Crystallography Open Database

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7235252 CIFC16 H20 F6 N4 O6 S2P 1 21/c 16.7528; 20.0716; 8.2927
90; 104.01; 90
1090.55Munir, Naima; Masood, Sara; Liaqat, Faroha; Tahir, Muhammad Nawaz; Yousuf, Sammer; Kalsoom, Saima; Mughal, Ehsan Ullah; Sumrra, Sajjad Hussain; Maalik, Aneela; Zafar, Muhammad Naveed
Synthesis of new Pro-PYE ligands as co-catalysts toward Pd-catalyzed Heck‒Mizoroki cross coupling reactions
RSC Advances, 2019, 9, 37986
7235253 CIFC7 H9 I2 NP n m a16.0537; 7.2941; 8.9376
90; 90; 90
1046.57Munir, Naima; Masood, Sara; Liaqat, Faroha; Tahir, Muhammad Nawaz; Yousuf, Sammer; Kalsoom, Saima; Mughal, Ehsan Ullah; Sumrra, Sajjad Hussain; Maalik, Aneela; Zafar, Muhammad Naveed
Synthesis of new Pro-PYE ligands as co-catalysts toward Pd-catalyzed Heck‒Mizoroki cross coupling reactions
RSC Advances, 2019, 9, 37986
7235254 CIFC7 H7 Cl F3 N O3 SP 1 21/n 16.6961; 9.9947; 16.1264
90; 99.272; 90
1065.17Munir, Naima; Masood, Sara; Liaqat, Faroha; Tahir, Muhammad Nawaz; Yousuf, Sammer; Kalsoom, Saima; Mughal, Ehsan Ullah; Sumrra, Sajjad Hussain; Maalik, Aneela; Zafar, Muhammad Naveed
Synthesis of new Pro-PYE ligands as co-catalysts toward Pd-catalyzed Heck‒Mizoroki cross coupling reactions
RSC Advances, 2019, 9, 37986
7235255 CIFC9 H7 N O2P 1 21/c 18.0481; 9.7876; 10.8529
90; 111.525; 90
795.28Sakharov, Pavel A.; Koronatov, Alexander N.; Khlebnikov, Alexander F.; Novikov, Mikhail S.; Glukharev, Artem G.; Rogacheva, Elizaveta V.; Kraeva, Liudmila A.; Sharoyko, Vladimir V.; Tennikova, Tatiana B.; Rostovskii, Nikolai V.
Non-natural 2H-azirine-2-carboxylic acids: an expedient synthesis and antimicrobial activity
RSC Advances, 2019, 9, 37901
7238051 CIFC31 H24 N7 O12 Zn2P 21 21 2112.717; 16.73; 27.427
90; 90; 90
5835Di, Ling; Xia, Zhengqiang; Li, Jian; Geng, Zhongxing; Li, Chun; Xing, Yang; Yang, Zhanxu
Selective sensing and visualization of pesticides by ABW-type metal‒organic framework based luminescent sensors
RSC Advances, 2019, 9, 38469
7238052 CIFC44 H34 N10 O4P n a 2120.554; 7.7056; 23.283
90; 90; 90
3687.6Yang, Ruchun; Deng, Si; Dong, Xiang-you; Song, Xianrong; Cai, Hu; Bai, Jiang; Xiao, Qiang
Metal-free synthesis of 1,N6-ethenoadenines from N6-propargyl-adenines via NIS mediated radical cascade reaction
RSC Advances, 2019, 9, 38897
7238053 CIFC38 H27 Co N7 O6P -19.0115; 10.9375; 17.301
94.82; 100.924; 92.663
1665Tang, Long; Wang, Huan-Huan; Fu, Yu-Hao; Wang, Yi-Tong; Wang, JiJiang; Hou, XiangYang
Three cobalt-based coordination polymers with tripodal carboxylate and imidazole-containing ligands: syntheses, structures, properties and DFT studies
RSC Advances, 2019, 9, 38902
7238054 CIFC38 H29 Co N7 O7P -18.571; 11.968; 16.874
91.273; 103.657; 95.169
1673.4Tang, Long; Wang, Huan-Huan; Fu, Yu-Hao; Wang, Yi-Tong; Wang, JiJiang; Hou, XiangYang
Three cobalt-based coordination polymers with tripodal carboxylate and imidazole-containing ligands: syntheses, structures, properties and DFT studies
RSC Advances, 2019, 9, 38902
7238055 CIFC45 H34 Co N8 O7P -110.004; 14.689; 15.139
71.253; 87.999; 89.725
2105.3Tang, Long; Wang, Huan-Huan; Fu, Yu-Hao; Wang, Yi-Tong; Wang, JiJiang; Hou, XiangYang
Three cobalt-based coordination polymers with tripodal carboxylate and imidazole-containing ligands: syntheses, structures, properties and DFT studies
RSC Advances, 2019, 9, 38902
7238056 CIFC40 H35 N3 O2P -110.9812; 11.0146; 13.6821
105.918; 94.241; 92.164
1584.17Muthukumar, Venkatesan; Munusamy, Sathishkumar; Thirumoorthy, Krishnan; Sawminathan, Sathish; KulathuIyer, Sathiyanarayanan
Fused pyrazole-phenanthridine based dyads: synthesis, photo-physical and theoretical studies, and live cell pH imaging
RSC Advances, 2019, 9, 38687
7238057 CIFC36 H28 N3P 1 21/n 114.0942; 11.0705; 17.449
90; 91.14; 90
2722Muthukumar, Venkatesan; Munusamy, Sathishkumar; Thirumoorthy, Krishnan; Sawminathan, Sathish; KulathuIyer, Sathiyanarayanan
Fused pyrazole-phenanthridine based dyads: synthesis, photo-physical and theoretical studies, and live cell pH imaging
RSC Advances, 2019, 9, 38687
7238058 CIFC34 H26 Cd I2 N2C 1 2/c 128.4498; 7.439; 17.7851
90; 125.191; 90
3076.1Dutta, Basudeb; Purkait, Rakesh; Bhunia, Suprava; Khan, Samim; Sinha, Chittaranjan; Mir, Mohammad Hedayetullah
Selective detection of trinitrophenol by a Cd(ii)-based coordination compound
RSC Advances, 2019, 9, 38718
7238060 CIFC17 H25 Cl4 N3 Ru SP b c a13.077; 14.235; 23.698
90; 90; 90
4411Namiecińska, Ewelina; Sadowska, Beata; Więckowska-Szakiel, Marzena; Dołęga, Anna; Pasternak, Beata; Grazul, Magdalena; Budzisz, Elzbieta
Anticancer and antimicrobial properties of novel η6-p-cymene ruthenium(ii) complexes containing a N,S-type ligand, their structural and theoretical characterization
RSC Advances, 2019, 9, 38629
7238061 CIFC18 H27 Cl2 N3 Ru SP b c a10.6918; 14.539; 26.597
90; 90; 90
4134.5Namiecińska, Ewelina; Sadowska, Beata; Więckowska-Szakiel, Marzena; Dołęga, Anna; Pasternak, Beata; Grazul, Magdalena; Budzisz, Elzbieta
Anticancer and antimicrobial properties of novel η6-p-cymene ruthenium(ii) complexes containing a N,S-type ligand, their structural and theoretical characterization
RSC Advances, 2019, 9, 38629
7238062 CIFC15 H22 Cl N3 O2 Ru SP 21 21 2110.398; 12.551; 13.766
90; 90; 90
1796.5Namiecińska, Ewelina; Sadowska, Beata; Więckowska-Szakiel, Marzena; Dołęga, Anna; Pasternak, Beata; Grazul, Magdalena; Budzisz, Elzbieta
Anticancer and antimicrobial properties of novel η6-p-cymene ruthenium(ii) complexes containing a N,S-type ligand, their structural and theoretical characterization
RSC Advances, 2019, 9, 38629
7238063 CIFC20 H22 Cl N3 O Ru SP 1 21/c 110.6196; 12.7321; 14.8584
90; 107.98; 90
1910.9Namiecińska, Ewelina; Sadowska, Beata; Więckowska-Szakiel, Marzena; Dołęga, Anna; Pasternak, Beata; Grazul, Magdalena; Budzisz, Elzbieta
Anticancer and antimicrobial properties of novel η6-p-cymene ruthenium(ii) complexes containing a N,S-type ligand, their structural and theoretical characterization
RSC Advances, 2019, 9, 38629
7239606 CIFC32 H36 N8 O8.5 ZnP 1 21/n 111.9804; 13.438; 21.0607
90; 97.313; 90
3363Huo, Jianqiang; Yu, Donghui; Li, Haiqiang; Luo, Bingcai; Arulsamy, Navamoney
Mechanistic investigation of photocatalytic degradation of organic dyes by a novel zinc coordination polymer
RSC Advances, 2019, 9, 39323
7239607 CIFC26 H24 O3 S Si2P -18.38; 11.88; 13.55
71.08; 78.98; 75.76
1228Xiao, Peng; Su, Shikuan; Wang, Wei; Cao, Weiguo; Chen, Jie; Li, Jian; Chen, Yali
Sequential cycloaddition and ring expansion reaction of arynes and methylenebenzothiopheneones: synthesis of a benzo-fused eight-membered ring via sulfonium ylides
RSC Advances, 2019, 9, 39119
7239608 CIFC27 H26 O4 S Si2P 1 21/n 110.329; 17.205; 15.111
90; 99.615; 90
2648Xiao, Peng; Su, Shikuan; Wang, Wei; Cao, Weiguo; Chen, Jie; Li, Jian; Chen, Yali
Sequential cycloaddition and ring expansion reaction of arynes and methylenebenzothiopheneones: synthesis of a benzo-fused eight-membered ring via sulfonium ylides
RSC Advances, 2019, 9, 39119
7239609 CIFC16 H10 I2 N2 O4P -18.4936; 9.6878; 11.232
102.855; 100.713; 107.846
824.9Horiuchi, Sachio; Ishibashi, Shoji; Kobayashi, Kensuke; Kumai, Reiji
Coexistence of normal and inverse deuterium isotope effects in a phase-transition sequence of organic ferroelectrics
RSC Advances, 2019, 9, 39662
7239610 CIFC18 H14 Br2 N2 O4P -18.824; 9.767; 12.01
97.017; 104.879; 115.3
872Horiuchi, Sachio; Ishibashi, Shoji; Kobayashi, Kensuke; Kumai, Reiji
Coexistence of normal and inverse deuterium isotope effects in a phase-transition sequence of organic ferroelectrics
RSC Advances, 2019, 9, 39662
7239611 CIFC16 H10 I2 N2 O4P 18.3748; 9.6561; 11.1482
102.586; 100.651; 107.601
807.64Horiuchi, Sachio; Ishibashi, Shoji; Kobayashi, Kensuke; Kumai, Reiji
Coexistence of normal and inverse deuterium isotope effects in a phase-transition sequence of organic ferroelectrics
RSC Advances, 2019, 9, 39662
7239612 CIFC16 H10 I2 N2 O4P -18.5223; 9.665; 11.255
102.807; 100.659; 107.876
827.8Horiuchi, Sachio; Ishibashi, Shoji; Kobayashi, Kensuke; Kumai, Reiji
Coexistence of normal and inverse deuterium isotope effects in a phase-transition sequence of organic ferroelectrics
RSC Advances, 2019, 9, 39662
7239613 CIFC18 H14 Br2 N2 O4P 18.8044; 9.7839; 11.882
97.226; 104.52; 115.868
858.5Horiuchi, Sachio; Ishibashi, Shoji; Kobayashi, Kensuke; Kumai, Reiji
Coexistence of normal and inverse deuterium isotope effects in a phase-transition sequence of organic ferroelectrics
RSC Advances, 2019, 9, 39662
7239614 CIFC16 H10 I2 N2 O4P -18.5359; 9.6656; 11.2585
102.844; 100.667; 107.825
829.48Horiuchi, Sachio; Ishibashi, Shoji; Kobayashi, Kensuke; Kumai, Reiji
Coexistence of normal and inverse deuterium isotope effects in a phase-transition sequence of organic ferroelectrics
RSC Advances, 2019, 9, 39662
7239615 CIFC16 H10 I2 N2 O4P -14.8002; 8.5129; 11.2407
102.13; 101.726; 104.523
418.54Horiuchi, Sachio; Ishibashi, Shoji; Kobayashi, Kensuke; Kumai, Reiji
Coexistence of normal and inverse deuterium isotope effects in a phase-transition sequence of organic ferroelectrics
RSC Advances, 2019, 9, 39662
7239616 CIFC18 H14 Br2 N2 O4P -18.812; 9.795; 11.993
97.0435; 105.051; 115.222
871.5Horiuchi, Sachio; Ishibashi, Shoji; Kobayashi, Kensuke; Kumai, Reiji
Coexistence of normal and inverse deuterium isotope effects in a phase-transition sequence of organic ferroelectrics
RSC Advances, 2019, 9, 39662
7239617 CIFC16 H10 I2 N2 O4P -18.4976; 9.6911; 11.242
102.877; 100.665; 107.889
826.2Horiuchi, Sachio; Ishibashi, Shoji; Kobayashi, Kensuke; Kumai, Reiji
Coexistence of normal and inverse deuterium isotope effects in a phase-transition sequence of organic ferroelectrics
RSC Advances, 2019, 9, 39662
7239618 CIFC18 H14 Br2 N2 O4P -14.8779; 8.1042; 11.8636
108.473; 91.2897; 98.2241
439.09Horiuchi, Sachio; Ishibashi, Shoji; Kobayashi, Kensuke; Kumai, Reiji
Coexistence of normal and inverse deuterium isotope effects in a phase-transition sequence of organic ferroelectrics
RSC Advances, 2019, 9, 39662
7239619 CIFC54 H54 Dy2 N8 O6P 1 21/n 111.211; 18.586; 11.571
90; 96.437; 90
2395.8Jiang, Zhijie; Sun, Lin; Li, Min; Wu, Haipeng; Xia, Zhengqiang; Ke, Hongshan; Zhang, Yiquan; Xie, Gang; Chen, Sanping
Solvent-tuned magnetic exchange interactions in Dy2 systems ligated by a μ-phenolato heptadentate Schiff base
RSC Advances, 2019, 9, 39640
7239620 CIFC56 H58 Cl4 Dy2 N8 O6P 1 21/n 112.399; 12.348; 18.779
90; 98.274; 90
2845.2Jiang, Zhijie; Sun, Lin; Li, Min; Wu, Haipeng; Xia, Zhengqiang; Ke, Hongshan; Zhang, Yiquan; Xie, Gang; Chen, Sanping
Solvent-tuned magnetic exchange interactions in Dy2 systems ligated by a μ-phenolato heptadentate Schiff base
RSC Advances, 2019, 9, 39640
7239621 CIFC60 H60 Cl6 Dy2 N8 O8P 1 21/n 112.54; 13.764; 18.544
90; 98.178; 90
3168.2Jiang, Zhijie; Sun, Lin; Li, Min; Wu, Haipeng; Xia, Zhengqiang; Ke, Hongshan; Zhang, Yiquan; Xie, Gang; Chen, Sanping
Solvent-tuned magnetic exchange interactions in Dy2 systems ligated by a μ-phenolato heptadentate Schiff base
RSC Advances, 2019, 9, 39640
7239622 CIFC62 H64 Cl6 Dy2 N8 O8P -111.675; 12.589; 13.298
64.222; 84.541; 65.307
1590.1Jiang, Zhijie; Sun, Lin; Li, Min; Wu, Haipeng; Xia, Zhengqiang; Ke, Hongshan; Zhang, Yiquan; Xie, Gang; Chen, Sanping
Solvent-tuned magnetic exchange interactions in Dy2 systems ligated by a μ-phenolato heptadentate Schiff base
RSC Advances, 2019, 9, 39640
7239623 CIFC19.5 H16.5 Br Cd N3.5 O5.5C 1 2/c 115.661; 13.297; 23.29
90; 108.66; 90
4595.1Jia, Lei; Xue, Zhe; Zhu, Rong-Rong; Yan, Tong; Wang, Yu-Na; Zhang, Suo-Shu; Geng, Xiao; Du, Lin; Zhao, Qi-Hua
A novel fluorescence phenomenon caused by amine induced ion-exchange between Cd2+ and Fe3+ ions
RSC Advances, 2019, 9, 39854
7239624 CIFC21 H19 Br Cd N2 O5C 1 2/c 114.34; 18.918; 16.582
90; 100.615; 90
4421.5Jia, Lei; Xue, Zhe; Zhu, Rong-Rong; Yan, Tong; Wang, Yu-Na; Zhang, Suo-Shu; Geng, Xiao; Du, Lin; Zhao, Qi-Hua
A novel fluorescence phenomenon caused by amine induced ion-exchange between Cd2+ and Fe3+ ions
RSC Advances, 2019, 9, 39854
7239631 CIFC32 H28 N2 O4P -18.9151; 9.6712; 15.8118
72.76; 83.325; 76.504
1264.5Velezheva, V. S.; Babii, O. L.; Khodak, A. A.; Alekseeva, E. A.; Nelyubina, Yu V.; Godovikov, I. A.; Peregudov, A. S.; Majorov, K. B.; Nikonenko, B. V.
Novel base-initiated cascade reactions of hemiindigos to produce dipolar γ-carbolines and indole-fused pentacycles
RSC Advances, 2019, 9, 41402
7239632 CIFC30 H22 N2 O3P 1 21 111.336; 6.3863; 15.8956
90; 95.678; 90
1145.12Velezheva, V. S.; Babii, O. L.; Khodak, A. A.; Alekseeva, E. A.; Nelyubina, Yu V.; Godovikov, I. A.; Peregudov, A. S.; Majorov, K. B.; Nikonenko, B. V.
Novel base-initiated cascade reactions of hemiindigos to produce dipolar γ-carbolines and indole-fused pentacycles
RSC Advances, 2019, 9, 41402
7239633 CIFC122 H150 N8 O15C 1 2/c 124.775; 25.959; 18.608
90; 114.51; 90
10889An, Lin; Liu, Jia-dong; Peng, Xian-na; Zheng, You-guang; Wang, Chan; Huang, Tong-hui
Preparation and in vitro bioactivity evaluation of N-heterocyclic-linked dihomooxacalix[4]arene derivatives
RSC Advances, 2019, 9, 41287
7239640 CIFC30 H24 Br2 Cl2 Cu N2 O2C 1 2/c 110.515; 18.508; 15.602
90; 106.547; 90
2910.6Guo, Yaning; Hu, Xiaobing; Zhang, Xinli; Pu, Xiaohua; Wang, Yue
The synthesis of a Cu(ii) Schiff base complex using a bidentate N2O2 donor ligand: crystal structure, photophysical properties, and antibacterial activities
RSC Advances, 2019, 9, 41737
7239641 CIFC15 H13 Br Cl N OP 1 21/c 112.621; 9.092; 13.389
90; 116.556; 90
1374.3Guo, Yaning; Hu, Xiaobing; Zhang, Xinli; Pu, Xiaohua; Wang, Yue
The synthesis of a Cu(ii) Schiff base complex using a bidentate N2O2 donor ligand: crystal structure, photophysical properties, and antibacterial activities
RSC Advances, 2019, 9, 41737
7239642 CIFC32 H42 Cl2 N2 O2 TiP 1 21/n 110.2955; 30.459; 10.5847
90; 111.381; 90
3090.82Li, Sihan; Zhu, Yuqiong; Liang, Huaqing; Xie, Xiuli; Zhan, Yipeng; Liang, Guodong; Zhu, Fangming
The influences of electronic effect and isomerization of salalen titanium(iv) complexes on ethylene polymerization in the presence of methylaluminoxane
RSC Advances, 2019, 9, 41824
7239643 CIFC25 H33 Cl2 F N2 O2 TiP 1 21/c 120.5893; 9.7299; 12.9904
90; 96.974; 90
2583.1Li, Sihan; Zhu, Yuqiong; Liang, Huaqing; Xie, Xiuli; Zhan, Yipeng; Liang, Guodong; Zhu, Fangming
The influences of electronic effect and isomerization of salalen titanium(iv) complexes on ethylene polymerization in the presence of methylaluminoxane
RSC Advances, 2019, 9, 41824
7239644 CIFC16 H15 N O6P 1 21 16.8717; 7.659; 14.4338
90; 101.854; 90
743.46Ghosh, Arun K.; Grillo, Alessandro; Kovela, Satish; Brindisi, Margherita
Asymmetric Diels‒Alder reaction of 3-(acyloxy)acryloyl oxazolidinones: optically active synthesis of a high-affinity ligand for potent HIV-1 protease inhibitors
RSC Advances, 2019, 9, 41755
7239645 CIFC21 H17 Br2 N3 O2 SP -19.1771; 10.3269; 11.308
81.303; 83.59; 74.781
1019.3Yi, Fengping; Fu, Chao; Sun, Qihui; Wei, Huazhen; Yu, Genfa; Yi, Weiyin
Direct intramolecular double cross-dehydrogentive-coupling (CDC) cyclization of N-(2-pyridyl)amidines under metal-free conditions
RSC Advances, 2019, 9, 42172
7239663 CIFC33 H20 N6 O8 ZnP -19.6385; 12.8687; 13.4092
71.818; 75.224; 74.543
1495.94Wang, Chang-Sheng; Huang, Qi; Wang, Xia; Zhang, Yu-Tong; Ma, Dong-Sheng; Yu, Ying-Hui; Gao, Jin-Sheng
Three new coordination polymers based on bis(4-(4H-1,2,4-triazol-4-yl)phenyl)methane: syntheses, structures, multiresponsive luminescent sensitive detection for antibiotics and pesticides, and antitumor activities
RSC Advances, 2019, 9, 42272
7239664 CIFC36 H31 Ag2 Mo4 N13 O13C 1 2/c 124.1943; 23.8328; 15.221
90; 102.567; 90
8566.4Wang, Chang-Sheng; Huang, Qi; Wang, Xia; Zhang, Yu-Tong; Ma, Dong-Sheng; Yu, Ying-Hui; Gao, Jin-Sheng
Three new coordination polymers based on bis(4-(4H-1,2,4-triazol-4-yl)phenyl)methane: syntheses, structures, multiresponsive luminescent sensitive detection for antibiotics and pesticides, and antitumor activities
RSC Advances, 2019, 9, 42272
7239665 CIFC21 H16 Cd N6 O2P 1 21/c 116.6171; 8.1566; 20.3047
90; 110.44; 90
2578.8Wang, Chang-Sheng; Huang, Qi; Wang, Xia; Zhang, Yu-Tong; Ma, Dong-Sheng; Yu, Ying-Hui; Gao, Jin-Sheng
Three new coordination polymers based on bis(4-(4H-1,2,4-triazol-4-yl)phenyl)methane: syntheses, structures, multiresponsive luminescent sensitive detection for antibiotics and pesticides, and antitumor activities
RSC Advances, 2019, 9, 42272
7247708 CIFC2 H12 N2 O6 P2P -113.21653; 7.88834; 4.65345
91.066; 87.8402; 106.538
464.74Mangstl, Martin; Wied, Jan Konrad; Weber, Johannes; Pritzel, Christian; Trettin, Reinhard; Schmedt auf der Günne, Jörn
Synthesis and characterization of methylammonium phosphates as crystalline approximants for anhydrous, low melting phosphate glasses
RSC Advances, 2019, 9, 1822-1830

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