Crystallography Open Database

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1550102 CIFC31 H34 N2 O7P 1 21/c 110.843; 17.862; 13.913
90; 91.715; 90		2693.4Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550103 CIFC31 H34 N2 O7P 1 21 111.4733; 17.6286; 13.653
90; 93.29; 90		2756.88Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550104 CIFC31 H34 N2 O5.9P 1 21/c 111.197; 17.627; 13.199
90; 96.347; 90		2589.1Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550105 CIFC31 H34.42 N2 O6.42P 1 21/c 111.282; 17.856; 13.46
90; 96.06; 90		2696.4Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550106 CIFC62 H67.84 N4 O11.72P 1 21 111.346; 17.508; 13.4
90; 98.15; 90		2635Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550107 CIFC31 H34 N2 O6.51P 1 21/c 111.253; 17.66; 13.247
90; 95.787; 90		2619.1Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550108 CIFC31 H34.55 N2 O6.14P 1 21/c 111.176; 17.608; 13.305
90; 95.426; 90		2606.5Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550109 CIFC31 H34 N2 O6.47P 1 21/c 111.487; 17.514; 13.31
90; 95.95; 90		2663Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550110 CIFC31 H34 N2 O7P 1 21/c 111.195; 17.69; 13.449
90; 94.4; 90		2656Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550111 CIFC31 H33 N2 O7P 1 21/c 111.475; 17.669; 13.248
90; 94.87; 90		2676Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550112 CIFC31 H34.12 N2 O6.33P 1 21/c 111.296; 17.807; 13.459
90; 95.99; 90		2692.5Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550113 CIFC31 H34 N2 O6.17P 1 21/c 111.199; 17.71; 13.4
90; 94.85; 90		2648Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550114 CIFC31 H34 N2 O6.27P 1 21/c 111.369; 17.66; 13.539
90; 95.632; 90		2705.2Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550115 CIFC31 H34 N2 O6.46P 1 21/c 111.102; 17.701; 13.437
90; 94.667; 90		2632Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550116 CIFC31 H34 N2 O6.4P 1 21/c 111.41; 17.772; 13.55
90; 95.891; 90		2733.1Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550117 CIFC31 H34 N2 O6.81P 1 21/c 111.405; 17.746; 13.511
90; 95.49; 90		2721.99Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550118 CIFC62 H68.91 N4 O13.03P 1 21 111.246; 17.607; 13.523
90; 94.19; 90		2671Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550119 CIFC31 H34 N2 O7P 1 21/c 111.319; 17.672; 13.391
90; 93.9; 90		2672.4Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550120 CIFC31.1 H33.33 N2 O6.35P 1 21/c 111.153; 17.701; 13.336
90; 95.232; 90		2621.8Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550121 CIFC31 H34 N2 O6.69P 1 21/c 111.404; 17.591; 13.269
90; 95.526; 90		2649Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550122 CIFC62 H67.8 N4 O12.63P 1 21 111.237; 17.571; 13.374
90; 94.584; 90		2632.2Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550123 CIFC31 H34 N2 O6.49P 1 21/c 111.279; 17.633; 13.377
90; 94.51; 90		2652Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550124 CIFC31 H34 N2 O8P 1 21/c 111.074; 17.895; 14
90; 92.859; 90		2770.9Dandela, Rambabu; Tothadi, Srinu; Marelli, Udaya Kiran; Nangia, Ashwini
Systematic synthesis of a 6-component organic-salt alloy of naftopidil, and pentanary, quaternary and ternary multicomponent crystals
IUCrJ, 2018, 5
1550146 CIF
Paper		C16 H14 O3P -16.0671; 7.5611; 13.8523
92.078; 93.838; 90.994		633.49Pawledzio, Sylwia; Makal, Anna; Trzybiński, Damian; Woźniak, Krzysztof
Crystal structure, interaction energies and experimental electron density of the popular drug ketoprophen
IUCrJ, 2018, 5
1550147 CIFC16 H14 O3P 21 21 216.113; 7.3809; 55.524
90; 90; 90		2505.2Pawledzio, Sylwia; Makal, Anna; Trzybiński, Damian; Woźniak, Krzysztof
Crystal structure, interaction energies and experimental electron density of the popular drug ketoprophen
IUCrJ, 2018, 5
1550148 CIFC16 H14 O3P 21 21 216.113; 7.3809; 55.524
90; 90; 90		2505.2Pawledzio, Sylwia; Makal, Anna; Trzybiński, Damian; Woźniak, Krzysztof
Crystal structure, interaction energies and experimental electron density of the popular drug ketoprophen
IUCrJ, 2018, 5
1550342 CIF
Paper		C15.5 H17 Cu N3.5 O5.75P 1 21/c 110.8431; 11.8835; 14.4823
90; 109.361; 90		1760.57Wang, Sujuan; Wei, Zhang-Wen; Zhang, Jianyong; Jiang, Long; Liu, Dingxin; Jiang, Ji-Jun; Si, Rui; Su, Cheng-Yong
Framework disorder and its effect on selective hysteretic sorption of a T-shaped azole-based metal‒organic framework
IUCrJ, 2019, 6
1550370 CIF
Paper		C4 H9 Co N O6P n m a8.2674; 11.66; 8.1483
90; 90; 90		785.48Canadillas-Delgado, Laura; Mazzuca, Lidia; Fabelo, Oscar; Rodriguez-Velamazan, J. Alberto; Rodriguez-Carvajal, Juan
Incommensurate structures of the [CH~3~NH~3~][Co(COOH)~3~] compound
IUCrJ, 2019, 6, 105-115
1550371 CIF
Paper		C4 H9 Co N O6P n m a8.2556; 11.6519; 8.1508
90; 90; 90		784.05Canadillas-Delgado, Laura; Mazzuca, Lidia; Fabelo, Oscar; Rodriguez-Velamazan, J. Alberto; Rodriguez-Carvajal, Juan
Incommensurate structures of the [CH~3~NH~3~][Co(COOH)~3~] compound
IUCrJ, 2019, 6, 105-115
1550372 CIF
Paper		C4 H9 Co N O6P n m a8.2702; 11.6766; 8.1631
90; 90; 90		788.29Canadillas-Delgado, Laura; Mazzuca, Lidia; Fabelo, Oscar; Rodriguez-Velamazan, J. Alberto; Rodriguez-Carvajal, Juan
Incommensurate structures of the [CH~3~NH~3~][Co(COOH)~3~] compound
IUCrJ, 2019, 6, 105-115
1550373 CIF
Paper		C4 H9 Co N O6P n m a8.2548; 11.6547; 8.1521
90; 90; 90		784.29Canadillas-Delgado, Laura; Mazzuca, Lidia; Fabelo, Oscar; Rodriguez-Velamazan, J. Alberto; Rodriguez-Carvajal, Juan
Incommensurate structures of the [CH~3~NH~3~][Co(COOH)~3~] compound
IUCrJ, 2019, 6, 105-115
1550383 CIFAl2 Eu4 F2 O8P 1 21/c 17.5885; 10.8399; 11.0776
90; 108.788; 90		862.67Morán-Ruiz, Aroa; Wain-Martin, Aritza; Orera, Alodia; Sanjuán, María Luisa; Larrañaga, Aitor; Slater, Peter R.; Arriortua, Maribel
Synthesis of new Ln~4~(Al~2~O~6~F~2~)O~2~ (Ln = Sm, Eu, Gd) phases with a cuspidine-related structure
IUCrJ, 2019, 6, 128-135
1550384 CIFAl2 F2 O8 Sm4P 1 21/c 17.6188; 10.8705; 11.1077
90; 108.805; 90		870.84Morán-Ruiz, Aroa; Wain-Martin, Aritza; Orera, Alodia; Sanjuán, María Luisa; Larrañaga, Aitor; Slater, Peter R.; Arriortua, Maribel
Synthesis of new Ln~4~(Al~2~O~6~F~2~)O~2~ (Ln = Sm, Eu, Gd) phases with a cuspidine-related structure
IUCrJ, 2019, 6, 128-135
1550439 CIFC16 H26P 1 21/n 114.3334; 5.56223; 8.53021
90; 92.0219; 90		679.65van de Streek, Jacco; Alig, Edith; Parsons, Simon; Vella-Zarb, Liana
A jumping crystal predicted with molecular dynamics and analysed with TLS refinement against powder diffraction data
IUCrJ, 2019, 6, 136-144
1550440 CIFC7 H15 Cl N2 OP 1 21 17.2588; 8.9399; 22.7927
90; 95.818; 90		1471.47Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550441 CIFC7 H15 I N2 OP b c a13.4725; 9.8551; 32.7259
90; 90; 90		4345.11Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550442 CIFC7 H15 Cl N2 OP 1 21 17.2902; 8.9099; 7.8789
90; 107.024; 90		489.35Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550443 CIFC7 H15 Br N2 OP 1 21 17.5269; 9.1017; 7.93
90; 107.161; 90		519.08Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550444 CIFC7 H15 I N2 OP 21 21 217.585; 10.8242; 13.0468
90; 90; 90		1071.16Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550445 CIFC14 H30 B Cl F4 N4 O2P 21 21 219.4006; 13.2619; 16.6581
90; 90; 90		2076.76Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550446 CIFC22 H27 Br N2 O4 SP 21 21 216.106; 9.0317; 42.33
90; 90; 90		2334.4Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550447 CIFC22 H27 I N2 O4 SP 21 21 216.2219; 9.0228; 43.0569
90; 90; 90		2417.17Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550448 CIFC22 H27 N3 O7 SP 21 21 216.3765; 8.8174; 42.942
90; 90; 90		2414.38Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550449 CIFC22 H32 N2 O9.5 P SP 18.7929; 12.6645; 23.7867
82.3345; 81.4117; 89.9824		2595.2Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550450 CIFC15 H24 N2 O5P 1 21 111.47377; 6.14747; 11.71348
90; 111.978; 90		766.164Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550451 CIFC19 H23 Cl N6 O4P 1 21/c 112.6065; 13.0726; 12.6694
90; 106.397; 90		2003Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550452 CIFC20 H23 Cl N6 O SP -112.1482; 13.1848; 13.8251
90.263; 90.218; 108.005		2105.9Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550453 CIFC19 H23 B Cl F4 N5 OP 1 21/c 112.46473; 12.98315; 13.42014
90; 106.765; 90		2079.49Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550454 CIFC16 H21 N O4 SP 1 21 15.72587; 20.83882; 6.92054
90; 98.3547; 90		816.998Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550455 CIFC24 H38 N2 O8P 15.8213; 7.27088; 15.90214
94.7215; 96.6693; 109.525		624.781Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151

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