Crystallography Open Database

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7229763 CIFC19 H24 N2 O5P 21 21 215.0492; 10.1001; 35.494
90; 90; 90		1810.1Peters, Byron K.; Razuwika, Rufaro; Samipillai, Marivel; Arvidsson, Per I.; Kruger, Hendrik G.; Govender, Thavendran; Naicker, Tricia
An unexpected re-arrangement of the antibiotic carbapenem core to new 1,4-diazepin-5-one scaffolds
RSC Advances, 2018, 8, 190
7229764 CIFC22 H20 N2 O2 SP -19.7907; 10.0612; 10.7006
87.711; 85.038; 61.834		925.77Huang, Ying; Yi, Weiyin; Sun, Qihui; Zhang, Lirong; Yi, Fengping
A new and facile approach to 1,2-dihydroisoquinolin-3(4H)-imines by the Cu(i)-catalyzed reaction of 2-ethynylbenzyl methanesulfonates, sulfonyl azides and amines
RSC Advances, 2018, 8, 74
7229849 CIFC42 H34 Cd3 N9 O17P 1 21/c 110.188; 28.963; 16.627
90; 117.64; 90		4346Huang, Qi; Huang, Ji-Han; Gu, Lei; Ruan, Jia-xin; Yu, Ying-Hui; Gao, Jin-Sheng
Two new luminescence cadmium coordination polymers constructed by 4,4′-di(4H-1,2,4-triazol-4-yl)-1,1′-biphenyl and polycarboxylic acids: syntheses, structures, Fe3+ identifying and photo-degradable properties
RSC Advances, 2018, 8, 557
7229850 CIFC52 H36 Cd4 N12 O20P 1 21/c 19.7918; 20.1958; 13.9061
90; 112.116; 90		2547.64Huang, Qi; Huang, Ji-Han; Gu, Lei; Ruan, Jia-xin; Yu, Ying-Hui; Gao, Jin-Sheng
Two new luminescence cadmium coordination polymers constructed by 4,4′-di(4H-1,2,4-triazol-4-yl)-1,1′-biphenyl and polycarboxylic acids: syntheses, structures, Fe3+ identifying and photo-degradable properties
RSC Advances, 2018, 8, 557
7229851 CIFC28 H25 B O2P -18.0397; 9.627; 14.3024
81.219; 79.289; 86.038		1074Kaiser, R. P.; Ulč, J.; Císařová, I.; Nečas, D.
Direct regioselective C‒H borylation of [5]helicene
RSC Advances, 2018, 8, 580
7229858 CIFC86 H110 Cl2 Dy6 N10 O30P -112.4846; 14.5722; 15.5223
79.157; 67.587; 69.131		2434.88Liu, Zi-Yuan; Zou, Hua-Hong; Wang, Rong; Chen, Man-Sheng; Liang, Fu-Pei
Structure and magnetism of two chair-shaped hexanuclear dysprosium(iii) complexes exhibiting slow magnetic relaxation
RSC Advances, 2018, 8, 767
7229859 CIFC76 H124 Dy6 N2 O34P 1 21/c 113.4065; 21.701; 17.9936
90; 99.84; 90		5157.95Liu, Zi-Yuan; Zou, Hua-Hong; Wang, Rong; Chen, Man-Sheng; Liang, Fu-Pei
Structure and magnetism of two chair-shaped hexanuclear dysprosium(iii) complexes exhibiting slow magnetic relaxation
RSC Advances, 2018, 8, 767
7229860 CIFC26 H27 Cl8 Ir N4P 1 21/n 18.3668; 12.3575; 30.7228
90; 90.524; 90		3176.4Gunasekar, Gunniya Hariyanandam; Yoon, Yeahsel; Baek, Il-hyun; Yoon, Sungho
Catalytic reactivity of an iridium complex with a proton responsive N-donor ligand in CO2 hydrogenation to formate
RSC Advances, 2018, 8, 1346
7229876 CIFC14 H17 N3 O4 SP -18.3702; 8.8979; 12.4669
97.411; 106.008; 113.67		786.53Kalaiarasi, G.; Jeya Rajkumar, S. Rex; Dharani, S.; Małecki, J. G.; Prabhakaran, R.
An investigation on 3-acetyl-7-methoxy-coumarin Schiff bases and their Ru(ii) metallates with potent antiproliferative activity and enhanced LDH and NO release
RSC Advances, 2018, 8, 1539
7229877 CIFC15 H17 N3 O3 SP -17.526; 8.0281; 13.5383
89.67; 87.437; 67.782		756.43Kalaiarasi, G.; Jeya Rajkumar, S. Rex; Dharani, S.; Małecki, J. G.; Prabhakaran, R.
An investigation on 3-acetyl-7-methoxy-coumarin Schiff bases and their Ru(ii) metallates with potent antiproliferative activity and enhanced LDH and NO release
RSC Advances, 2018, 8, 1539
7229878 CIFC14 H15 N3 O3 SP -317.5595; 17.5595; 8.6657
90; 90; 120		2314Kalaiarasi, G.; Jeya Rajkumar, S. Rex; Dharani, S.; Małecki, J. G.; Prabhakaran, R.
An investigation on 3-acetyl-7-methoxy-coumarin Schiff bases and their Ru(ii) metallates with potent antiproliferative activity and enhanced LDH and NO release
RSC Advances, 2018, 8, 1539
7229879 CIFC56 H45 N3 O4 P2 Ru SP -113.3038; 13.487; 14.3074
85.881; 85.582; 69.949		2401.56Kalaiarasi, G.; Jeya Rajkumar, S. Rex; Dharani, S.; Małecki, J. G.; Prabhakaran, R.
An investigation on 3-acetyl-7-methoxy-coumarin Schiff bases and their Ru(ii) metallates with potent antiproliferative activity and enhanced LDH and NO release
RSC Advances, 2018, 8, 1539
7229880 CIFC51 H45 N3 O5 P2 Ru SP -113.0569; 13.7232; 13.8479
89.094; 75.301; 70.576		2257.08Kalaiarasi, G.; Jeya Rajkumar, S. Rex; Dharani, S.; Małecki, J. G.; Prabhakaran, R.
An investigation on 3-acetyl-7-methoxy-coumarin Schiff bases and their Ru(ii) metallates with potent antiproliferative activity and enhanced LDH and NO release
RSC Advances, 2018, 8, 1539
7229881 CIFC51 H43 N3 O4 P2 Ru SP -112.2016; 13.4519; 15.1541
82.857; 79.55; 65.934		2229.9Kalaiarasi, G.; Jeya Rajkumar, S. Rex; Dharani, S.; Małecki, J. G.; Prabhakaran, R.
An investigation on 3-acetyl-7-methoxy-coumarin Schiff bases and their Ru(ii) metallates with potent antiproliferative activity and enhanced LDH and NO release
RSC Advances, 2018, 8, 1539
7229882 CIFC34 H33 B N2 O8P 17.9518; 9.5337; 10.5702
89.02; 76.831; 65.86		709.41Wong, Lawrence W.-Y.; Au Yeung, Alex S.-F.; Tam, Gemma S.-S.; Kan, Jack W.-H.; Sung, Herman H.-Y.; Sheong, Fu Kit; Lin, Zhenyang; Williams, Ian D.
Isolation and enantiostability of the B-chiral bis(salicylato)borate anions [BR(Sal)2] and [BS(Sal)2]
RSC Advances, 2018, 8, 1451
7229883 CIFC30 H44 B N O6P 1 21 19.49961; 13.42524; 12.0837
90; 110.171; 90		1446.57Wong, Lawrence W.-Y.; Au Yeung, Alex S.-F.; Tam, Gemma S.-S.; Kan, Jack W.-H.; Sung, Herman H.-Y.; Sheong, Fu Kit; Lin, Zhenyang; Williams, Ian D.
Isolation and enantiostability of the B-chiral bis(salicylato)borate anions [BR(Sal)2] and [BS(Sal)2]
RSC Advances, 2018, 8, 1451
7229884 CIFC43 H42 B2 Cl4 N2 O13P 1 21 112.1841; 10.7394; 16.5166
90; 98.35; 90		2138.29Wong, Lawrence W.-Y.; Au Yeung, Alex S.-F.; Tam, Gemma S.-S.; Kan, Jack W.-H.; Sung, Herman H.-Y.; Sheong, Fu Kit; Lin, Zhenyang; Williams, Ian D.
Isolation and enantiostability of the B-chiral bis(salicylato)borate anions [BR(Sal)2] and [BS(Sal)2]
RSC Advances, 2018, 8, 1451
7229885 CIFC29 H35 B N2 O6P 1 21 111.5542; 18.7836; 11.981
90; 95.04; 90		2590.18Wong, Lawrence W.-Y.; Au Yeung, Alex S.-F.; Tam, Gemma S.-S.; Kan, Jack W.-H.; Sung, Herman H.-Y.; Sheong, Fu Kit; Lin, Zhenyang; Williams, Ian D.
Isolation and enantiostability of the B-chiral bis(salicylato)borate anions [BR(Sal)2] and [BS(Sal)2]
RSC Advances, 2018, 8, 1451
7229886 CIFC86 H88 B4 N4 O24P 1 21 112.2938; 19.4089; 16.2958
90; 90.477; 90		3888.19Wong, Lawrence W.-Y.; Au Yeung, Alex S.-F.; Tam, Gemma S.-S.; Kan, Jack W.-H.; Sung, Herman H.-Y.; Sheong, Fu Kit; Lin, Zhenyang; Williams, Ian D.
Isolation and enantiostability of the B-chiral bis(salicylato)borate anions [BR(Sal)2] and [BS(Sal)2]
RSC Advances, 2018, 8, 1451
7229887 CIFC29 H35 B N2 O6P 21 21 2111.70439; 11.9649; 18.9233
90; 90; 90		2650.05Wong, Lawrence W.-Y.; Au Yeung, Alex S.-F.; Tam, Gemma S.-S.; Kan, Jack W.-H.; Sung, Herman H.-Y.; Sheong, Fu Kit; Lin, Zhenyang; Williams, Ian D.
Isolation and enantiostability of the B-chiral bis(salicylato)borate anions [BR(Sal)2] and [BS(Sal)2]
RSC Advances, 2018, 8, 1451
7229923 CIFC16 H32 Br2 Cu6 I6 N4P -19.856; 9.951; 10.625
62.77; 64.9; 84.22		833.4Xin, Bingjing; Sang, Jianwei; Gao, Yi; Li, Guanghua; Shi, Zhan; Feng, Shouhua
A pillared-layered copper(i) halide-based metal‒organic framework exhibiting dual emission, and piezochromic and thermochromic properties with a large temperature-dependent emission red-shift
RSC Advances, 2018, 8, 1973
7229924 CIFC16 H32 Br2 Cu6 I6 N4P -19.715; 9.887; 10.541
62.33; 66.13; 84.03		815.6Xin, Bingjing; Sang, Jianwei; Gao, Yi; Li, Guanghua; Shi, Zhan; Feng, Shouhua
A pillared-layered copper(i) halide-based metal‒organic framework exhibiting dual emission, and piezochromic and thermochromic properties with a large temperature-dependent emission red-shift
RSC Advances, 2018, 8, 1973
7229925 CIFC4 H6 N12 O2P 1 21 17.891; 7.425; 8.722
90; 108.523; 90		484.6Tao, Jingjing; Jin, Bo; Chu, Shijin; Peng, Rufang; Shang, Yu; Tan, Bisheng
Novel insensitive energetic-cocrystal-based BTO with good comprehensive properties
RSC Advances, 2018, 8, 1784
7229926 CIFC9 H12 Cl N5 O3P 1 21/c 111.7756; 9.1501; 11.4455
90; 103.01; 90		1201.57Yang, Dongyan; Wan, Chuan; Xiao, Yumei; Che, Chuanliang; Rui, Changhui; Qin, Zhaohai
Design, synthesis, and insecticidal activity of novel 1-alkoxy-2-nitroguanidines
RSC Advances, 2018, 8, 1838
7229932 CIFC8 H2 Cl3 N5 O4P 1 21/n 18.8432; 17.4; 16.43
90; 91.832; 90		2526.8Yang, Wei; Lu, Huanchang; Liao, Longyu; Fan, Guijuan; Ma, Qing; Huang, Jinglun
Synthesis, and single crystal structure of fully-substituted polynitrobenzene derivatives for high-energy materials
RSC Advances, 2018, 8, 2203
7229933 CIFC10 H4 Cl2 N8 O4P 1 21/c 116.424; 10.27; 17.559
90; 92.886; 90		2958Yang, Wei; Lu, Huanchang; Liao, Longyu; Fan, Guijuan; Ma, Qing; Huang, Jinglun
Synthesis, and single crystal structure of fully-substituted polynitrobenzene derivatives for high-energy materials
RSC Advances, 2018, 8, 2203
7229934 CIFC8 H2 N14 O4P 1 21/c 111.5557; 11.6416; 11.1129
90; 116.222; 90		1341.1Yang, Wei; Lu, Huanchang; Liao, Longyu; Fan, Guijuan; Ma, Qing; Huang, Jinglun
Synthesis, and single crystal structure of fully-substituted polynitrobenzene derivatives for high-energy materials
RSC Advances, 2018, 8, 2203
7229935 CIFC10 H8 N10 O4P 1 21/c 18.941; 7.445; 20.759
90; 106.328; 90		1326.1Yang, Wei; Lu, Huanchang; Liao, Longyu; Fan, Guijuan; Ma, Qing; Huang, Jinglun
Synthesis, and single crystal structure of fully-substituted polynitrobenzene derivatives for high-energy materials
RSC Advances, 2018, 8, 2203
7229936 CIFC8 H8 N8 O4P -17.4815; 9.2466; 16.151
87.286; 87.725; 89.891		1115.2Yang, Wei; Lu, Huanchang; Liao, Longyu; Fan, Guijuan; Ma, Qing; Huang, Jinglun
Synthesis, and single crystal structure of fully-substituted polynitrobenzene derivatives for high-energy materials
RSC Advances, 2018, 8, 2203
7229937 CIFC21 H15 F3 N4 SP 1 21/c 115.0769; 8.801; 15.4166
90; 115.203; 90		1850.92Meti, Puttavva; Gong, Young-Dae
Unveiling the photophysical and morphological properties of an acidochromic thiophene flanked dipyrrolopyrazine-based chromophore for optoelectronic application
RSC Advances, 2018, 8, 2004
7229938 CIFC12 H20 Cu6 Mo5 N18 O23P b c a17.837; 17.886; 23.754
90; 90; 90		7578Xu, Li; Lu, Ying; Huang, Liping; Li, Xiaohui; Wang, Shuang; Zhang, Zhong; Liu, Shuxia
Synthesis and properties of a POM-based trinuclear copper(ii) triazole framework
RSC Advances, 2018, 8, 2034
7229988 CIFC32 H42 Cl2 Cu N6 O8P -18.5849; 10.5243; 12.043
111.668; 108.999; 96.088		923.9Li, Jie; Liu, Huiyu; Guo, Zhaoqi; Yang, Mingyan; Song, Jirong; Ma, Haixia
Two Cu(ii)-triadimenol complexes as potential fungicides: synergistic actions and DFT calculations
RSC Advances, 2018, 8, 2933
7229989 CIFC58 H84 Cl4 Cu N14 O18P -17.8341; 15.51; 16.076
68.996; 88.38; 88.253		1822.4Li, Jie; Liu, Huiyu; Guo, Zhaoqi; Yang, Mingyan; Song, Jirong; Ma, Haixia
Two Cu(ii)-triadimenol complexes as potential fungicides: synergistic actions and DFT calculations
RSC Advances, 2018, 8, 2933
7229990 CIFC22 H32 Cl2 N16 Ni O7P -112.261; 12.784; 13.598
74.133; 70.006; 64.47		1787.3Yepremyan, Akop; Mehmood, Arshad; Brewer, Samantha; Barnett, Madalyn M.; Janesko, Benjamin G.; Akkaraju, Giridhar; Simanek, Eric E.; Green, Kayla N.
A new triazine bearing a pyrazolone group capable of copper, nickel, and zinc chelation.
RSC advances, 2018, 8, 3024-3035
7229991 CIFC22 H39 Cl3 Cu2 N16 O9P -111.3979; 12.0551; 13.6836
97.586; 103.997; 106.156		1711.75Yepremyan, Akop; Mehmood, Arshad; Brewer, Samantha; Barnett, Madalyn M.; Janesko, Benjamin G.; Akkaraju, Giridhar; Simanek, Eric E.; Green, Kayla N.
A new triazine bearing a pyrazolone group capable of copper, nickel, and zinc chelation.
RSC advances, 2018, 8, 3024-3035
7229992 CIFC22 H33 Cl N16 O13 ZnP 1 21/c 112.4036; 19.8086; 14.3748
90; 91.559; 90		3530.6Yepremyan, Akop; Mehmood, Arshad; Brewer, Samantha; Barnett, Madalyn M.; Janesko, Benjamin G.; Akkaraju, Giridhar; Simanek, Eric E.; Green, Kayla N.
A new triazine bearing a pyrazolone group capable of copper, nickel, and zinc chelation.
RSC advances, 2018, 8, 3024-3035
7230000 CIFC10 H7 F3 N2 O3P 1 21/c 115.609; 5.0175; 14.758
90; 109.902; 90		1086.8Tang, Cheng-Ke; Feng, Kai-Xiang; Xia, Ai-Bao; Li, Chen; Zheng, Ya-Yun; Xu, Zhen-Yuan; Xu, Dan-Qian
Asymmetric synthesis of polysubstituted chiral chromans via an organocatalytic oxa-Michael-nitro-Michael domino reaction
RSC Advances, 2018, 8, 3095
7230004 CIFC25 H18 Fe N2C 2 2 219.746; 19.123; 19.154
90; 90; 90		3569.8Wu, Pei; Wang, Guo; Zhou, Lu; Lu, Jing; Wang, Jianchun
The first colorimetric receptor for the B4O72− anion based on nitro substituted phenanthroimidazole ferrocene derivatives
RSC Advances, 2018, 8, 3782
7230007 CIFC62 H47 Cd2 N9 O10C 1 2/c 122.015; 12.2707; 21.9979
90; 115.613; 90		5358.6Liu, Siyu; Guo, Mingming; Guo, Huadong; Sun, Yingying; Guo, Xianmin; Sun, Shaowen; Alexandrov, Eugeny V.
Structural diversity of six metal‒organic frameworks from a rigid bisimidazole ligand and their adsorption of organic dyes
RSC Advances, 2018, 8, 4039
7230008 CIFC74 H68 Cd2 N12 O14P 1 21/c 111.6567; 27.1818; 11.3231
90; 99.419; 90		3539.4Liu, Siyu; Guo, Mingming; Guo, Huadong; Sun, Yingying; Guo, Xianmin; Sun, Shaowen; Alexandrov, Eugeny V.
Structural diversity of six metal‒organic frameworks from a rigid bisimidazole ligand and their adsorption of organic dyes
RSC Advances, 2018, 8, 4039
7230009 CIFC94 H98 N12 O20 Zn3C 1 2/c 130.643; 10.5532; 31.782
90; 116.594; 90		9190.3Liu, Siyu; Guo, Mingming; Guo, Huadong; Sun, Yingying; Guo, Xianmin; Sun, Shaowen; Alexandrov, Eugeny V.
Structural diversity of six metal‒organic frameworks from a rigid bisimidazole ligand and their adsorption of organic dyes
RSC Advances, 2018, 8, 4039
7230010 CIFC66 H42 Cd2 F12 N8 O9P -19.9983; 10.228; 14.6829
92.254; 97.61; 92.017		1485.9Liu, Siyu; Guo, Mingming; Guo, Huadong; Sun, Yingying; Guo, Xianmin; Sun, Shaowen; Alexandrov, Eugeny V.
Structural diversity of six metal‒organic frameworks from a rigid bisimidazole ligand and their adsorption of organic dyes
RSC Advances, 2018, 8, 4039
7230011 CIFC96 H86 Cd3 N14 O22 P2P -110.6823; 15.8149; 15.9776
63.889; 79.164; 72.15		2302.6Liu, Siyu; Guo, Mingming; Guo, Huadong; Sun, Yingying; Guo, Xianmin; Sun, Shaowen; Alexandrov, Eugeny V.
Structural diversity of six metal‒organic frameworks from a rigid bisimidazole ligand and their adsorption of organic dyes
RSC Advances, 2018, 8, 4039
7230012 CIFC44 H32 Cd2 N8 O10 S2P 1 21/c 111.376; 17.593; 11.651
90; 114.192; 90		2127Liu, Siyu; Guo, Mingming; Guo, Huadong; Sun, Yingying; Guo, Xianmin; Sun, Shaowen; Alexandrov, Eugeny V.
Structural diversity of six metal‒organic frameworks from a rigid bisimidazole ligand and their adsorption of organic dyes
RSC Advances, 2018, 8, 4039
7230016 CIFC19 H27 Cl O6P 21 21 2112.446; 15.594; 25.49
90; 90; 90		4947.2Wang, Chao-Yi; Hao, Jun-Di; Ning, Xing-Yan; Wu, Jing-Shuai; Zhao, Dong-Lin; Kong, Chui-Jian; Shao, Chang-Lun; Wang, Chang-Yun
Penicilazaphilones D and E: two new azaphilones from a sponge-derived strain of the fungus Penicillium sclerotiorum
RSC Advances, 2018, 8, 4348
7230017 CIFC14 H16 Cl O5.5P 21 21 217.7241; 16.3543; 22.3393
90; 90; 90		2822Wang, Chao-Yi; Hao, Jun-Di; Ning, Xing-Yan; Wu, Jing-Shuai; Zhao, Dong-Lin; Kong, Chui-Jian; Shao, Chang-Lun; Wang, Chang-Yun
Penicilazaphilones D and E: two new azaphilones from a sponge-derived strain of the fungus Penicillium sclerotiorum
RSC Advances, 2018, 8, 4348
7230018 CIFC42 H32 N2 O12 Ru2P -19.0471; 12.5948; 18.3765
102.293; 90.06; 102.35		1996.2Xu, Lei; Li, Shasha; Jiang, Liping; Zhang, Guofang; Zhang, Weiqiang; Gao, Ziwei
Electronic and steric effects of substituents in 1,3-diphenylprop-2-yn-1-one during its reaction with Ru3(CO)12
RSC Advances, 2018, 8, 4354
7230019 CIFC45 H30 O3P -16.5834; 12.571; 20.2038
97.333; 94.773; 102.775		1606.57Xu, Lei; Li, Shasha; Jiang, Liping; Zhang, Guofang; Zhang, Weiqiang; Gao, Ziwei
Electronic and steric effects of substituents in 1,3-diphenylprop-2-yn-1-one during its reaction with Ru3(CO)12
RSC Advances, 2018, 8, 4354
7230020 CIFC25 H9 Cl O11 Ru3P 1 21/c 118.0137; 9.0328; 15.9733
90; 90.808; 90		2598.8Xu, Lei; Li, Shasha; Jiang, Liping; Zhang, Guofang; Zhang, Weiqiang; Gao, Ziwei
Electronic and steric effects of substituents in 1,3-diphenylprop-2-yn-1-one during its reaction with Ru3(CO)12
RSC Advances, 2018, 8, 4354
7230021 CIFC46 H32 Cl2 O3P -112.3207; 12.5368; 24.013
85.154; 84.179; 80.72		3632.9Xu, Lei; Li, Shasha; Jiang, Liping; Zhang, Guofang; Zhang, Weiqiang; Gao, Ziwei
Electronic and steric effects of substituents in 1,3-diphenylprop-2-yn-1-one during its reaction with Ru3(CO)12
RSC Advances, 2018, 8, 4354

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