Crystallography Open Database

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2019166 CIF
Paper
C18 H38 N4 O8P -15.8454; 7.7696; 13.0987
75.336; 81.763; 78.448
561.16Smith, Graham; Wermuth, Urs D.
Three-dimensional hydrogen-bonded structures in the hydrated proton-transfer salts of isonipecotamide with the dicarboxylic oxalic and adipic acid homologues
Acta Crystallographica Section C, 2013, 69, 1192-1195
2019167 CIF
Paper
C26 H20 N4 OP 1 21/c 112.786; 7.872; 20.732
90; 105.573; 90
2010.1Hou, Shan; Liu, Qi-Kui; Li, Yan-An; Ma, Jian-Ping; Dong, Yu-Bin
2,5-Bis[4-methyl-3-(pyridin-3-yl)phenyl]-1,3,4-oxadiazole and its one-dimensional polymeric complex with ZnCl~2~
Acta Crystallographica Section C, 2013, 69, 1108-1111
2019168 CIF
Paper
C26 H20 Cl2 N4 O ZnP 1 21/n 117.779; 7.3406; 18.944
90; 102.942; 90
2409.5Hou, Shan; Liu, Qi-Kui; Li, Yan-An; Ma, Jian-Ping; Dong, Yu-Bin
2,5-Bis[4-methyl-3-(pyridin-3-yl)phenyl]-1,3,4-oxadiazole and its one-dimensional polymeric complex with ZnCl~2~
Acta Crystallographica Section C, 2013, 69, 1108-1111
2019169 CIF
Paper
C9 H8 K2 O11 SP 1 21/n 111.4108; 7.1795; 16.9372
90; 95.774; 90
1380.52Xiong, Wei-Lu; Wang, Yu-Ling; Liu, Qing-Yan
A three-dimensional polymeric potassium complex of 5-sulfonobenzene-1,2,4-tricarboxylic acid: poly[μ-aqua-aqua-μ~9~-(2,4-dicarboxy-5-sulfonatobenzoato)-dipotassium(I)]
Acta Crystallographica Section C, 2013, 69, 1132-1135
2019170 CIF
Paper
C19 H21 Br N O3 PP 1 21/n 110.9339; 16.5179; 11.1325
90; 104.114; 90
1949.9Ouahrouch, Abdelaaziz; Krim, Jamal; Taourirte, Moha; Lazrek, Hassan B.; Engels, Joachim W.; Bats, Jan W.
Four related diethyl [(arylamino)(4-ethynylphenyl)methyl]phosphonates
Acta Crystallographica Section C, 2013, 69, 1157-1163
2019171 CIF
Paper
C23 H31 Cl N O3 P SiI 1 2/a 117.3791; 14.7131; 20.019
90; 90.464; 90
5118.7Ouahrouch, Abdelaaziz; Krim, Jamal; Taourirte, Moha; Lazrek, Hassan B.; Engels, Joachim W.; Bats, Jan W.
Four related diethyl [(arylamino)(4-ethynylphenyl)methyl]phosphonates
Acta Crystallographica Section C, 2013, 69, 1157-1163
2019172 CIF
Paper
C22 H29 F N O3 P SiP -18.9633; 11.1726; 12.6997
69.98; 87.263; 73.667
1145.06Ouahrouch, Abdelaaziz; Krim, Jamal; Taourirte, Moha; Lazrek, Hassan B.; Engels, Joachim W.; Bats, Jan W.
Four related diethyl [(arylamino)(4-ethynylphenyl)methyl]phosphonates
Acta Crystallographica Section C, 2013, 69, 1157-1163
2019173 CIF
Paper
C23 H24 N O3 PP -111.3104; 11.5194; 17.8485
82.703; 81.943; 64.035
2064.5Ouahrouch, Abdelaaziz; Krim, Jamal; Taourirte, Moha; Lazrek, Hassan B.; Engels, Joachim W.; Bats, Jan W.
Four related diethyl [(arylamino)(4-ethynylphenyl)methyl]phosphonates
Acta Crystallographica Section C, 2013, 69, 1157-1163
2019174 CIF
Paper
C8 H22 Mg O8P 1 21/c 113.808; 10.704; 9.183
90; 90.241; 90
1357.2Malaestean, Iurie L.; Schmitz, Sebastian; Ellern, Arkady; Kögerler, Paul
<!?tlsb=-0.06pt>Zigzag polymer chains in <i>catena</i>-poly[[[triaqua(isobutyrato-κ<i>O</i>)magnesium(II)]-μ-isobutyrato-κ^2^<i>O</i>:<i>O</i>'] monohydrate]
Acta Crystallographica Section C, 2013, 69, 1144-1146
2019175 CIF
Paper
C17 H11 F5 N4 OP 1 21/n 111.6678; 16.6283; 17.8362
90; 97.368; 90
3431.9Alvarez-Thon, Luis; Bustos, Carlos; Espinoza-Santibañez, Katherina; Garland, Maria Teresa; Baggio, Ricardo
Dimers linked by type-I C—F···F—C contacts in (<i>Z</i>)-3-methyl-4-[2-(4-methylphenyl)hydrazinylidene]-1-(pentafluorophenyl)-1<i>H</i>-pyrazol-5(4<i>H</i>)-one
Acta Crystallographica Section C, 2013, 69, 1200-1204
2019176 CIF
Paper
C12 H19 Cl N4 O5C 1 2/c 133.661; 5.1236; 20.232
90; 113.93; 90
3189.4Zhang, Heng; Chang, Liangliang; Wang, Na; Xuan, Xiaopeng
1-Carboxymethyl-3-methyl-1<i>H</i>-imidazol-3-ium chloride 2-(3-methyl-1<i>H</i>-imidazol-3-ium-1-yl)acetate monohydrate: a crystal stabilized by imidazolium zwitterions
Acta Crystallographica Section C, 2013, 69, 1173-1176
2019177 CIF
Paper
Ge4 Li2 O9P 21 c a9.31165; 4.62854; 15.81663
90; 90; 90
681.686Redhammer, Günther J.; Tippelt, Gerold
The polar phase of Li~2~Ge~4~O~9~ at 298, 150 and 90K
Acta Crystallographica Section C, 2013, 69, 1091-1095
2019178 CIF
Paper
Ge4 Li2 O9P 21 c a9.3044; 4.6253; 15.8331
90; 90; 90
681.39Redhammer, Günther J.; Tippelt, Gerold
The polar phase of Li~2~Ge~4~O~9~ at 298, 150 and 90K
Acta Crystallographica Section C, 2013, 69, 1091-1095
2019179 CIF
Paper
Ge4 Li2 O9P 21 c a9.3081; 4.6267; 15.8298
90; 90; 90
681.72Redhammer, Günther J.; Tippelt, Gerold
The polar phase of Li~2~Ge~4~O~9~ at 298, 150 and 90K
Acta Crystallographica Section C, 2013, 69, 1091-1095
2019180 CIF
Paper
C39 H57 Al N6P c c n31.286; 33.409; 14.3488
90; 90; 90
14998Mayo, Dennis H.; Peng, Yang; Zavalij, Peter; Bowen, Kit H.; Eichhorn, Bryan W.
Aluminium(III) amidinates formed from reactions of `AlCl' with lithium amidinates
Acta Crystallographica Section C, 2013, 69, 1120-1123
2019181 CIF
Paper
C26 H38 Al Cl N4P 1 21/c 119.205; 16.4832; 17.8498
90; 106.287; 90
5423.8Mayo, Dennis H.; Peng, Yang; Zavalij, Peter; Bowen, Kit H.; Eichhorn, Bryan W.
Aluminium(III) amidinates formed from reactions of `AlCl' with lithium amidinates
Acta Crystallographica Section C, 2013, 69, 1120-1123
2019182 CIF
Paper
C40.7 H59.4 Al Cl N4 O0.68C 1 2/c 122.042; 16.007; 12.852
90; 115.396; 90
4096.3Mayo, Dennis H.; Peng, Yang; Zavalij, Peter; Bowen, Kit H.; Eichhorn, Bryan W.
Aluminium(III) amidinates formed from reactions of `AlCl' with lithium amidinates
Acta Crystallographica Section C, 2013, 69, 1120-1123
2019183 CIF
Paper
C44 H34 Cd2 O9 S4P -112.472; 12.76; 14.192
76.778; 80.258; 68.709
2039.4Deng, Yong-Kai; Yan, Zhi-Hao; Sun, Di
A one-dimensional cadmium metal‒organic chain based on a [Cd~4~(COO)~4~] secondary building unit and a flexible dicarboxylic acid ligand
Acta Crystallographica Section C, 2013, 69, 1147-1151
2019184 CIF
Paper
C20 H23 Cu N3 O9P -18.5997; 11.1264; 11.6962
85.02; 85.72; 74.647
1073.57Zamisa, Sizwe J.; Ndungu, Patrick; Omondi, Bernard
The double-stranded ladder-like structure of poly[[bis(μ~2~-acetato-κ^2^<i>O</i>:<i>O</i>')bis(acetato-κ<i>O</i>)bis(μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>')dicopper(II)] 4-nitrophenol disolvate tetrahydrate]
Acta Crystallographica Section C, 2013, 69, 1100-1103
2019185 CIF
Paper
C19 H19 Cl2 I N6 O3P 1 21/n 19.7282; 24.9148; 10.0307
90; 108.618; 90
2304Sridhar, Balasubramanian; Nanubolu, Jagadeesh Babu; Ravikumar, Krishnan
Solvent-mediated pseudo-quadruple hydrogen-bond motifs in three lamotrigine‒carboxylic acid complexes
Acta Crystallographica Section C, 2013, 69, 1164-1169
2019186 CIF
Paper
C20 H22 Cl2 N6 O3P 1 21/n 19.3976; 24.904; 10.2105
90; 108.976; 90
2259.8Sridhar, Balasubramanian; Nanubolu, Jagadeesh Babu; Ravikumar, Krishnan
Solvent-mediated pseudo-quadruple hydrogen-bond motifs in three lamotrigine‒carboxylic acid complexes
Acta Crystallographica Section C, 2013, 69, 1164-1169
2019187 CIF
Paper
C19 H18 Cl2 N8 O8P -110.0227; 10.5507; 12.5359
81.858; 71.888; 70.009
1183.1Sridhar, Balasubramanian; Nanubolu, Jagadeesh Babu; Ravikumar, Krishnan
Solvent-mediated pseudo-quadruple hydrogen-bond motifs in three lamotrigine‒carboxylic acid complexes
Acta Crystallographica Section C, 2013, 69, 1164-1169
2019188 CIF
Paper
C16 H12 N4 SC 1 2/c 133.4368; 6.049; 14.6066
90; 108.034; 90
2809.18Bolduc, Andréanne; Dufresne, Stéphane; Skene, W. G.
The six-membered-ring azomethine <i>N</i>-((<i>E</i>)-{5-[(<i>E</i>)-(pyridin-3-ylimino)methyl]thiophen-2-yl}methylidene)pyridin-3-amine
Acta Crystallographica Section C, 2013, 69, 1196-1199
2019189 CIF
Paper
Cs2.91 Fe3.25 H16 Na1.34 O33 S6C 1 2 117.183; 9.482; 20.058
90; 110.42; 90
3062.7Mereiter, Kurt
Cs~2.91~Na~1.34~Fe^3+^~0.25~[Fe~3~O(SO~4~)~6~(H~2~O)~3~]·5H~2~O, a member of the Maus's salt family
Acta Crystallographica Section C, 2013, 69, 1085-1090
2019190 CIF
Paper
C14 H19 N3 O3P -17.7253; 8.6778; 11.5759
72.136; 87.59; 75.671
715.16Wani, Naiem Ahmad; Gupta, Vivek Kumar; Kant, Rajni; Aravinda, Subrayashastry; Rai, Rajkishor
<i>C</i>~5~ and <i>C</i>~7~ intramolecular hydrogen bonds stabilize the structure of <i>N</i>-pyrazinoyl-gabapentin (Pyr-Gpn-OH)
Acta Crystallographica Section C, 2013, 69, 1170-1172
2019191 CIF
Paper
C14 H26 Mn3 N2 O21C 1 2/c 111.156; 14.659; 15.887
90; 96.07; 90
2583.5Mirzaei, Masoud; Eshtiagh-Hosseini, Hossein; Karrabi, Zahra; Notash, Behrouz
<i>catena</i>-Poly[[di-μ~2~-aqua-hexaaquabis(μ~3~-4-oxidopyridine-2,6-dicarboxylato)trimanganese(II)] trihydrate]: a new one-dimensional coordination polymer based on a trinuclear Mn^II^ complex of chelidamic acid
Acta Crystallographica Section C, 2013, 69, 1140-1143
2019192 CIF
Paper
C25 H20 F6 N4 O Si ZnP 1 21/n 111.3701; 12.7057; 16.3139
90; 100.896; 90
2314.3Seidel, Rüdiger W.; Dietz, Christina; Breidung, Jürgen; Goddard, Richard; Oppel, Iris M.
(Hexafluorosilicato-κ^2^<i>F</i>,<i>F</i>')bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')zinc(II) methanol monosolvate
Acta Crystallographica Section C, 2013, 69, 1112-1115
2019193 CIF
Paper
C23 H20 N2P -19.4245; 10.6605; 18.405
80.2989; 85.094; 78.1155
1781.2Shi, Yao-Cheng; Duan, Hong-Yang
Two seven-membered heterocycles with 1,2-diaza ring N atoms: 3,5,7-triphenyl-1,2-diazacyclohepta-1(7),2-diene and 3,7-bis(2-hydroxyphenyl)-5-phenyl-1,2-diazacyclohepta-1(7),2-diene
Acta Crystallographica Section C, 2013, 69, 1177-1180
2019194 CIF
Paper
Ct H20 N2 O2 wo23C 1 2/c 123.9715; 9.5669; 18.2303
90; 119.256; 90
3647.5Shi, Yao-Cheng; Duan, Hong-Yang
Two seven-membered heterocycles with 1,2-diaza ring N atoms: 3,5,7-triphenyl-1,2-diazacyclohepta-1(7),2-diene and 3,7-bis(2-hydroxyphenyl)-5-phenyl-1,2-diazacyclohepta-1(7),2-diene
Acta Crystallographica Section C, 2013, 69, 1177-1180
2019195 CIF
Paper
C65.18 H60.36 N8 O S8.18 Zn4P -111.757; 16.145; 17.376
92.254; 91.897; 110.427
3084.6Luck, Rudy L.; Olds, Travis A.; Zeller, Matthias
Bis{μ-2,2'-[(butane-2,3-diylidene)bis(azanylylidene)]dibenzenethiolato}dizinc(II)‒dimethyl sulfoxide‒methanol (2/0.18/0.82)
Acta Crystallographica Section C, 2013, 69, 1116-1119
2019196 CIF
Paper
C33 H32 Co N10 O4 S2P 1 21 19.5651; 16.6002; 11.3351
90; 108.4; 90
1707.8Zhao, Ya-Yun; Zhao, Xiu-Hua; Zhang, Jie; Pan, Jian-Guo; Li, Xing
Electrochemical properties of a cobalt(II) complex with sulfadiazine and 1,3-bis(pyridin-4-yl)propane
Acta Crystallographica Section C, 2013, 69, 1096-1099
2019197 CIF
Paper
C14 H12 N2 Ni O7P 1 21/n 16.5322; 30.456; 7.2856
90; 91.223; 90
1449.1Chen, Man-Sheng; Xu, Jin-Sheng; Deng, Yi-Fang; Zhang, Chun-Hua
Poly[diaqua[μ~4~-4-(isonicotinamido)phthalato]nickel(II)] displaying an <b>sra</b> topology
Acta Crystallographica Section C, 2013, 69, 1124-1127
2019198 CIF
Paper
C5 H9 Cd Cl N2 S3P -18.0676; 8.8427; 9.0977
105.64; 105.18; 98.56
586.1Liu, Ming-Liang
A trimethylsulfonium salt with a novel polymeric cadmate anion
Acta Crystallographica Section C, 2013, 69, 1128-1131
2019199 CIF
Paper
C5 H7 Br I N2 O0.5P 1 21/n 110.531; 14.714; 11.675
90; 104.457; 90
1751.8Polson, Matthew; Turnbull, Mark M.; Wikaira, Jan L.
2-Amino-5-iodopyridinium bromide hemihydrate and 2-amino-5-iodopyridinium chloride monohydrate
Acta Crystallographica Section C, 2013, 69, 1152-1156
2019200 CIF
Paper
C5 H8.375 Cl1.375 I N2 OP 1 21/c 14.177; 12.972; 17.601
90; 94.904; 90
950.2Polson, Matthew; Turnbull, Mark M.; Wikaira, Jan L.
2-Amino-5-iodopyridinium bromide hemihydrate and 2-amino-5-iodopyridinium chloride monohydrate
Acta Crystallographica Section C, 2013, 69, 1152-1156
2019201 CIF
Paper
C10 H22 Cl4 N2 ZnP b c a11.3673; 9.5997; 28.6571
90; 90; 90
3127.14Soudani, Sarra; Aubert, Emmanuel; Jelsch, Christian; Ben Nasr, Cherif
The organic‒inorganic hybrid material 1-cyclohexylpiperazine-1,4-diium tetrachloridozincate
Acta Crystallographica Section C, 2013, 69, 1304-1306
2019202 CIF
Paper
Mo6 Na9 O24 ScR -315.0087; 15.0087; 19.1943
90; 90; 120
3744.46Savina, Aleksandra A.; Morozov, Vladimir A.; Basovich, Olga M.; Khaikina, Elena G.; Lazoryak, Bogdan I.
The double molybdate Na~9~Sc(MoO~4~)~6~ refined from powder XRD data
Acta Crystallographica Section C, 2013, 69, 1301-1303
2019203 CIF
Paper
B4 H16 K YbC m c m8.4341; 12.445; 9.6449
90; 90; 90
1012.4Wegner, Wojciech; Jaroń, Tomasz; Grochala, Wojciech
<i>M</i>Yb(BH~4~)~4~ (<i>M</i> = K, Na) from laboratory X-ray powder data
Acta Crystallographica Section C, 2013, 69, 1289-1291
2019204 CIF
Paper
B4 H16 Na YbC m c m8.438; 12.057; 9.057
90; 90; 90
921.4Wegner, Wojciech; Jaroń, Tomasz; Grochala, Wojciech
<i>M</i>Yb(BH~4~)~4~ (<i>M</i> = K, Na) from laboratory X-ray powder data
Acta Crystallographica Section C, 2013, 69, 1289-1291
2019205 CIF
Paper
C14 H13 N3 O4P -17.235; 7.282; 13.512
88.714; 85.131; 67.239
654Wade, Colin B.; Mohanty, Dillip K.; Squattrito, Philip J.; Amato, Nicholas J.; Kirschbaum, Kristin
A series of <i>N</i>-(2-phenylethyl)nitroaniline derivatives as precursors for slow and sustained nitric oxide release agents
Acta Crystallographica Section C, 2013, 69, 1383-1389
2019206 CIF
Paper
C22 H22 N4 O4P -18.1121; 10.1819; 13.1018
93.466; 106.595; 106.932
979.88Wade, Colin B.; Mohanty, Dillip K.; Squattrito, Philip J.; Amato, Nicholas J.; Kirschbaum, Kristin
A series of <i>N</i>-(2-phenylethyl)nitroaniline derivatives as precursors for slow and sustained nitric oxide release agents
Acta Crystallographica Section C, 2013, 69, 1383-1389
2019207 CIF
Paper
C15 H13 N3 O2P 1 21/n 17.4871; 16.27; 10.8432
90; 94.384; 90
1317Wade, Colin B.; Mohanty, Dillip K.; Squattrito, Philip J.; Amato, Nicholas J.; Kirschbaum, Kristin
A series of <i>N</i>-(2-phenylethyl)nitroaniline derivatives as precursors for slow and sustained nitric oxide release agents
Acta Crystallographica Section C, 2013, 69, 1383-1389
2019208 CIF
Paper
C15 H16 N2 O4 SI 41/a :220.4639; 20.4639; 14.3952
90; 90; 90
6028.3Wade, Colin B.; Mohanty, Dillip K.; Squattrito, Philip J.; Amato, Nicholas J.; Kirschbaum, Kristin
A series of <i>N</i>-(2-phenylethyl)nitroaniline derivatives as precursors for slow and sustained nitric oxide release agents
Acta Crystallographica Section C, 2013, 69, 1383-1389
2019209 CIF
Paper
C22 H23 Cu N3 O5P 1 21/c 110.874; 22.702; 9.137
90; 106.701; 90
2160.4Chen, Xiao-Hua; Chen, Shun-Yu; Xie, Chun-Ling; Wu, Qiong-Jie
A novel one-dimensional copper(II) coordination polymer and a trinuclear nickel(II) complex with a one-dimensional hydrogen-bonded structure
Acta Crystallographica Section C, 2013, 69, 1373-1377
2019210 CIF
Paper
C48 H62 N12 Ni3 O14P -110.978; 11.653; 12.276
80.87; 64.41; 74.069
1360.5Chen, Xiao-Hua; Chen, Shun-Yu; Xie, Chun-Ling; Wu, Qiong-Jie
A novel one-dimensional copper(II) coordination polymer and a trinuclear nickel(II) complex with a one-dimensional hydrogen-bonded structure
Acta Crystallographica Section C, 2013, 69, 1373-1377
2019211 CIF
Paper
C26 H24 B Cu F4 N7P 1 21/c 113.6714; 17.0453; 11.2195
90; 93.361; 90
2610Potočňák, Ivan; Burčák, Milan; Dušek, Michal
Low-dimensional compounds containing cyanide groups. XXVI. (Dicyanamido-κ<i>N</i>^1^)bis(5,5'-dimethyl-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')copper(II) complexes with tetrafluoroborate and perchlorate anions
Acta Crystallographica Section C, 2013, 69, 1357-1361
2019212 CIF
Paper
C26 H24 Cl Cu N7 O4P 1 21/c 113.6977; 16.9837; 11.3416
90; 93.146; 90
2634.5Potočňák, Ivan; Burčák, Milan; Dušek, Michal
Low-dimensional compounds containing cyanide groups. XXVI. (Dicyanamido-κ<i>N</i>^1^)bis(5,5'-dimethyl-2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')copper(II) complexes with tetrafluoroborate and perchlorate anions
Acta Crystallographica Section C, 2013, 69, 1357-1361
2019213 CIF
Paper
C54 H36 Fe N14 O5P -19.8498; 12.9871; 18.8001
83.7705; 89.3525; 85.699
2383.97Setifi, Zouaoui; Domasevitch, Konstantin V.; Setifi, Fatima; Mach, Pavel; Ng, Seik Weng; Petříček, Vaclav; Dušek, Michal
Multiple anion···π interactions in tris(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')iron(II) bis[1,1,3,3-tetracyano-2-(2-hydroxyethyl)propenide] monohydrate
Acta Crystallographica Section C, 2013, 69, 1351-1356
2019214 CIF
Paper
C28 H24 Cd N8 O5 S2P 1 21/n 18.2871; 30.7094; 12.1783
90; 107.289; 90
2959.25Zhao, Xiu-Hua; Zhao, Ya-Yun; Zhang, Jie; Pan, Jian-Guo; Li, Xing
Synthesis, crystal structure and fluorescence spectrum of a cadmium(II) sulfaquinoxaline complex
Acta Crystallographica Section C, 2013, 69, 1332-1335
2019215 CIF
Paper
C15 H18 N2 O2 SP -17.9753; 8.1446; 11.7776
86.829; 81.6; 67.124
697.29Pan, Fangfang; Englert, Ulli
A new polymorph of <i>N</i>-(6-methylpyridin-2-yl)mesitylenesulfonamide
Acta Crystallographica Section C, 2013, 69, 1217-1220
2019216 CIF
Paper
C20 H24 Cu N10 O4 S2P n a 2113.662; 12.6329; 13.9651
90; 90; 90
2410.2Pan, Fangfang; Kalf, Irmgard; Englert, Ulli
Bis[4-amino-<i>N</i>-(pyrimidin-2-yl)benzenesulfonamido]diamminecopper(II): aqua or ammine ligands?
Acta Crystallographica Section C, 2013, 69, 1221-1224
2019217 CIF
Paper
C20 H24 Cu N10 O4 S2P n a 2113.7824; 12.5795; 14.1313
90; 90; 90
2450Pan, Fangfang; Kalf, Irmgard; Englert, Ulli
Bis[4-amino-<i>N</i>-(pyrimidin-2-yl)benzenesulfonamido]diamminecopper(II): aqua or ammine ligands?
Acta Crystallographica Section C, 2013, 69, 1221-1224
2019218 CIF
Paper
C8 H12 N2 O3 SP 21 21 216.1954; 10.4543; 14.7654
90; 90; 90
956.33Saouane, Sofiane; Buth, Gernot; Fabbiani, Francesca P. A.
Crystal structure and packing energy calculations of (+)-6-aminopenicillanic acid
Acta Crystallographica Section C, 2013, 69, 1238-1242
2019219 CIF
Paper
C27 H22 N4 O7P -18.233; 11.872; 13.773
109.61; 95.34; 109.75
1160.7Sowa, Michał; Ślepokura, Katarzyna; Matczak-Jon, Ewa
A 1:2 cocrystal of genistein with isonicotinamide: crystal structure and Hirshfeld surface analysis
Acta Crystallographica Section C, 2013, 69, 1267-1272
2019220 CIF
Paper
C14 H14 N4 O2 SP 1 21/c 16.834; 16.923; 12.531
90; 104.882; 90
1400.6Tatum, Natalie J.; Villemagne, Baptiste; Willand, Nicolas; Deprez, Benoit; Liebeschuetz, John W.; Baulard, Alain R.; Pohl, Ehmke
Structural and docking studies of potent ethionamide boosters
Acta Crystallographica Section C, 2013, 69, 1243-1250
2019221 CIF
Paper
C19 H19 F3 N4 O3 SP 21 21 214.828; 16.1865; 24.3327
90; 90; 90
1901.56Tatum, Natalie J.; Villemagne, Baptiste; Willand, Nicolas; Deprez, Benoit; Liebeschuetz, John W.; Baulard, Alain R.; Pohl, Ehmke
Structural and docking studies of potent ethionamide boosters
Acta Crystallographica Section C, 2013, 69, 1243-1250
2019222 CIF
Paper
C19 H22 F3 N3 O4 SP 1 21/c 110.7027; 19.853; 9.873
90; 104.568; 90
2030.4Tatum, Natalie J.; Villemagne, Baptiste; Willand, Nicolas; Deprez, Benoit; Liebeschuetz, John W.; Baulard, Alain R.; Pohl, Ehmke
Structural and docking studies of potent ethionamide boosters
Acta Crystallographica Section C, 2013, 69, 1243-1250
2019223 CIF
Paper
C44 H52 Cl2 N6 O12P -19.4171; 9.7604; 13.7949
74.708; 86.102; 65.518
1111.86Bhardwaj, Rajni M.; Johnston, Blair F.; Oswald, Iain D. H.; Florence, Alastair J.
A complementary experimental and computational study of loxapine succinate and its monohydrate
Acta Crystallographica Section C, 2013, 69, 1273-1278
2019224 CIF
Paper
C22 H24 Cl N3 O5C 1 2/c 136.1824; 7.08622; 18.769
90; 113.84; 90
4401.7Bhardwaj, Rajni M.; Johnston, Blair F.; Oswald, Iain D. H.; Florence, Alastair J.
A complementary experimental and computational study of loxapine succinate and its monohydrate
Acta Crystallographica Section C, 2013, 69, 1273-1278
2019225 CIF
Paper
C18 H16 Br2 N2 O4P 1 21/c 116.3604; 7.7452; 14.3658
90; 100.911; 90
1787.4Thomas, Lynne H.; Adam, Martin S.; O'Neill, Andrew; Wilson, Chick C.
Utilizing proton transfer to produce molecular salts in bromanilic acid substituted-pyridine molecular complexes ‒ predictable synthons?
Acta Crystallographica Section C, 2013, 69, 1279-1288
2019226 CIF
Paper
C18 H16 Br2 N2 O4P 1 21/c 18.9526; 9.6149; 10.4275
90; 103.935; 90
871.17Thomas, Lynne H.; Adam, Martin S.; O'Neill, Andrew; Wilson, Chick C.
Utilizing proton transfer to produce molecular salts in bromanilic acid substituted-pyridine molecular complexes ‒ predictable synthons?
Acta Crystallographica Section C, 2013, 69, 1279-1288
2019227 CIF
Paper
C18 H16 Br2 N2 O4P 1 21/c 18.1345; 6.1517; 17.7868
90; 96.177; 90
884.9Thomas, Lynne H.; Adam, Martin S.; O'Neill, Andrew; Wilson, Chick C.
Utilizing proton transfer to produce molecular salts in bromanilic acid substituted-pyridine molecular complexes ‒ predictable synthons?
Acta Crystallographica Section C, 2013, 69, 1279-1288
2019228 CIF
Paper
C13 H11 Br2 N O4P 1 21/c 18.2948; 12.156; 13.9544
90; 102.966; 90
1371.17Thomas, Lynne H.; Adam, Martin S.; O'Neill, Andrew; Wilson, Chick C.
Utilizing proton transfer to produce molecular salts in bromanilic acid substituted-pyridine molecular complexes ‒ predictable synthons?
Acta Crystallographica Section C, 2013, 69, 1279-1288
2019229 CIF
Paper
C13 H11 Br2 N O4P 1 21/c 17.7357; 11.1416; 15.8011
90; 94.269; 90
1358.09Thomas, Lynne H.; Adam, Martin S.; O'Neill, Andrew; Wilson, Chick C.
Utilizing proton transfer to produce molecular salts in bromanilic acid substituted-pyridine molecular complexes ‒ predictable synthons?
Acta Crystallographica Section C, 2013, 69, 1279-1288
2019230 CIF
Paper
C13 H11 Br2 N O4P 1 21/c 111.6766; 10.4926; 11.5221
90; 98.834; 90
1394.92Thomas, Lynne H.; Adam, Martin S.; O'Neill, Andrew; Wilson, Chick C.
Utilizing proton transfer to produce molecular salts in bromanilic acid substituted-pyridine molecular complexes ‒ predictable synthons?
Acta Crystallographica Section C, 2013, 69, 1279-1288
2019231 CIF
Paper
C12 H8 Br3 N O4P 1 21/c 110.2229; 5.576; 24.53
90; 95.802; 90
1391.12Thomas, Lynne H.; Adam, Martin S.; O'Neill, Andrew; Wilson, Chick C.
Utilizing proton transfer to produce molecular salts in bromanilic acid substituted-pyridine molecular complexes ‒ predictable synthons?
Acta Crystallographica Section C, 2013, 69, 1279-1288
2019232 CIF
Paper
C13 H11 Br2 N O4P 1 21/n 14.9786; 23.181; 12.2811
90; 100.794; 90
1392.3Thomas, Lynne H.; Adam, Martin S.; O'Neill, Andrew; Wilson, Chick C.
Utilizing proton transfer to produce molecular salts in bromanilic acid substituted-pyridine molecular complexes ‒ predictable synthons?
Acta Crystallographica Section C, 2013, 69, 1279-1288
2019233 CIF
Paper
C12 H8 Br3 N O4P 1 21/c 15.2866; 13.3814; 20.3576
90; 91.556; 90
1439.61Thomas, Lynne H.; Adam, Martin S.; O'Neill, Andrew; Wilson, Chick C.
Utilizing proton transfer to produce molecular salts in bromanilic acid substituted-pyridine molecular complexes ‒ predictable synthons?
Acta Crystallographica Section C, 2013, 69, 1279-1288
2019234 CIF
Paper
C22 H20 Mn N2 O9P 1 21/n 19.092; 29.484; 9.093
90; 117.04; 90
2171.1Lei, Yong-Qian; Wang, Guan-Hua
A two-dimensional network containing an ‒Mn—O—C—O—Mn‒ chain: poly[diaqua[1,2-bis(pyridin-4-yl)ethylene][μ~3~-3-carboxy-5-(carboxylatomethoxy)benzoato]manganese(II)]
Acta Crystallographica Section C, 2013, 69, 1311-1313
2019235 CIF
Paper
C11 H13 N OP 1 21/n 16.2966; 25.416; 11.7111
90; 90.162; 90
1874.2Andrews, Keith G.; Frampton, Christopher S.; Spivey, Alan C.
Structural assignment of a bis-cyclopentenyl-β-cyanohydrin formed <i>via</i> alkene metathesis from either a triene or a tetraene precursor
Acta Crystallographica Section C, 2013, 69, 1207-1211
2019236 CIF
Paper
C26 H30 Cu2 N4 O16P -18.1142; 11.94; 16.16
77.797; 84.782; 88.231
1523.8Ge, Jing-Yuan; Wang, Peng; Ma, Jian-Ping; Liu, Qi-Kui; Dong, Yu-Bin
A well-resolved cyclic water tetramer in a dinuclear Cu^II^ coordination complex based on 1,2-bis(pyridin-3-yloxy)ethane and capped by pyridine-2,6-dicarboxylic acid
Acta Crystallographica Section C, 2013, 69, 1362-1366
2019237 CIF
Paper
C16 H16 N2 O4 SP 1 21/c 15.5673; 15.7196; 18.125
90; 97.641; 90
1572.1Eberlin, Alex R.; Eddleston, Mark D.; Frampton, Christopher S.
Methanesulfonic acid salt forms of carbamazepine and 10,11-dihydrocarbamazepine
Acta Crystallographica Section C, 2013, 69, 1260-1266
2019238 CIF
Paper
C16 H18 N2 O4 SP 1 21/c 15.4477; 15.734; 18.5034
90; 96.647; 90
1575.34Eberlin, Alex R.; Eddleston, Mark D.; Frampton, Christopher S.
Methanesulfonic acid salt forms of carbamazepine and 10,11-dihydrocarbamazepine
Acta Crystallographica Section C, 2013, 69, 1260-1266
2019239 CIF
Paper
C17 H13 F3 N2 O3P 1 21/n 114.9968; 5.266; 20.1911
90; 102.191; 90
1558.6Eberlin, Alex R.; Eddleston, Mark D.; Frampton, Christopher S.
Methanesulfonic acid salt forms of carbamazepine and 10,11-dihydrocarbamazepine
Acta Crystallographica Section C, 2013, 69, 1260-1266
2019240 CIF
Paper
C17 H13 F3 N2 O3P 1 21/n 114.997; 5.3712; 20.4441
90; 101.529; 90
1613.58Eberlin, Alex R.; Eddleston, Mark D.; Frampton, Christopher S.
Methanesulfonic acid salt forms of carbamazepine and 10,11-dihydrocarbamazepine
Acta Crystallographica Section C, 2013, 69, 1260-1266
2019241 CIF
Paper
C14 H20 Mo5 N2 O16C 1 2/c 130.2701; 5.6712; 14.2997
90; 108.167; 90
2332.43Oszajca, Marcin; Smrčok, Ľubomír; Łasocha, Wiesław
Bis(4-methylanilinium) and bis(4-iodoanilinium) pentamolybdates from laboratory X-ray powder data and total energy minimization
Acta Crystallographica Section C, 2013, 69, 1367-1372
2019242 CIF
Paper
C12 H14 I2 Mo5 N2 O16C 1 2/c 132.284; 5.6274; 14.3066
90; 104.329; 90
2518.3Oszajca, Marcin; Smrčok, Ľubomír; Łasocha, Wiesław
Bis(4-methylanilinium) and bis(4-iodoanilinium) pentamolybdates from laboratory X-ray powder data and total energy minimization
Acta Crystallographica Section C, 2013, 69, 1367-1372
2019243 CIF
Paper
C20 H20 O4P 21 21 216.3744; 11.961; 21.041
90; 90; 90
1604.3Simmler, Charlotte; Fronczek, Frank R.; Pauli, Guido F.; Santarsiero, Bernard D.
Absolute configuration of naturally occurring glabridin
Acta Crystallographica Section C, 2013, 69, 1212-1216
2019244 CIF
Paper
C7 H13 N O4P 1 21 16.2876; 10.7132; 6.7764
90; 111.143; 90
425.73Rajalakshmi, P.; Srinivasan, N.; Krishnakumar, R. V.; Razak, Ibrahim Abdul; Rosli, Mohd Mustaqim
Supramolecular architectures of <i>N</i>-acetyl-<small>L</small>-proline monohydrate and <i>N</i>-benzyl-<small>L</small>-proline
Acta Crystallographica Section C, 2013, 69, 1390-1396
2019245 CIF
Paper
C12 H15 N O2P 1 21 18.7552; 10.6254; 11.2816
90; 93.737; 90
1047.27Rajalakshmi, P.; Srinivasan, N.; Krishnakumar, R. V.; Razak, Ibrahim Abdul; Rosli, Mohd Mustaqim
Supramolecular architectures of <i>N</i>-acetyl-<small>L</small>-proline monohydrate and <i>N</i>-benzyl-<small>L</small>-proline
Acta Crystallographica Section C, 2013, 69, 1390-1396
2019246 CIF
Paper
C20 H18 O6P 1 21/c 115.4385; 6.1475; 8.7281
90; 105.029; 90
800.03Nye, Luke; Turnbull, Mark M.; Wikaira, Jan L.
3,4-Dihydroxy-1,6-bis(4-methoxyphenyl)hexa-2,4-diene-1,6-dione, its 4-methylphenyl analogue, and a potassium salt of 2-hydroxy-4-(4-methoxyphenyl)-4-oxobut-2-enoic acid
Acta Crystallographica Section C, 2013, 69, 1317-1321
2019247 CIF
Paper
C20 H18 O4P 1 21/c 114.771; 6.1622; 8.6184
90; 91.896; 90
784.03Nye, Luke; Turnbull, Mark M.; Wikaira, Jan L.
3,4-Dihydroxy-1,6-bis(4-methoxyphenyl)hexa-2,4-diene-1,6-dione, its 4-methylphenyl analogue, and a potassium salt of 2-hydroxy-4-(4-methoxyphenyl)-4-oxobut-2-enoic acid
Acta Crystallographica Section C, 2013, 69, 1317-1321
2019248 CIF
Paper
C22 H19 K O10P 1 21/n 115.3832; 6.3481; 21.1606
90; 90.582; 90
2066.31Nye, Luke; Turnbull, Mark M.; Wikaira, Jan L.
3,4-Dihydroxy-1,6-bis(4-methoxyphenyl)hexa-2,4-diene-1,6-dione, its 4-methylphenyl analogue, and a potassium salt of 2-hydroxy-4-(4-methoxyphenyl)-4-oxobut-2-enoic acid
Acta Crystallographica Section C, 2013, 69, 1317-1321
2019249 CIF
Paper
C15 H20 Cd N2 O11P 1 21/c 17.633; 22.831; 12.5639
90; 124.061; 90
1813.9Wang, Peng; Zhao, Ying; Chen, Yong; Kou, Xiao-Yan
A novel one-dimensional tubular cadmium(II) coordination polymer based on 5-(carboxylatomethoxy)benzene-1,3-dicarboxylate containing 4-aminopyridinium ions
Acta Crystallographica Section C, 2013, 69, 1340-1343
2019250 CIF
Paper
C19 H19 Na O6P 1 21/c 15.7235; 27.444; 21.287
90; 95.6; 90
3327.7Huang, Qiu-Ying; Liu, Chun-Li; Zhou, Zi-Peng
Two sodium(I) coordination polymers constructed by the V-shaped ligands 2,2'-[isopropylidenebis(1,4-phenyleneoxy)]diacetic acid and 2,2'-[sulfonylbis(1,4-phenyleneoxy)]diacetic acid
Acta Crystallographica Section C, 2013, 69, 1322-1327
2019251 CIF
Paper
C16 H20 Na2 O12 SP 18.098; 8.382; 15.291
75.492; 87.242; 86.712
1002.6Huang, Qiu-Ying; Liu, Chun-Li; Zhou, Zi-Peng
Two sodium(I) coordination polymers constructed by the V-shaped ligands 2,2'-[isopropylidenebis(1,4-phenyleneoxy)]diacetic acid and 2,2'-[sulfonylbis(1,4-phenyleneoxy)]diacetic acid
Acta Crystallographica Section C, 2013, 69, 1322-1327
2019252 CIF
Paper
C31 H27 Cl5 N4 O6 Zn2P -19.3167; 10.1345; 19.4988
88.344; 88.179; 67.092
1694.75Kim, Young-Inn; Lee, Jin Young; Song, Young-Kwang; Kang, Sung Kwon
Different Zn^II^ cation coordination geometries in di-μ-acetato-bis{2-chloro-6-[(pyridine-2-ylmethylimino)methyl]phenol}dizinc(II) chloroform monosolvate
Acta Crystallographica Section C, 2013, 69, 1348-1350
2019253 CIF
Paper
C36 H33 Cl2 N O5P 1 21 111.4579; 9.83146; 13.8027
90; 95.6581; 90
1547.27Kawanami, Yuko; Tanaka, Hidekazu; Mizoguchi, Jun-ichi; Kanehisa, Nobuko; Fukuhara, Gaku; Nishijima, Masaki; Mori, Tadashi; Inoue, Yoshihisa
Absolute configuration determination of the <i>anti</i>-head-to-head photocyclodimer of anthracene-2-carboxylic acid through cocrystallization with <small>L</small>-prolinol
Acta Crystallographica Section C, 2013, 69, 1411-1413
2019254 CIF
Paper
C8 H14 N4 O3P 1 21/c 17.5434; 13.002; 10.513
90; 92.728; 90
1029.94Gerhardt, Valeska; Bolte, Michael
Three new pseudopolymorphs of 6-aminouracil
Acta Crystallographica Section C, 2013, 69, 1402-1407
2019255 CIF
Paper
C8 H14 N4 O3P 1 21/c 17.12; 21.882; 13.1561
90; 92.908; 90
2047.1Gerhardt, Valeska; Bolte, Michael
Three new pseudopolymorphs of 6-aminouracil
Acta Crystallographica Section C, 2013, 69, 1402-1407
2019256 CIF
Paper
C9 H14 N4 O3P 1 21/c 17.5767; 21.889; 7.1356
90; 117.312; 90
1051.5Gerhardt, Valeska; Bolte, Michael
Three new pseudopolymorphs of 6-aminouracil
Acta Crystallographica Section C, 2013, 69, 1402-1407
2019257 CIF
Paper
C15 H21 N6 Nd O18P 1 21 16.7298; 11.4266; 15.2522
90; 102.292; 90
1145.99Atria, Ana María; Garland, Maria Teresa; Baggio, Ricardo
A dense hydrogen-bonding network and an unusually large packing index in triaquatris(2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylato)neodymium(III) trihydrate
Acta Crystallographica Section C, 2013, 69, 1378-1382
2019258 CIF
Paper
C8 H6 N4 O3 ZnP 1 21/c 110.785; 10.1308; 8.91
90; 111.01; 90
908.8Ma, Wen-Juan; Li, Guo-Ting
The purine‒carboxylate-containing coordination polymer poly[[μ~4~-1-(2-carboxylatoethyl)-6-oxo-6,9-dihydro-1<i>H</i>-purin-9-ido]zinc(II)]
Acta Crystallographica Section C, 2013, 69, 1314-1316
2019259 CIF
Paper
C12 H9 Cd N3 O4P -17.744; 8.745; 8.812
84.933; 89.017; 88.148
594.1Cai, Hua; Guo, Ying; Li, Jian-Gang
A one-dimensional coordination polymer created <i>via in situ</i> ligand synthesis involving C—N bond formation
Acta Crystallographica Section C, 2013, 69, 1307-1310
2019260 CIF
Paper
C10 H22 Cu2 O18C 1 2/c 112.1571; 18.1138; 9.637
90; 113.405; 90
1947.56Cancino, Patricio; Spodine, Evgenia; Paredes-García, Verónica; Venegas-Yazigi, Diego; Vega, Andrés
The layered structure of poly[[hexaaqua(μ~4~-benzene-1,2,4,5-tetracarboxylato)dicopper(II)] tetrahydrate]
Acta Crystallographica Section C, 2013, 69, 1344-1347
2019261 CIF
Paper
C24 H27 Cl N2 O4 Sn2P 1 21/c 112.5649; 15.9508; 13.3525
90; 101.335; 90
2623.91Schwarzer, Anke; Paul, Lydia E. H.; Böhme, Uwe
Enantiotropic phase transition in a binuclear tin complex with an <i>O</i>,<i>N</i>,<i>O</i>'-tridentate ligand
Acta Crystallographica Section C, 2013, 69, 1336-1339
2019262 CIF
Paper
C24 H27 Cl N2 O4 Sn2P 1 21/c 113.2848; 15.7966; 25.7287
90; 109.176; 90
5099.7Schwarzer, Anke; Paul, Lydia E. H.; Böhme, Uwe
Enantiotropic phase transition in a binuclear tin complex with an <i>O</i>,<i>N</i>,<i>O</i>'-tridentate ligand
Acta Crystallographica Section C, 2013, 69, 1336-1339
2019263 CIF
Paper
C30 H26 Cd N2 O5C 1 2/c 118.537; 16.886; 8.3534
90; 101.26; 90
2564.4Wang, Jun-Feng; Guo, Wen-Jing; Deng, Fan-Zheng
A fivefold interpenetrating diamondoid framework constructed by flexible dipyridyl and dicarboxylate ligands
Acta Crystallographica Section C, 2013, 69, 1328-1331
2019264 CIF
Paper
C8 H12 N2 O2 SP 1 21/c 110.9122; 5.0428; 17.279
90; 93.284; 90
949.3Jacobs, Danielle L.; Chan, Benny C.; O'Connor, Abby R.
<i>N</i>-[2-(Pyridin-2-yl)ethyl]-derivatives of methane-, benzene- and toluenesulfonamide: prospective ligands for metal coordination
Acta Crystallographica Section C, 2013, 69, 1397-1401
2019265 CIF
Paper
C13 H14 N2 O2 SP 1 21/c 15.492; 9.4328; 24.569
90; 95.651; 90
1266.6Jacobs, Danielle L.; Chan, Benny C.; O'Connor, Abby R.
<i>N</i>-[2-(Pyridin-2-yl)ethyl]-derivatives of methane-, benzene- and toluenesulfonamide: prospective ligands for metal coordination
Acta Crystallographica Section C, 2013, 69, 1397-1401

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