Crystallography Open Database

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1501685 CIFC2 H8 Cl NP 1 21/m 18.2039; 5.99673; 4.5435
90; 93.8032; 90
223.032Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Triolo, Alessandro; Caminiti, Ruggero
Thermal and structural properties of ethylammonium chloride and its mixture with water.
The journal of physical chemistry. B, 2011, 115, 4887-4899
1501686 CIFC2 H8 Cl NP 1 21/m 18.20987; 5.99729; 4.54601
90; 93.8491; 90
223.327Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Triolo, Alessandro; Caminiti, Ruggero
Thermal and structural properties of ethylammonium chloride and its mixture with water.
The journal of physical chemistry. B, 2011, 115, 4887-4899
1501687 CIFC2 H8 Cl NP 1 21/m 18.21673; 5.99825; 4.54871
90; 93.8929; 90
223.67Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Triolo, Alessandro; Caminiti, Ruggero
Thermal and structural properties of ethylammonium chloride and its mixture with water.
The journal of physical chemistry. B, 2011, 115, 4887-4899
1501688 CIFC2 H8 Cl NP 1 21/m 18.22307; 5.99899; 4.55113
90; 93.9367; 90
223.978Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Triolo, Alessandro; Caminiti, Ruggero
Thermal and structural properties of ethylammonium chloride and its mixture with water.
The journal of physical chemistry. B, 2011, 115, 4887-4899
1501689 CIFC2 H8 Cl NP 1 21/m 18.22913; 5.99941; 4.55352
90; 93.9808; 90
224.265Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Triolo, Alessandro; Caminiti, Ruggero
Thermal and structural properties of ethylammonium chloride and its mixture with water.
The journal of physical chemistry. B, 2011, 115, 4887-4899
1501690 CIFC2 H8 Cl NP 1 21/m 18.23546; 5.99997; 4.55596
90; 94.0251; 90
224.566Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Triolo, Alessandro; Caminiti, Ruggero
Thermal and structural properties of ethylammonium chloride and its mixture with water.
The journal of physical chemistry. B, 2011, 115, 4887-4899
1501691 CIFC2 H8 Cl NP 1 21/m 18.24185; 6.00052; 4.55819
90; 94.071; 90
224.858Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Triolo, Alessandro; Caminiti, Ruggero
Thermal and structural properties of ethylammonium chloride and its mixture with water.
The journal of physical chemistry. B, 2011, 115, 4887-4899
1501692 CIFC2 H8 Cl NP 1 21/m 18.24909; 6.00107; 4.56111
90; 94.1234; 90
225.206Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Triolo, Alessandro; Caminiti, Ruggero
Thermal and structural properties of ethylammonium chloride and its mixture with water.
The journal of physical chemistry. B, 2011, 115, 4887-4899
1501693 CIFC2 H8 Cl NP 1 21/m 18.25578; 6.00157; 4.56351
90; 94.1741; 90
225.511Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Triolo, Alessandro; Caminiti, Ruggero
Thermal and structural properties of ethylammonium chloride and its mixture with water.
The journal of physical chemistry. B, 2011, 115, 4887-4899
1501694 CIFC2 H8 Cl NP 1 21/m 18.26299; 6.00194; 4.56608
90; 94.2299; 90
225.833Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Triolo, Alessandro; Caminiti, Ruggero
Thermal and structural properties of ethylammonium chloride and its mixture with water.
The journal of physical chemistry. B, 2011, 115, 4887-4899
1501695 CIFC2 H8 Cl NP 1 21/m 18.26972; 6.00243; 4.56867
90; 94.2836; 90
226.148Migliorati, Valentina; Ballirano, Paolo; Gontrani, Lorenzo; Triolo, Alessandro; Caminiti, Ruggero
Thermal and structural properties of ethylammonium chloride and its mixture with water.
The journal of physical chemistry. B, 2011, 115, 4887-4899
1502040 CIFC23 H19 I N2 O2P 1 21/m 111.998; 6.7769; 11.9999
90; 93.718; 90
973.65Chen, Jiun-Jia; Li, Kuan-Ting; Yang, Ding-Yah
Synthesis of coumarin/phenanthridine-fused heterocycles and their photochemical and thermochromic properties.
Organic letters, 2011, 13, 1658-1661
1502320 CIFC20 H12 Cl N O2P 1 21/m 18.265; 6.753; 14.254
90; 103.68; 90
773Fei, Na; Yin, Hao; Wang, Shaozhong; Wang, Huaqin; Yao, Zhu-Jun
CuCl2-promoted 6-endo-dig chlorocyclization and oxidative aromatization cascade: efficient construction of 1-azaanthraquinones from N-propargylaminoquinones.
Organic letters, 2011, 13, 4208-4211
1504158 CIFC34 H56 N12 O17P 1 21/m 110.4708; 19.8848; 10.7309
90; 116.395; 90
2001.36Stancl, Marek; Hodan, Martin; Sindelar, Vladimir
Glycoluril trimers: selective synthesis and supramolecular properties.
Organic letters, 2009, 11, 4184-4187
1504526 CIFC42 H30 Cl2 N3 O PP 1 21/m 18.6044; 15.398; 13.408
90; 106.679; 90
1701.7Matano, Yoshihiro; Nakashima, Makoto; Nakabuchi, Takashi; Imahori, Hiroshi; Fujishige, Shinya; Nakano, Haruyuki
Monophosphaporphyrins: oxidative pi-extension at the peripherally fused carbocycle of the phosphaporphyrin ring.
Organic letters, 2008, 10, 553-556
1505174 CIFC13 H16 N4 O4P 1 21/m 18.7478; 6.5361; 12.5842
90; 107.296; 90
686.98Childs, Scott L.; Stahly, G. Patrick; Park, Aeri
The Salt−Cocrystal Continuum: The Influence of Crystal Structure on Ionization State
Molecular Pharmaceutics, 2007, 4, 323
1505747 CIFC89 H8 Sc3P 1 21/m 118.1948; 11.14953; 11.13725
90; 107.733; 90
2151.99Nishibori, Eiji; Terauchi, Ikuya; Sakata, Makoto; Takata, Masaki; Ito, Yasuhiro; Sugai, Toshiki; Shinohara, Hisanori
High-resolution analysis of (Sc3C2)@ C80 metallofullerene by third generation synchrotron radiation X-ray powder diffraction.
The journal of physical chemistry. B, 2006, 110, 19215-19219
1505888 CIFC15 H9 N O6P 1 21/m 17.4374; 8.0243; 11.3999
90; 92.67; 90
679.61Deb, Indubhusan; Dadwal, Mamta; Mobin, Shaikh M.; Namboothiri, Irishi N. N.
Hydroxyalkylation of conjugated nitroalkenes with activated nonenolizable carbonyl compounds.
Organic letters, 2006, 8, 1201-1204
1506077 CIFC13 H15 N O4P 1 21/m 16.3417; 20.5313; 9.4744
90; 96.329; 90
1226.08Bogdan, Niculina; Grosu, Ion; Benoît, Guillaume; Toupet, Loïc; Ramondenc, Yvan; Condamine, Eric; Silaghi-Dumitrescu, Ioan; Plé, Gérard
Molecular rotors: design, synthesis, structural analysis, and silver complex of new [7.7]cyclophanes.
Organic letters, 2006, 8, 2619-2622
1506343 CIFC3 H1.5 Cl1.5 O1.5P 1 21/m 17.88; 6.795; 8.835
90; 115.02; 90
428.67Gong, Huijuan; You, Zhen; Xian, Qiming; Shen, Xing; Zou, Huixian; Huan, Fei; Xu, X.
Study on the Structure and Mutagenicity of a New Disinfection Byproduct in Chlorinated Drinking Water
Environmental Science & Technology, 2005, 39, 7499
1506535 CIFC18 H14 I2 N4 O2P 1 21/m 14.517; 26.92; 8.586
90; 93.546; 90
1042Goroff, Nancy S.; Curtis, Sean M.; Webb, Jeffrey A.; Fowler, Frank W.; Lauher, Joseph W.
Designed cocrystals based on the pyridine-iodoalkyne halogen bond.
Organic letters, 2005, 7, 1891-1893
1508699 CIFC15 H23 N O3P 1 21/m 18.025; 9.9052; 8.9614
90; 92.41; 90
711.7Paletta, Joseph T.; Pink, Maren; Foley, Bridget; Rajca, Suchada; Rajca, Andrzej
Synthesis and reduction kinetics of sterically shielded pyrrolidine nitroxides.
Organic letters, 2012, 14, 5322-5325
1509109 CIFAg0.4 Bi0.39 Cu4.93 Pb0.61 Se4P 1 21/m 19.5341; 4.1004; 10.2545
90; 100.066; 90
394.715Cooper, M.A.; Hawthorne, F.C.; Criddle, A.J.; Tischendorf, G.; Laflamme, J.H.G.; Stanley, C.J.; Foerster, H.J.; Roberts, A.C.
Schlemaite, (Cu, vac)6 (Pb, Bi) Se4, a new mineral species from Niederschlema-Alberoda, Erzgebirge, Germany: description and crystal structure
Canadian Mineralogist, 2003, 41, 1433-1444
1509147 CIFAg Bi2 Cl Se3P 1 21/m 17.9738; 4.1067; 11.135
90; 104.17; 90
353.533Ruck, M.
Synthese und Kristallstrukturen der quaternaeren Chalkogenidchloride Ag Bi2 S3 Cl und Ag Bi2 Se3 Cl
Zeitschrift fuer Anorganische und Allgemeine Chemie, 2002, 628, 1537-1540
1509246 CIFAg Bi2 Cl S3P 1 21/m 17.765; 3.999; 10.829
90; 103.18; 90
327.407Ruck, M.
Synthese und Kristallstrukturen der quaternaeren Chalkogenidchloride Ag Bi2 S3 Cl und Ag Bi2 Se3 Cl
Zeitschrift fuer Anorganische und Allgemeine Chemie, 2002, 628, 1537-1540
1509249 CIFC12 H28 Cl K O8P 1 21/m 19.782; 14.983; 12.1152
90; 92.886; 90
1773.4Jentzsch, Andreas Vargas; Emery, Daniel; Mareda, Jiri; Nayak, Susanta K; Metrangolo, Pierangelo; Resnati, Giuseppe; Sakai, Naomi; Matile, Stefan
Transmembrane anion transport mediated by halogen-bond donors.
Nature Communications, 2012, 3, 905
1509288 CIFAg Cs5 O9 Si3P 1 21/m 19.682; 6.527; 11.626
90; 93.84; 90
733.049Amann, P.; Moeller, A.
Neue Cyclosilicate der Alkalielemente: Cs5 Ag Si3 O9 und Cs6 Na6 Si6 O18
Zeitschrift fuer Anorganische und Allgemeine Chemie, 2001, 627, 172-179
1509464 CIFAg Mn6 O24 P7P 1 21/m 15.424; 26.97; 6.627
90; 106.81; 90
928.008ElMaadi, A.; Bennazha, J.; Holt, E.M.; Boukhari, A.
Identification of a new family of phosphate compounds, A(I) B(II)6 (P2 O7)2 P3 O10: structures of K Mn6 (P2 O7)2 P3 O10 and Ag Mn6 (P2 O7)2 P3 O10
Solid State Sciences, 2001, 3, 587-592
1509584 CIFAg1.2 O8 V3P 1 21/m 17.382; 3.6029; 12.193
90; 107.39; 90
309.47Rozier, P.; Galy, J.
Ag1.2 V3 O8 crystal structure: relationship with Ag2 V4 O11-y and interpretation of physical properties
Journal of Solid State Chemistry, 1997, 134, 294-301
1509926 CIFAg3 Bi14 Br21P 1 21/m 112.7778; 14.6687; 13.4262
90; 108.48; 90
2386.76Wahl, B.; Ruck, M.
Ag3 Bi14 Br21: a subbromide with Bi2(4+) dumbbells and Bi9(5+) polyhedra - synthesis, crystal structure and chemical bonding
Zeitschrift fuer Anorganische und Allgemeine Chemie, 2008, 634, 2873-2879
1509978 CIFAg8 Ba S5P 1 21/m 17.672; 17.66599; 8.937
90; 107.89; 90
1152.7Chong Zheng; Dabrowski, B.; Check, C.E.; Zhang Jianhua
Synthesis and structure of a new ternary silver-rich sulfide Ba Ag8 S5
Journal of Solid State Chemistry, 1999, 144, 409-415
1510031 CIFAg3 P7 SnP 1 21/m 16.36; 11.071; 6.518
90; 108.17; 90
436.058Shevel'kov, A.V.; Popovkin, B.A.; Shatruk, M.M.; Kovnir, K.A.
Ag3 Sn P7: A polyphosphide with a unique infinite(P7) chain and a novel Ag3 Sn heterocluster
Angew. Chem. Int. ed., 2000, 39, 2508-2509
1510098 CIFAu Co Na4 O5P 1 21/m 15.5569; 10.4211; 5.5569
90; 117.387; 90
285.728Hoppe, R.; Mader, K.
Neuartige Maeander mit Co3+ und Au3+: Na4(AuCoO5) = Na8((O2/2(CoO)O2AuO2/2)2)
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1992, 612, 89-96
1510308 CIFAu SrP 1 21/m 140.13; 4.697; 6.192
90; 94.21; 90
1163.98Fornasini, M.L.
New alkaline earth equiatomic phases: Sr Au and Ba Au
Journal of Solid State Chemistry, 1985, 59, 60-64
1510667 CIFB2 Ba2 Cl Ho O6P 1 21/m 16.432; 5.312; 11.286
90; 96.03; 90
383.473Khamaganova, T.N.; Nevskii, N.N.; Trunov, V.K.
Crystal structures of Ba2 TR (B O3)2 Cl (TR= Ho, Yb)
Kristallografiya, 1989, 34, 1422-1425
1510677 CIFB2 Ba2 Cl O6 YbP 1 21/m 16.397; 5.279; 11.222
90; 96.17; 90
376.769Trunov, V.K.; Nevskii, N.N.; Khamaganova, T.N.
Crystal structures of Ba2 TR (B O3)2 Cl (TR= Ho, Yb)
Kristallografiya, 1989, 34, 1422-1425
1510906 CIFB3 Er MoP 1 21/m 16.79; 3.1513; 5.396
90; 101.6; 90
113.102Kuz'ma, Yu.B.; Aksel'rud, L.G.; Chaban, N.F.
Crystal structure of Er Mo B3
Kristallografiya, 1989, 34, 1419-1421
1510928 CIFB3 Li2 O13 Yb5P 1 21/m 110.095; 3.519; 15.647
90; 105.45; 90
535.762Chaminade, J.P.; Fouassier, C.; Jubera, V.; Gravereau, P.
A new oxyborate in the ternary phase diagrams Li2 O-Ln2 O3-B2 O3: Li2 Ln5 O4 (B O3)3 (Ln = Yb, Lu): Crystal structure of the ytterbium phase
Journal of Solid State Chemistry, 2001, 156, 161-167
1511027 CIFB Ce O3P 1 21/m 16.3022; 5.0593; 4.1311
90; 107.528; 90
125.603Montardi, Y.; Jobic, S.; Goubin, F.; Rocquefelte, X.; Deniard, P.; Brec, R.
Optical properties of Ce B O3 and Ce B3 O6 compounds: first- principles calculations and experimental results
Journal of Solid State Chemistry, 2004, 177, 89-100
1511186 CIFB I N2 Sr2P 1 21/m 110.284; 4.224; 13.246
90; 90.87; 90
575.335Rohrer, F.E.; Nesper, R.
Sr2 B N2 I: a strontium iodide compound with isolated B N2(3-) units
Journal of Solid State Chemistry, 1999, 142, 187-191
1511323 CIFB S3 Tl3P 1 21/m 15.444; 9.699; 6.69
90; 98.13; 90
349.691Hamann, W.; Krebs, B.
Ortho-Thioborates and Ortho-Selenoborates: Synthesis, Structure and Properties of Tl3 B S3 and Tl3 B Se3
Journal of the Less-Common Metals, 1988, 137, 143-154
1511327 CIFB Se3 Tl3P 1 21/m 15.547; 10.099; 6.852
90; 97.59; 90
380.48Hamann, W.; Krebs, B.
Ortho-thioborates and ortho-selenoborates: synthesis, structure and properties of Tl3 B S3 and Tl3 B Se3
Journal of the Less-Common Metals, 1988, 137, 143-154
1511784 CIFC8 H8 B F2 Li N2 O4P 1 21/m 16.1948; 15.6492; 6.2164
90; 113.897; 90
550.98Han, Sang-Don; Allen, Joshua L.; Jónsson, Erlendur; Johansson, Patrik; McOwen, Dennis W.; Boyle, Paul D.; Henderson, Wesley A.
Solvate Structures and Computational/Spectroscopic Characterization of Lithium Difluoro(oxalato)borate (LiDFOB) Electrolytes
The Journal of Physical Chemistry C, 2013, 117, 5521
1511791 CIFC6 H6 B F2 Li O7P 1 21/m 16.443; 6.2831; 12.1294
90; 97.91; 90
486.35Han, Sang-Don; Allen, Joshua L.; Jónsson, Erlendur; Johansson, Patrik; McOwen, Dennis W.; Boyle, Paul D.; Henderson, Wesley A.
Solvate Structures and Computational/Spectroscopic Characterization of Lithium Difluoro(oxalato)borate (LiDFOB) Electrolytes
The Journal of Physical Chemistry C, 2013, 117, 5521
1511921 CIFC19 H19 F3 N2 O3 SP 1 21/m 19.4896; 9.4513; 10.805
90; 108.172; 90
920.8Senczyszyn, Jemma; Brice, Heloise; Clayden, Jonathan
Spirocyclic dihydropyridines by electrophile-induced dearomatizing cyclization of N-alkenyl pyridinecarboxamides.
Organic letters, 2013, 15, 1922-1925
1512133 CIFC17 H18 F3 N O2P 1 21/m 112.365; 7.358; 16.939
90; 95.378; 90
1534.4Liu, Xiaogang; Cole, Jacqueline M.; Waddell, Paul G.; Lin, Tze-Chia; McKechnie, Scott
Molecular Origins of Optoelectronic Properties in Coumarins 343, 314T, 445, and 522B
The Journal of Physical Chemistry C, 2013, 117, 14130
1512155 CIFC17 H16 O5P 1 21/m 19.9253; 6.9102; 10.7273
90; 110.711; 90
688.19Seephonkai, Prapairat; Pyne, Stephen G.; Willis, Anthony C.; Lie, Wilford
Bioactive Compounds from the Roots of Strophioblachia fimbricalyx.
Journal of natural products, 2013, 76, 1358-1364
1512335 CIFC13 H9 Br F3 NP 1 21/m 17.731; 7.195; 10.886
90; 104.56; 90
586.1Wang, Yong; Chen, Chao; Zhang, Shu; Lou, Zhenbang; Su, Xiang; Wen, Lirong; Li, Ming
A Concise Construction of Polycyclic Quinolines via Annulation of ω-Cyano-1-alkynes with Diaryliodonium Salts
Organic Letters, 2013, 15, 4794
1512474 CIFC30 H24 Cu3 Mo5 N12 O30 P2P 1 21/m 19.985; 23.899; 10.574
90; 103.997; 90
2448.4Xiang Wang; Dandan Wang; Mingguan Liu; Cuili Meng; Aixiang Tian; Kundawlet Alimaje; Zhenyu Shi
Two polyoxomolybdate-tuned hybrids composed of tripodal star-like ligand copper complexes
Inorganica Chimica Acta, 2012, 392, 160-164
1512977 CIFC32 H29 N3 O9 Zn2P 1 21/m 18.458; 21.6474; 9.4309
90; 109.884; 90
1623.8De-Yun Ma; Kuan Lu; Liang Qin; Hai-Fu Guo; Xiong-Yi Peng; Jian-Qiang Liu
Syntheses, crystal structures, substituents steric effect, luminescent and moisture-stability studies of three two-dimensional zinc-organic frameworks
Inorganica Chimica Acta, 2013, 396, 84-91

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