC38 H29 N3 P2P 1 21/n 115.517; 11.9307; 18.3226
90; 111.801; 90		3149.4Radhakrishna, Latchupatula; Pandey, Madhusudan K.; Balakrishna, Maravanji S.
1,2,3-Triazole based bisphosphine, 5-(diphenylphosphanyl)-1-(2-(diphenylphosphanyl)-phenyl)-4-phenyl-1H-1,2,3-triazole: an ambidentate ligand with switchable coordination modes
RSC Advances, 2018, 8, 25704
7231188 CIFC43 H30 Cl3 Mo N3 O4 P2P 1 21/c 114.1841; 11.2966; 25.2699
90; 97.008; 90		4018.8Radhakrishna, Latchupatula; Pandey, Madhusudan K.; Balakrishna, Maravanji S.
1,2,3-Triazole based bisphosphine, 5-(diphenylphosphanyl)-1-(2-(diphenylphosphanyl)-phenyl)-4-phenyl-1H-1,2,3-triazole: an ambidentate ligand with switchable coordination modes
RSC Advances, 2018, 8, 25704
7231189 CIFC42 H29 Au Cl N3 O4 P2 WP 1 21/n 112.5915; 20.0214; 15.3286
90; 92.147; 90		3861.62Radhakrishna, Latchupatula; Pandey, Madhusudan K.; Balakrishna, Maravanji S.
1,2,3-Triazole based bisphosphine, 5-(diphenylphosphanyl)-1-(2-(diphenylphosphanyl)-phenyl)-4-phenyl-1H-1,2,3-triazole: an ambidentate ligand with switchable coordination modes
RSC Advances, 2018, 8, 25704
7231190 CIFC43 H30 Cl3 N3 O4 P2 WP 1 21/c 114.1865; 11.2881; 25.1974
90; 97.169; 90		4003.5Radhakrishna, Latchupatula; Pandey, Madhusudan K.; Balakrishna, Maravanji S.
1,2,3-Triazole based bisphosphine, 5-(diphenylphosphanyl)-1-(2-(diphenylphosphanyl)-phenyl)-4-phenyl-1H-1,2,3-triazole: an ambidentate ligand with switchable coordination modes
RSC Advances, 2018, 8, 25704
7231191 CIFC39 H30 Cl5 N3 P2 PdP 1 21/c 113.351; 11.0729; 25.9296
90; 95.69; 90		3814.4Radhakrishna, Latchupatula; Pandey, Madhusudan K.; Balakrishna, Maravanji S.
1,2,3-Triazole based bisphosphine, 5-(diphenylphosphanyl)-1-(2-(diphenylphosphanyl)-phenyl)-4-phenyl-1H-1,2,3-triazole: an ambidentate ligand with switchable coordination modes
RSC Advances, 2018, 8, 25704
7231192 CIFC42 H29 N3 O4 P2 WP -112.615; 13.342; 14.0151
71.437; 69.756; 65.94		1977.1Radhakrishna, Latchupatula; Pandey, Madhusudan K.; Balakrishna, Maravanji S.
1,2,3-Triazole based bisphosphine, 5-(diphenylphosphanyl)-1-(2-(diphenylphosphanyl)-phenyl)-4-phenyl-1H-1,2,3-triazole: an ambidentate ligand with switchable coordination modes
RSC Advances, 2018, 8, 25704
7231193 CIFC39 H30 Cl5 N3 P2 PtP 21 21 2110.2544; 12.3816; 28.9853
90; 90; 90		3680.1Radhakrishna, Latchupatula; Pandey, Madhusudan K.; Balakrishna, Maravanji S.
1,2,3-Triazole based bisphosphine, 5-(diphenylphosphanyl)-1-(2-(diphenylphosphanyl)-phenyl)-4-phenyl-1H-1,2,3-triazole: an ambidentate ligand with switchable coordination modes
RSC Advances, 2018, 8, 25704
7231194 CIFC87 H69 Cl5 N6 P4 Ru2P -113.7636; 14.7629; 22.1839
76.1417; 85.9054; 85.3961		4355.89Radhakrishna, Latchupatula; Pandey, Madhusudan K.; Balakrishna, Maravanji S.
1,2,3-Triazole based bisphosphine, 5-(diphenylphosphanyl)-1-(2-(diphenylphosphanyl)-phenyl)-4-phenyl-1H-1,2,3-triazole: an ambidentate ligand with switchable coordination modes
RSC Advances, 2018, 8, 25704
7231195 CIFC48 H43 Cl2 N3 P2 RuP -112.7908; 15.2107; 15.2959
114.525; 103.851; 102.567		2453.7Radhakrishna, Latchupatula; Pandey, Madhusudan K.; Balakrishna, Maravanji S.
1,2,3-Triazole based bisphosphine, 5-(diphenylphosphanyl)-1-(2-(diphenylphosphanyl)-phenyl)-4-phenyl-1H-1,2,3-triazole: an ambidentate ligand with switchable coordination modes
RSC Advances, 2018, 8, 25704
7231196 CIFC39 H30 Au2 Cl5 N3 P2P 1 21/c 112.7791; 14.3916; 20.6657
90; 95.247; 90		3784.7Radhakrishna, Latchupatula; Pandey, Madhusudan K.; Balakrishna, Maravanji S.
1,2,3-Triazole based bisphosphine, 5-(diphenylphosphanyl)-1-(2-(diphenylphosphanyl)-phenyl)-4-phenyl-1H-1,2,3-triazole: an ambidentate ligand with switchable coordination modes
RSC Advances, 2018, 8, 25704
7231209 CIFC31 H35 N2 O2P 1 21/c 111.5429; 14.3317; 16.9947
90; 109.552; 90		2649.3Ten, Yury A.; Salnikov, Oleg G.; Amitina, Svetlana A.; Stass, Dmitri V.; Rybalova, Tatyana V.; Kazantsev, Maxim S.; Bogomyakov, Artem S.; Mostovich, Evgeny A.; Mazhukin, Dmitrii G.
The Suzuki‒Miyaura reaction as a tool for modification of phenoxyl-nitroxyl radicals of the 4H-imidazole N-oxide series
RSC Advances, 2018, 8, 26099
7231218 CIFC9 H14 Na O11.5 ZnP -17.098; 9.8; 11.2043
66.923; 73.598; 84.72		687.68Ye, Ranfeng; Ni, Min; Xu, Yuanyuan; Chen, Hao; Li, Shengqing
Synthesis of Zn-based metal‒organic frameworks in ionic liquid microemulsions at room temperature
RSC Advances, 2018, 8, 26237
7231219 CIFC38 H30 B F10 O PP -18.7905; 12.014; 16.205
84.36; 85.808; 88.853		1698.4Wang, Yiheng; Li, Zhen Hua; Wang, Huadong
Synthesis of an oxygen-linked germinal frustrated Lewis pair and its application in small molecule activation
RSC Advances, 2018, 8, 26271
7231220 CIFC35 H27 B F10 N O PP 1 21/c 118.51; 9.944; 17.597
90; 95.165; 90		3226Wang, Yiheng; Li, Zhen Hua; Wang, Huadong
Synthesis of an oxygen-linked germinal frustrated Lewis pair and its application in small molecule activation
RSC Advances, 2018, 8, 26271
7231221 CIFC35 H30 B F10 O PP 1 21/c 112.078; 8.875; 29.647
90; 90.449; 90		3178Wang, Yiheng; Li, Zhen Hua; Wang, Huadong
Synthesis of an oxygen-linked germinal frustrated Lewis pair and its application in small molecule activation
RSC Advances, 2018, 8, 26271
7231222 CIFC76 H56 B2 F20 O2 P2P -113.951; 15.282; 16.319
82.719; 79.714; 89.784		3395Wang, Yiheng; Li, Zhen Hua; Wang, Huadong
Synthesis of an oxygen-linked germinal frustrated Lewis pair and its application in small molecule activation
RSC Advances, 2018, 8, 26271
7231223 CIFC30 H24 B F10 O PP 1 21/n 19.7242; 22.4308; 13.8977
90; 108.5; 90		2874.74Wang, Yiheng; Li, Zhen Hua; Wang, Huadong
Synthesis of an oxygen-linked germinal frustrated Lewis pair and its application in small molecule activation
RSC Advances, 2018, 8, 26271
7231224 CIFC30 H22 B F10 O PP 1 21/c 110.5258; 20.8548; 13.077
90; 109.292; 90		2709.4Wang, Yiheng; Li, Zhen Hua; Wang, Huadong
Synthesis of an oxygen-linked germinal frustrated Lewis pair and its application in small molecule activation
RSC Advances, 2018, 8, 26271
7231225 CIFC41 H37 B F10 O3 PP -111.8184; 11.8406; 15.532
70.423; 79.484; 67.364		1886.5Wang, Yiheng; Li, Zhen Hua; Wang, Huadong
Synthesis of an oxygen-linked germinal frustrated Lewis pair and its application in small molecule activation
RSC Advances, 2018, 8, 26271
7231230 CIFC66 H64 Ag2 F12 N8 O4 P2P 1 21/c 117.7431; 15.6583; 26.3446
90; 95.567; 90		7284.7Chiu, Chien-Cheng; Chiu, Hui-Tzu; Lee, Dong-Sheng; Lu, Ta-Jung
An efficient class of bis-NHC salts: applications in Pd-catalyzed reactions under mild reaction conditions
RSC Advances, 2018, 8, 26407
7231231 CIFC68 H68 Cl7 F6 N8 O4 P Pd2P -112.6608; 17.192; 18.8963
87.943; 84.738; 76.841		3987.7Chiu, Chien-Cheng; Chiu, Hui-Tzu; Lee, Dong-Sheng; Lu, Ta-Jung
An efficient class of bis-NHC salts: applications in Pd-catalyzed reactions under mild reaction conditions
RSC Advances, 2018, 8, 26407

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