Crystallography Open Database

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2232831 CIF
HKL
Paper
C12 H26 N3 O PP c a 2110.962; 16.663; 8.079
90; 90; 90
1475.7Raissi Shabari, Akbar; Pourayoubi, Mehrdad; Ghoreishi, Farnaz; Vahdani, Banafsheh
<i>N</i>,<i>N</i>'-Dicyclopentyl-<i>N</i>'',<i>N</i>''-dimethylphosphoric triamide
Acta Crystallographica Section E, 2011, 67, o3401
2232924 CIF
HKL
Paper
C15 H21 N2 O4P c a 2114.458; 10.187; 10.67
90; 90; 90
1571.5Jing, Lin-Lin; Ma, Hui-Ping; He, Lei; Fan, Peng-Cheng; Jia, Zheng-Ping
2-[2-(2-Hydroxyethoxy)phenyl]-4,4,5,5-tetramethyl-2-imidazoline-1-oxyl 3-oxide
Acta Crystallographica Section E, 2011, 67, o3503
2233106 CIF
HKL
Paper
C13 H18 Br2 O3P c a 2114.0658; 9.599; 11.2657
90; 90; 90
1521.07Blanco, Magda; Garrido, Narciso M.; Sanz, Francisca; Diez, David
(3<i>S</i>*,4<i>S</i>*,<i>E</i>)-<i>tert</i>-Butyl 3,4-dibromo-5-oxocyclooct-1-enecarboxylate
Acta Crystallographica Section E, 2012, 68, o232
2233176 CIF
HKL
Paper
C10 H7 Cl N2P c a 217.5091; 11.041; 21.38
90; 90; 90
1772.6Pan, Mei-Ling; Li, Xiang; Luo, Yang-Hui
2-(4-Chloro-1<i>H</i>-indol-3-yl)acetonitrile
Acta Crystallographica Section E, 2012, 68, o203
2233387 CIF
HKL
Paper
C14 H13 N O4 SP c a 2111.9274; 15.6064; 7.2949
90; 90; 90
1357.9Vijayakumar, S.; Murugavel, S.; Kannan, D.; Bakthadoss, M.
Methyl (2<i>E</i>)-2-[(2,4-dioxo-1,3-thiazolidin-3-yl)methyl]-3-phenylprop-2-enoate
Acta Crystallographica Section E, 2012, 68, o328-o329
2233477 CIF
HKL
Paper
C13 H18 N2 O3 SP c a 2116.1869; 10.8467; 15.9353
90; 90; 90
2797.83Siddiqui, Waseeq Ahmad; Ashraf, Adnan; Siddiqui, Hamid Latif; Akram, Muhammad; Parvez, Masood
2-(<i>N</i>-Cyclohexylcarbamoyl)benzenesulfonamide
Acta Crystallographica Section E, 2012, 68, o370
2233479 CIF
HKL
Paper
C12 H12 F2 N2 O3P c a 2121.814; 9.0079; 13.188
90; 90; 90
2591.4Fun, Hoong-Kun; Quah, Ching Kheng; Shetty, Shobhitha; Kalluraya, Balakrishna
Ethyl 2-[(2,4-difluorophenyl)hydrazinylidene]-3-oxobutanoate
Acta Crystallographica Section E, 2012, 68, o422
2233723 CIF
HKL
Paper
C14 H10 F3 N OP c a 2117.9907; 5.0898; 13.2564
90; 90; 90
1213.88Odabaşoğlu, Hakkı Yasin; Büyükgüngör, Orhan; Avinç, Osman Ozan; Odabaşoğlu, Mustafa
(<i>E</i>)-2-{[(2-(Trifluoromethyl)phenyl]iminomethyl}phenol
Acta Crystallographica Section E, 2012, 68, o578
2233777 CIF
HKL
Paper
C32 H26 N10 Ni O4 S2P c a 2111.015; 17.995; 16.128
90; 90; 90
3196.8Hu, Xiu-Feng; Bing, Yue; Li, Xing; Kong, Zu-Ping
Bis[4-amino-<i>N</i>-(pyrimidin-2-yl)benzenesulfonamidato](1,10-phenanthroline)nickel(II)
Acta Crystallographica Section E, 2012, 68, m348-m349
2233788 CIF
HKL
Paper
C25 H27 N O4P c a 2136.1068; 6.8748; 8.4813
90; 90; 90
2105.29Madadi, Nikhil Reddy; Parkin, Sean; Crooks, Peter A.
(<i>Z</i>)-2-{2,4-Dimethoxy-6-[(<i>E</i>)-4-methoxystyryl]benzylidene}quinuclidin-3-one
Acta Crystallographica Section E, 2012, 68, o730
2233815 CIF
HKL
Paper
C3 H9 La N O9 P3P c a 219.144; 11.727; 9.823
90; 90; 90
1053.3Silva, Patrícia; Fernandes, José A.; Almeida Paz, Filipe A.
Redetermination at 180K of a layered lanthanide‒organic framework
Acta Crystallographica Section E, 2012, 68, m294-m295
2233930 CIF
HKL
Paper
C7 H6 Cl N3 SP c a 2113.0225; 5.7767; 21.708
90; 90; 90
1633Fun, Hoong-Kun; Ooi, Chin Wei; Sarojini, B. K.; Mohan, B. J.; Narayana, B.
1-(6-Chloro-1,3-benzothiazol-2-yl)hydrazine
Acta Crystallographica Section E, 2012, 68, o691-o692
2233963 CIF
HKL
Paper
C18 H14 OP c a 2129.192; 3.911; 11.2025
90; 90; 90
1279Asiri, Abdullah M.; Faidallah, Hassan M.; Al-Nemari, Khulud F.; Ng, Seik Weng; Tiekink, Edward R. T.
(2<i>E</i>)-2-[(2<i>E</i>)-3-Phenylprop-2-en-1-ylidene]-2,3-dihydro-1<i>H</i>-inden-1-one
Acta Crystallographica Section E, 2012, 68, o814
2234111 CIF
Paper
C24 H36 Cl2 F3 N3 O3 SP c a 2139.76; 9.952; 7.127
90; 90; 90
2820Petrus, Joanna; Petrus, Rafał; Czarnik-Matusewicz, Bogusława
Fluphenazine dihydrochloride dimethanol solvate
Acta Crystallographica Section E, 2012, 68, o1004-o1005
2234247 CIF
HKL
Paper
C11 H11 N3 O2P c a 2121.3909; 3.8653; 12.4514
90; 90; 90
1029.51Tiekink, Edward R. T.; Wardell, Solange M. S. V.; Wardell, James L.
3,5-Dimethyl-1-(4-nitrophenyl)-1<i>H</i>-pyrazole
Acta Crystallographica Section E, 2012, 68, o1018
2234268 CIF
HKL
Paper
C21 H14 F N5P c a 2110.5189; 8.1339; 20.0009
90; 90; 90
1711.27Abu Thaher, Bassam; Koch, Pierre; Schollmeyer, Dieter; Laufer, Stefan
4-[5-Amino-4-(4-fluorophenyl)-3-(pyridin-4-yl)-1<i>H</i>-pyrazol-1-yl]benzonitrile
Acta Crystallographica Section E, 2012, 68, o935
2234562 CIF
HKL
Paper
C12 H11 N O2P c a 2123.398; 5.8343; 7.3934
90; 90; 90
1009.3Wang, Guang-Tu; Zhang, Yong; Yang, Jin-Xin; Zou, Ping; Hou, Guang-Feng
A second orthorhombic polymorph of 2-(pyridin-4-ylmethoxy)phenol
Acta Crystallographica Section E, 2012, 68, o1366
2234601 CIF
HKL
Paper
C64 H76 B2 N4 O2P c a 2130.0601; 9.9321; 18.2054
90; 90; 90
5435.4Tiritiris, Ioannis; Kantlehner, Willi
1,1,2,2-Tetrakis(dimethylamino)ethane-1,2-diium bis(tetraphenylborate) acetone disolvate
Acta Crystallographica Section E, 2012, 68, o1371
2234692 CIF
HKL
Paper
C17 H23 N3 O6P c a 2110.2307; 9.3038; 20.652
90; 90; 90
1965.7Al-Omar, Mohamed A.; Amr, Abdel-Galil E.; Ghabbour, Hazem A.; Quah, Ching Kheng; Fun, Hoong-Kun
Methyl 2-({6-[(1-methoxy-2-methyl-1-oxopropan-2-yl)carbamoyl]pyridin-2-yl}formamido)-2-methylpropanoate
Acta Crystallographica Section E, 2012, 68, o1377-o1378
2234708 CIF
HKL
Paper
C9 H11 N3P c a 2118.3004; 8.3399; 5.6563
90; 90; 90
863.28Zhang, Xiao-Kai; Liu, Bing-Ni; Liu, Mo; Liu, Deng-Ke; Wang, Ping-Bao
1,3-Dimethyl-1<i>H</i>-indazol-6-amine
Acta Crystallographica Section E, 2012, 68, o1291
2234741 CIF
HKL
Paper
C20 H20 Br N3 O4P c a 2133.688; 4.7962; 12.3337
90; 90; 90
1992.81Guo, Wen-Jiao; Huang, Hua-Rong; Du, Zhi-Yun; Fang, Yan-Xiong; Zhang, Kun
1,4-Bis[4-(methoxycarbonyl)benzyl]-1<i>H</i>-1,2,4-triazol-4-ium bromide
Acta Crystallographica Section E, 2012, 68, o1553
2234915 CIF
HKL
Paper
C13 H11 N O3 SP c a 2119.2845; 3.86753; 15.643
90; 90; 90
1166.71Singh, Durga Prasad; Pratap, Seema; Butcher, Ray J.; Gupta, Sushil K.
Methyl 2-(thiophene-2-carboxamido)benzoate
Acta Crystallographica Section E, 2012, 68, o1765
2235026 CIF
HKL
Paper
C15 H13 N3 O3P c a 2132.657; 4.7861; 8.7596
90; 90; 90
1369.1Hu, Hua-Nan; Liu, Shi-Yong
(<i>E</i>)-4-Methyl-<i>N</i>'-(3-nitrobenzylidene)benzohydrazide
Acta Crystallographica Section E, 2012, 68, o1613
2235228 CIF
HKL
Paper
C8 H6 N4 O3P c a 217.6307; 9.5168; 12.4097
90; 90; 90
901.19Yousuf, Sammer; Arshad, Muhammad; Butt, Hafiza Madiha; Saeed, Sumayya; Basha, Fatima Z.
2-Azido-1-(4-nitrophenyl)ethanone
Acta Crystallographica Section E, 2012, 68, o1952
2235358 CIF
HKL
Paper
C9 H11 N3 O3P c a 2113.9945; 5.044; 27.286
90; 90; 90
1926.1Tahir, M. Nawaz; Ali, Akbar; Umar, M. Naveed; Hussain, Ishtiaq; Shad, Hazoor Ahmad
(2<i>E</i>)-2-(4-Hydroxy-3-methoxybenzylidene)hydrazinecarboxamide
Acta Crystallographica Section E, 2012, 68, o2071
2235359 CIF
HKL
Paper
C11 H7 Cl F NP c a 2121.1252; 3.8763; 11.7009
90; 90; 90
958.16Adeel, Muhammad; Elahi, Fazal; Tahir, M. Nawaz; Khan, Azim; Langer, Peter
5-(4-Chlorophenyl)-2-fluoropyridine
Acta Crystallographica Section E, 2012, 68, o2043
2235463 CIF
HKL
Paper
C11 H7 F2 NP c a 2120.365; 3.8303; 11.4835
90; 90; 90
895.76Elahi, Fazal; Adeel, Muhammad; Tahir, M. Nawaz; Langer, Peter; Ahmad, Saeed
2-Fluoro-5-(4-fluorophenyl)pyridine
Acta Crystallographica Section E, 2012, 68, o2070
2235531 CIF
HKL
Paper
C5 H5 Li N2 O3P c a 2124.433; 4.7861; 5.6385
90; 90; 90
659.4Starosta, Wojciech; Leciejewicz, Janusz
Poly[μ~2~-aqua-μ~2~-(pyrazine-2-carboxylato)-lithium]
Acta Crystallographica Section E, 2012, 68, m933-m934
2235551 CIF
HKL
Paper
C36 H27 Cl8 Cu2 N4 O4P c a 2126.6927; 7.7775; 18.6689
90; 90; 90
3875.7Kia, Reza; Kargar, Hadi; Adabi Ardakani, Amir; Tahir, Muhammad Nawaz
<i>catena</i>-Poly[{μ~3~-4,4',6,6'-tetrachloro-2,2'-[butane-1,4-diylbis(nitrilomethanylylidene)]diphenolato}{μ~2~-4,4',6,6'-tetrachloro-2,2'-[butane-1,4-diylbis(nitrilomethanylylidene)]diphenolato}dicopper(II)]
Acta Crystallographica Section E, 2012, 68, m999-m1000
2235610 CIF
HKL
Paper
C36 H27 Br8 Cu2 N4 O4P c a 2127.41; 7.9055; 18.8291
90; 90; 90
4080.1Kargar, Hadi; Kia, Reza; Adabi Ardakani, Amir; Tahir, Muhammad Nawaz
<i>catena</i>-Poly[{μ~3~-4,4',6,6'-tetrabromo-2,2'-[butane-1,4-diylbis(nitrilomethanylylidene)]diphenolato}{μ~2~-4,4',6,6'-tetrabromo-2,2'-[butane-1,4-diylbis(nitrilomethanylylidene)]diphenolato}dicopper(II)]
Acta Crystallographica Section E, 2012, 68, m1018-m1019
2235783 CIF
HKL
Paper
C18 H44 N2 O6P c a 2119.9302; 7.6627; 14.3253
90; 90; 90
2187.75McNeese, Timothy J.; Pike, Robert D.
Bis(tetraethylammonium) oxalate dihydrate
Acta Crystallographica Section E, 2012, 68, o2382-o2383
2235998 CIF
HKL
Paper
C14 H9 Cl3 I2P c a 219.8117; 20.3445; 8.0486
90; 90; 90
1606.61Smith, Graham
1,1,1-Trichloro-2,2-bis(4-iodophenyl)ethane
Acta Crystallographica Section E, 2012, 68, o2504
2236071 CIF
HKL
Paper
C14 H9 N O2P c a 2117.4505; 3.7875; 15.1669
90; 90; 90
1002.44Patel, Dinesh G.; Benedict, Jason B.
Tautomerism in 10-(hydroxyimino)phenanthren-9-one
Acta Crystallographica Section E, 2012, 68, o2871
2236186 CIF
HKL
Paper
C14 H13 Cl N2 OP c a 218.8746; 13.3273; 9.8331
90; 90; 90
1163Okuda, Kensuke; Hirota, Takashi; Nishina, Yuta; Ishida, Hiroyuki
10'-Chloro-3',4'-dihydro-2'<i>H</i>-spiro[cyclopropane-1,7'(6'<i>H</i>)-pyrimido[2,1-<i>a</i>]isoquinolin]-6'-one
Acta Crystallographica Section E, 2012, 68, o3252
2236237 CIF
HKL
Paper
C9 H7 N OP c a 2114.0758; 5.8059; 8.6909
90; 90; 90
710.24Dileep, C. S.; Abdoh, M. M. M.; Chakravarthy, M. P.; Mohana, K. N.; Sridhar, M. A.
1<i>H</i>-Indole-3-carbaldehyde
Acta Crystallographica Section E, 2012, 68, o3135
2236379 CIF
HKL
Paper
C12 H12 Cl2 F2 N2 ZnP c a 2111.6817; 4.708; 25.2056
90; 90; 90
1386.24Subashini, Ashokkumar; Ramamurthi, Kandasamy; Stoeckli-Evans, Helen
Dichloridobis(4-fluoroaniline-κ<i>N</i>)zinc
Acta Crystallographica Section E, 2012, 68, m1152
2236452 CIF
HKL
Paper
C19 H16 N2 O3P c a 2117.2908; 6.9946; 27.1617
90; 90; 90
3285Kant, Rajni; Gupta, Vivek K.; Kapoor, Kamini; Samshuddin, S.; Narayana, B.; Sarojini, B. K.
<i>N</i>'-[(<i>E</i>)-4-Hydroxybenzylidene]-2-(naphthalen-2-yloxy)acetohydrazide
Acta Crystallographica Section E, 2012, 68, o2923-o2924
2236515 CIF
HKL
Paper
C12 H12 N4 O5P c a 2114.963; 8.5; 20.385
90; 90; 90
2592.7Ton, Quoc-Cuong; Bolte, Michael
Intra- and intermolecular proton transfer in 2,6-diaminopyridinium 4-hydroxypyridin-1-ium-2,6-dicarboxylate
Acta Crystallographica Section E, 2012, 68, o2860-o2861
2236542 CIF
HKL
Paper
C17 H13 N OP c a 2113.6348; 5.8768; 15.869
90; 90; 90
1271.6Sharif, Hafiz Muhammad Adeel; Alvi, Dildar Ahmed; Yousuf, S.
2-[(<i>E</i>)-(Naphthalen-2-yl)iminomethyl]phenol
Acta Crystallographica Section E, 2012, 68, o2629
2236624 CIF
HKL
Paper
C2 H4 N3 O4 P ZnP c a 218.5467; 8.4344; 8.9674
90; 90; 90
646.43Aitenneite, Hafid; El Bouari, Abdeslam; Sebti, Said; Saadi, Mohamed; El Ammari, Lahcen; Adil, Karim
Poly[(μ~3~-hydrogenphosphato)(4<i>H</i>-1,2,4-triazole-κ<i>N</i>^1^)zinc]
Acta Crystallographica Section E, 2012, 68, m1426-m1427
2236766 CIF
HKL
Paper
C10 H9 N OP c a 2116.9456; 5.7029; 8.6333
90; 90; 90
834.31Ismail, Sharifah Shafiqah; Khaledi, Hamid; Mohd Ali, Hapipah
5-Methyl-1<i>H</i>-indole-3-carbaldehyde
Acta Crystallographica Section E, 2012, 68, o2691
2237037 CIF
HKL
Paper
C18 H14.6 I N2 O4.8 SP c a 2116.2403; 7.1539; 15.2458
90; 90; 90
1771.28Smith, Graham
Quinolinium 8-hydroxy-7-iodoquinoline-5-sulfonate 0.8-hydrate
Acta Crystallographica Section E, 2012, 68, o3349
2237203 CIF
HKL
Paper
C10 H12 O4P c a 2119.174; 5.5026; 8.9956
90; 90; 90
949.1Scalzullo, Stefania M.; Khorasani, Sanaz; Michael, Joseph P.
1-(2-Hydroxy-4,5-dimethoxyphenyl)ethanone
Acta Crystallographica Section E, 2013, 69, o139
2237263 CIF
HKL
Paper
C22 H21 Cl2 N OP c a 2118.0123; 7.0128; 15.4364
90; 90; 90
1949.9Yang, Quanzhi; Chen, Lingzi; Weng, Bixia; Fan, Lei; Wu, Xiaoping
(3<i>E</i>,5<i>E</i>)-3,5-Bis(2-chlorobenzylidene)-1-propylpiperidin-4-one
Acta Crystallographica Section E, 2013, 69, o63
2237356 CIF
HKL
Paper
C25 H31 N O4P c a 2114.1607; 15.3126; 21.1196
90; 90; 90
4579.5Kant, Rajni; Gupta, Vivek K.; Kapoor, Kamini; Patil, D. R.; Chandam, D. R.; Deshmukh, Madhukar B.
9-(3,4-Dimethoxyphenyl)-3,3,6,6-tetramethyl-1,2,3,4,5,6,7,8,9,10-decahydroacridine-1,8-dione
Acta Crystallographica Section E, 2013, 69, o297-o298
2237371 CIF
Paper
C33 H25 F2 N O2P c a 2117.728; 12.272; 12.094
90; 90; 90
2631Chen, Gao-Zhi; Wei, Xiao-Yan; Wang, Yi; Ren, Lu-Qing; Li, Xiao-Kun
3''-(2-Fluorobenzylidene)-4'-(2-fluorophenyl)-1'-methyldispiro[acenaphthylene-1,2'-pyrrolidine-3',1''-cyclopentane]-2,2''-dione
Acta Crystallographica Section E, 2013, 69, o249-o250
2237403 CIF
HKL
Paper
C18 H14 N2 O2P c a 2119.326; 10.7866; 6.9072
90; 90; 90
1439.9Suresh, G.; Srinivasan, J.; Bakthadoss, M.; Aravindhan, S.
3-(2-Methylphenyl)-3a,4-dihydro-3<i>H</i>-chromeno[4,3-<i>c</i>]isoxazole-3a-carbonitrile
Acta Crystallographica Section E, 2013, 69, o181
2237513 CIF
HKL
Paper
C17 H18 N2 OP c a 2126.1151; 4.9484; 11.3933
90; 90; 90
1472.33Taha, Muhammad; Ismail, Nor Hadiani; Jaafar, Faridahanim Mohd; Khan, Khalid M.; Yousuf, Sammer
(<i>E</i>)-2,4-Dimethyl-<i>N</i>'-(2-methylbenzylidene)benzohydrazide
Acta Crystallographica Section E, 2013, 69, o400
2237521 CIF
HKL
Paper
C21 H21 N5 O2P c a 2119.7286; 11.5659; 17.8088
90; 90; 90
4063.6Song, Xiang-Yun; Gu, Wei-Jin; Jiang, Yu-Liang; Wang, Bing-Xiang
(3,5-Dimethyl-1<i>H</i>-pyrazol-1-yl){3-[(3,5-dimethyl-1<i>H</i>-pyrazol-1-yl)carbonyl]-5-methylindolizin-1-yl}methanone
Acta Crystallographica Section E, 2013, 69, o450
2237740 CIF
HKL
Paper
C14 H8 Cl6 O4 SP c a 2113.993; 9.189; 28.778
90; 90; 90
3700.3Lehmler, Hans-Joachim; He, Xianran; Duffel, Michael W.; Parkin, Sean
3,4',5-Trichlorobiphenyl-4-yl 2,2,2-trichloroethyl sulfate
Acta Crystallographica Section E, 2013, 69, o620

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