Crystallography Open Database

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7217167 CIFC39 H33 Cu N3 O0.5 P2 S3P 1 21 112.864; 16.167; 17.506
90; 95.271; 90
3625.4Lobana, Tarlok S.; Sandhu, Amanpreet K.; Sultana, Razia; Castineiras, Alfonso; Butcher, Ray J.; Jasinski, Jerry P.
Coordination variability of CuIin multidonor heterocyclic thioamides: synthesis, crystal structures, luminescent properties and ESI-mass studies of complexes
RSC Advances, 2014, 4, 30511
7217168 CIFC111 H92 Br2 Cu3 N3 P6 S3P -112.8825; 13.2054; 33.4043
93.223; 96.511; 119.084
4893.4Lobana, Tarlok S.; Sandhu, Amanpreet K.; Sultana, Razia; Castineiras, Alfonso; Butcher, Ray J.; Jasinski, Jerry P.
Coordination variability of CuIin multidonor heterocyclic thioamides: synthesis, crystal structures, luminescent properties and ESI-mass studies of complexes
RSC Advances, 2014, 4, 30511
7217195 CIFC25 H37 Ge N3 O6 Ru2 Si2P -112.0005; 17.7747; 17.9712
112.81; 102.108; 94.844
3396.02Cabeza, Javier A.; Fernández-Colinas, José M.; García-Álvarez, Pablo; Polo, Diego
Steric effects in the reactions of amidinate germylenes with ruthenium carbonyl: isolation of a coordinatively unsaturated diruthenium(0) derivative
RSC Advances, 2014, 4, 31503
7217196 CIFC49 H61 Ge N3 O5 Ru2 Si2 SnP -113.0728; 13.3171; 17.1692
73.514; 72.315; 72.066
2649.05Cabeza, Javier A.; Fernández-Colinas, José M.; García-Álvarez, Pablo; Polo, Diego
Steric effects in the reactions of amidinate germylenes with ruthenium carbonyl: isolation of a coordinatively unsaturated diruthenium(0) derivative
RSC Advances, 2014, 4, 31503
7217318 CIFC26 H23 N OP 1 21/n 19.7889; 6.4372; 29.94
90; 96.75; 90
1873.5Sasaki, Shunsuke; Niko, Yosuke; Igawa, Kazunobu; Konishi, Gen-ichi
Aggregation-induced emission active D-π-A binaphthyl luminophore with dual-mode fluorescence
RSC Advances, 2014, 4, 33474
7217636 CIFC15 H14 N2 OP 1 21 19.415; 5.6395; 12.3566
90; 110.273; 90
615.44Vidyacharan, Shinde; Sagar, A.; Chaitra, N. C.; Sharada, Duddu S.
A facile synthesis of 2H-indazoles under neat conditions and further transformation into aza-γ-carboline alkaloid analogues in a tandem one-pot fashion
RSC Advances, 2014, 4, 34232
7217637 CIFC18 H16 B F2 N O3C 1 2/c 126.916; 8.0515; 17.954
90; 123.571; 90
3241.9Liu, Xu; Zhang, Qian; Xin, Xiaoqing; Zhang, Rui; Zhang, Ning; Liang, Yongjiu; Dong, Dewen
BF3•Et2O-Mediated Intramolecular Cyclization of Unsaturated Amides: Convenient Synthesis of Dihydroquinolin-2-one-BF2 Complexes
RSC Advances, 2014, 4, 36234-36240
7217638 CIFC45 H38 B2 Cl2 F4 N2 O6P -17.643; 12.269; 12.84
101.954; 104.028; 98.284
1118.6Liu, Xu; Zhang, Qian; Xin, Xiaoqing; Zhang, Rui; Zhang, Ning; Liang, Yongjiu; Dong, Dewen
BF3•Et2O-Mediated Intramolecular Cyclization of Unsaturated Amides: Convenient Synthesis of Dihydroquinolin-2-one-BF2 Complexes
RSC Advances, 2014, 4, 36234-36240
7217663 CIFB16 H14 Na6 O48 UP 1 21/n 114.736; 11.765; 23.928
90; 105.91; 90
3989.5Zhang, Yingjie; Bhadbhade, Mohan; Price, Jason R.; Karatchevtseva, Inna; Collison, David; Lumpkin, Gregory R.
Kinetics vs. thermodynamics: a unique crystal transformation from a uranyl peroxo-nanocluster to a nanoclustered uranyl polyborate
RSC Advances, 2014, 4, 34244
7217664 CIFO118 U28P 4/m n c20.234; 20.234; 26.874
90; 90; 90
11003Zhang, Yingjie; Bhadbhade, Mohan; Price, Jason R.; Karatchevtseva, Inna; Collison, David; Lumpkin, Gregory R.
Kinetics vs. thermodynamics: a unique crystal transformation from a uranyl peroxo-nanocluster to a nanoclustered uranyl polyborate
RSC Advances, 2014, 4, 34244
7217730 CIFC58 H58 N4 O4P -19.998; 11.2625; 11.6848
64.985; 80.227; 89.948
1171.31Brauchli, Sven Y.; Bozic-Weber, Biljana; Constable, Edwin C.; Hostettler, Nik; Housecroft, Catherine E.; Zampese, Jennifer A.
Factors controlling the photoresponse of copper(i) diimine dyes containing hole-transporting dendrons in dye-sensitized solar cells: substituent and solvent effects
RSC Advances, 2014, 4, 34801
7217734 CIFC16 H22 Cl2 N4 O4 PdC m c 2116.3889; 8.8163; 14.1318
90; 90; 90
2041.9Kumar, Alok; Purkait, Kallol; Dey, Suman Kr.; Sarkar, Amrita; Mukherjee, Arindam
A hydroquinone based palladium catalyst for room temperature nitro reduction in water
RSC Advances, 2014, 4, 35233
7217753 CIFC50 H52 Cl2 Cu2 F2 N12 O17P -110.401; 14.123; 19.125
90.608; 96.072; 99.224
2756.4Huang, Wan-Yun; Li, Ji; Kong, Shi-Lin; Wang, Zhong-Chang; Zhu, Hai-Liang
Cu(ii) and Co(ii) ternary complexes of quinolone antimicrobial drug enoxacin and levofloxacin: structure and biological evaluation
RSC Advances, 2014, 4, 35193
7217754 CIFC42 H49 Cl Co F2 N8 O14P -113.2744; 13.713; 14.1741
81.403; 64.381; 89.639
2295.4Huang, Wan-Yun; Li, Ji; Kong, Shi-Lin; Wang, Zhong-Chang; Zhu, Hai-Liang
Cu(ii) and Co(ii) ternary complexes of quinolone antimicrobial drug enoxacin and levofloxacin: structure and biological evaluation
RSC Advances, 2014, 4, 35193
7217755 CIFC28 H33 Cl Cu F N5 O11P -110.598; 10.71; 15.085
80.41; 86.353; 69.459
1580.9Huang, Wan-Yun; Li, Ji; Kong, Shi-Lin; Wang, Zhong-Chang; Zhu, Hai-Liang
Cu(ii) and Co(ii) ternary complexes of quinolone antimicrobial drug enoxacin and levofloxacin: structure and biological evaluation
RSC Advances, 2014, 4, 35193
7217756 CIFC48 H48 Cl2 Co F2 N8 O24C 1 2/c 120.36; 32.323; 10.184
90; 109.733; 90
6308Huang, Wan-Yun; Li, Ji; Kong, Shi-Lin; Wang, Zhong-Chang; Zhu, Hai-Liang
Cu(ii) and Co(ii) ternary complexes of quinolone antimicrobial drug enoxacin and levofloxacin: structure and biological evaluation
RSC Advances, 2014, 4, 35193
7217788 CIFC130 H138 Au8 N2 O12 P8C 1 2/c 131.2188; 17.1001; 23.3745
90; 90.371; 90
12478.1Zhang, Xiao-jing; Li, Jian-qiang; Liu, Shu-juan; Luo, Ming-biao; Feng, Xue-feng; Luo, Feng
An unprecedented (3, 6)-connected net featuring tcj-3,6-P21/c topology
RSC Advances, 2014, 4, 36282
7217796 CIFC27 H29 N3 O3P -16.6657; 8.9418; 19.201
87.395; 87.173; 88.605
1141.6Yu, Fang; Wang, Yan; Zhu, Wencheng; Huang, Yan; Yang, Minghui; Ai, Hua; Lu, Zhiyun
A novel fluorescent pH probe with valuable pKabased on a twisted intramolecular charge transfer mechanism, and its applications in cell imaging
RSC Advances, 2014, 4, 36849
7217880 CIFC26 H27 Br N O3 PP -19.4832; 11.2471; 12.8517
104.059; 109.087; 97.056
1225.6Li, Xi-An; Li, Jia-Yuan; Yang, Bin; Yang, Shang-Dong
Catalyst-free three-component reaction to synthesize chiral α-amino phosphine oxides
RSC Adv., 2014, 4, 39920
7217901 CIFC27 H23 F3 O4P -19.904; 10.633; 13.243
100.613; 103.125; 117.338
1137.4Minakawa, Maki; Ishikawa, Tomoki; Namioka, Junya; Hirooka, Souichirou; Zhou, Biao; Kawatsura, Motoi
Iron-catalyzed [2 + 2 + 2] cycloaddition of trifluoromethyl group substituted unsymmetrical internal alkynes
RSC Adv., 2014, 4, 41353
7217902 CIFC36 H35 N2 O4C 1 c 131.102; 6.1084; 21.032
90; 129.544; 90
3081.3Chinnaraja, Duraisamy; Rajalakshmi, Ramarajan
Atom and step economic multicomponent synthesis of highly functionalized novel N-alkyl piperidines: structural elucidation through spectral studies and single crystallographic analysis
RSC Adv., 2014, 4, 41314
7217903 CIFC34 H30 F4 N2 O2P -110.9418; 10.9774; 12.3371
96.606; 99.89; 103.363
1401.7Chinnaraja, Duraisamy; Rajalakshmi, Ramarajan
Atom and step economic multicomponent synthesis of highly functionalized novel N-alkyl piperidines: structural elucidation through spectral studies and single crystallographic analysis
RSC Adv., 2014, 4, 41314
7218076 CIFC28 H24 N2 OP 1 21/n 113.918; 11.138; 14.314
90; 110.04; 90
2085Yuan, Zeli; Yang, Xiaoqing; Wang, Lei; Huang, Jiandong; Wei, Gang
Efficient synthesis of new asymmetric tripodal ligands using microwave irradiation, and their crystal structures
RSC Adv., 2014, 4, 42211
7218077 CIFC24 H22 N2 OP 1 21/n 113.197; 11.102; 14.265
90; 111.786; 90
1941Yuan, Zeli; Yang, Xiaoqing; Wang, Lei; Huang, Jiandong; Wei, Gang
Efficient synthesis of new asymmetric tripodal ligands using microwave irradiation, and their crystal structures
RSC Adv., 2014, 4, 42211
7218078 CIFC23 H21 N3 OP 1 21/c 19.929; 12.099; 16.261
90; 96.512; 90
1941Yuan, Zeli; Yang, Xiaoqing; Wang, Lei; Huang, Jiandong; Wei, Gang
Efficient synthesis of new asymmetric tripodal ligands using microwave irradiation, and their crystal structures
RSC Adv., 2014, 4, 42211
7218150 CIFC20 H11 N O8.5 ZnC 1 2/c 125.951; 11.8662; 20.436
90; 125.847; 90
5101Jiang, Xiaoli; Liu, Yanhong; Wu, Pengyan; Wang, Lei; Wang, Qiyuan; Zhu, Guangzhou; Li, Xiu-Ling; Jian, Wang
Metal-organic Framework with 9-Phenylcarbazole Moiety as a Fluorescent Tag for Picric Acid Explosive Detection: Collaborating Electron Transfer, Hydrogen Bonding and Size Matching
RSC Advances, 2014, 4, 47357-47360
7218175 CIFC35 H30 Cl N2 O P SnC 1 2/n 157.264; 9.8858; 22.2965
90; 93.908; 90
12592.7Gholivand, K.; Gholami, A.; Tizhoush, S. K.; Schenk, K. J.; Fadaei, F.; Bahrami, A.
Steric and electronic control over the structural diversity of N-(n-pyridinyl) diphenylphosphinic amides (n = 2 and 4) as difunctional ligands in triphenyltin(iv) adducts
RSC Adv., 2014, 4, 44509
7218176 CIFC52 H45 Cl N4 O2 P2 SnP -19.9181; 14.7686; 16.9564
82.955; 81.181; 74.541
2356.8Gholivand, K.; Gholami, A.; Tizhoush, S. K.; Schenk, K. J.; Fadaei, F.; Bahrami, A.
Steric and electronic control over the structural diversity of N-(n-pyridinyl) diphenylphosphinic amides (n = 2 and 4) as difunctional ligands in triphenyltin(iv) adducts
RSC Adv., 2014, 4, 44509
7218242 CIFC18 H35 Cl N2P 1 21 116.137; 7.876; 16.214
90; 108.606; 90
1953Hiscock, Jennifer R.; Kirby, Isabelle L.; Herniman, Julie; John Langley, G.; Clark, Alistair J.; Gale, Philip A.
Supramolecular gels for the remediation of reactive organophosphorus compounds
RSC Adv., 2014, 4, 45517
7218243 CIFC18 H37 Cl N2 OP 1 21 110.722; 5.2236; 18.916
90; 103.548; 90
1030Hiscock, Jennifer R.; Kirby, Isabelle L.; Herniman, Julie; John Langley, G.; Clark, Alistair J.; Gale, Philip A.
Supramolecular gels for the remediation of reactive organophosphorus compounds
RSC Adv., 2014, 4, 45517
7218291 CIFC90 H62 Cd2 N2 O20P -18.0107; 14.519; 17.487
109.295; 97.629; 103.764
1814.3Liu, Lin; Zhang, Gong-Ming; Zhu, Ru-Gang; Liu, Yong-Hui; Yao, Hui-Meng; Han, Zheng-Bo
Dinuclear Cd(ii), Mn(ii) and Cu(ii) complexes derived from (anthraquinone-1-diyl) benzoate: DNA binding and cleavage studies
RSC Adv., 2014, 4, 46639
7218292 CIFC90 H62 Mn2 N2 O20P -18.012; 14.559; 17.184
108.545; 97.46; 103.804
1799Liu, Lin; Zhang, Gong-Ming; Zhu, Ru-Gang; Liu, Yong-Hui; Yao, Hui-Meng; Han, Zheng-Bo
Dinuclear Cd(ii), Mn(ii) and Cu(ii) complexes derived from (anthraquinone-1-diyl) benzoate: DNA binding and cleavage studies
RSC Adv., 2014, 4, 46639
7218293 CIFC94 H70 Cu2 N2 O20P -111.554; 12.053; 15.546
75.142; 71.824; 86.856
1987Liu, Lin; Zhang, Gong-Ming; Zhu, Ru-Gang; Liu, Yong-Hui; Yao, Hui-Meng; Han, Zheng-Bo
Dinuclear Cd(ii), Mn(ii) and Cu(ii) complexes derived from (anthraquinone-1-diyl) benzoate: DNA binding and cleavage studies
RSC Adv., 2014, 4, 46639
7218339 CIFC13 H18 N6 O2 SP -17.345; 8.053; 14.531
91.821; 100.056; 115.273
759.8Saha, Rajat; Sengupta, Suman; Dey, Sanjoy Kumar; Steele, Ian M.; Bhattacharyya, Arindam; Biswas, Susobhan; Kumar, Sanjay
A pharmaceutical cocrystal with potential anticancer activity
RSC Adv., 2014, 4, 49070
7218372 CIFC28 H24 Cu F6 I2 N4 PC 1 2/c 120.1617; 29.1275; 13.5247
90; 130.048; 90
6080Malzner, Frederik J.; Brauchli, Sven Y.; Constable, Edwin C.; Housecroft, Catherine E.; Neuburger, Markus
Halos show the path to perfection: peripheral iodo-substituents improve the efficiencies of bis(diimine)copper(i) dyes in DSCs
RSC Adv., 2014, 4, 48712
7218381 CIFC38 H47 Cu2 N5 O16R -3 m :H18.6843; 18.6843; 38.6052
90; 90; 120
11671.6Cai, Jianfeng; Lin, Yichao; Yu, Jiancan; Wu, Chuande; Chen, Liang; Cui, Yuanjing; Yang, Yu; Chen, Banglin; Qian, Guodong
A NbO type microporous metal‒organic framework constructed from a naphthalene derived ligand for CH4and C2H2storage at room temperature
RSC Adv., 2014, 4, 49457
7218383 CIFC64 H60 Cu4 N8 O22 S4P -18.6702; 14.5121; 15.1558
113.704; 95.764; 95.945
1715.4Hazra, Susanta; Mukherjee, Sanghamitra; Guedes da Silva, M. Fátima C.; Pombeiro, Armando J. L.
A cyclic tetranuclear cuboid type copper(ii) complex doubly supported by cyclohexane-1,4-dicarboxylate: molecular and supramolecular structure and cyclohexane oxidation activity
RSC Adv., 2014, 4, 48449
7218413 CIFC17 H13 NP -16.5135; 7.3675; 13.814
78.153; 76.412; 90.06
629.78Yan, Rulong; Zhou, Xiaoqiang; Li, Ming; Li, Xiaoni; Kang, Xing; Liu, Xingxing; Huo, Xing; Huang, Guosheng
Metal-free synthesis of substituted pyridines from aldehydes and NH4OAc under air
RSC Adv., 2014, 4, 50369
7218506 CIFC15 H16 N3 O4 SP -18.085; 9.738; 10.671
78.516; 83.189; 68.866
766.9Dey, Swapan; Sain, Dibyendu; Kumar, Ashish; Kumari, Chanda
A series of ditopic receptors for succinic acid binding
RSC Adv., 2014, 4, 51486
7218532 CIFC20 H20 N4 O5 SP 1 21/c 110.7923; 7.50518; 24.2322
90; 92.1594; 90
1961.37Pankova, Alena S.; Samartsev, Mikhail A.; Shulgin, Igor A.; Golubev, Pavel R.; Avdontceva, Margarita S.; Kuznetsov, Mikhail A.
Synthesis of thiazolidines via regioselective addition of unsymmetric thioureas to maleic acid derivatives
RSC Adv., 2014, 4, 51780
7218533 CIFC20 H21 N3 O2 SP -15.30469; 12.5053; 14.6627
71.1056; 83.182; 86.6139
913.54Pankova, Alena S.; Samartsev, Mikhail A.; Shulgin, Igor A.; Golubev, Pavel R.; Avdontceva, Margarita S.; Kuznetsov, Mikhail A.
Synthesis of thiazolidines via regioselective addition of unsymmetric thioureas to maleic acid derivatives
RSC Adv., 2014, 4, 51780
7218534 CIFC20 H21 N3 O2 SP b c a18.7677; 11.1216; 35.516
90; 90; 90
7413.1Pankova, Alena S.; Samartsev, Mikhail A.; Shulgin, Igor A.; Golubev, Pavel R.; Avdontceva, Margarita S.; Kuznetsov, Mikhail A.
Synthesis of thiazolidines via regioselective addition of unsymmetric thioureas to maleic acid derivatives
RSC Adv., 2014, 4, 51780
7218585 CIFC52 H47 Cl N4 O3 P2 Ru SP 1 21/n 114.3378; 16.5494; 19.591
90; 95.898; 90
4623.98Kalaivani, P.; Prabhakaran, R.; Dallemer, F.; Natarajan, K.
Photophysical properties and in vitro cytotoxicity studies of new Ru(ii) carbonyl complexes and mixed geometrical Ru(ii)‒Ni(ii) complex in HS-DNA/BSA protein and human lung (A549) and liver (HepG2) cells
RSC Adv., 2014, 4, 51850
7218586 CIFC67 H55 Cl N3 Ni O3 P3 Ru SI b a 222.4615; 22.8701; 24.3408
90; 90; 90
12503.8Kalaivani, P.; Prabhakaran, R.; Dallemer, F.; Natarajan, K.
Photophysical properties and in vitro cytotoxicity studies of new Ru(ii) carbonyl complexes and mixed geometrical Ru(ii)‒Ni(ii) complex in HS-DNA/BSA protein and human lung (A549) and liver (HepG2) cells
RSC Adv., 2014, 4, 51850
7218587 CIFC50 H42 Cl3 N3 O2 P2 Ru SP 1 21/n 114.3713; 16.5083; 19.6494
90; 96.112; 90
4635.24Kalaivani, P.; Prabhakaran, R.; Dallemer, F.; Natarajan, K.
Photophysical properties and in vitro cytotoxicity studies of new Ru(ii) carbonyl complexes and mixed geometrical Ru(ii)‒Ni(ii) complex in HS-DNA/BSA protein and human lung (A549) and liver (HepG2) cells
RSC Adv., 2014, 4, 51850
7218589 CIFC21 H25 N5 O SP -18.5845; 10.8223; 12.5073
84.207; 72.287; 75.18
1069.73Sarkar, Satavisha; Das, Deb K.; Khan, Abu T.
Synthesis of fully-substituted pyridines and dihydropyridines in a highly chemoselective manner utilizing a multicomponent reaction (MCR) strategy
RSC Adv., 2014, 4, 53752
7218590 CIFC20 H16 Cl N5P 1 21/n 112.968; 10.2902; 13.385
90; 98.889; 90
1764.7Sarkar, Satavisha; Das, Deb K.; Khan, Abu T.
Synthesis of fully-substituted pyridines and dihydropyridines in a highly chemoselective manner utilizing a multicomponent reaction (MCR) strategy
RSC Adv., 2014, 4, 53752
7218594 CIFDy4 H10 O23 S4P 21 21 2110.2877; 10.7888; 16.6377
90; 90; 90
1846.65Yao, Ru-Xin; Xu, Xia; Zhang, Xian-Ming
Ferromagnetically coupled chiral dysprosium hydroxysulfate and centrosymmetric dysprosium hydroxysulfate-oxalate: Dy4(OH)4cubane based high-connected networks via in situ conversion of organosulfur to sulfate
RSC Adv., 2014, 4, 53954
7218595 CIFC2 H16 Dy4 O26 S3P b c m9.4145; 14.6978; 15.2089
90; 90; 90
2104.5Yao, Ru-Xin; Xu, Xia; Zhang, Xian-Ming
Ferromagnetically coupled chiral dysprosium hydroxysulfate and centrosymmetric dysprosium hydroxysulfate-oxalate: Dy4(OH)4cubane based high-connected networks via in situ conversion of organosulfur to sulfate
RSC Adv., 2014, 4, 53954
7218618 CIFC19 H19 N O2P 1 21/n 115.852; 6.0728; 17.75
90; 114.655; 90
1552.9Thottiparambil, Abhineeshbabu; Anil Kumar, P. R.; Chakkumkumarath, Lakshmi
Styrylcyanine-based ratiometric and tunable fluorescent pH sensors
RSC Adv., 2014, 4, 56063

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