Crystallography Open Database

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4512408 CIFC60 S16C 1 2/c 120.904; 21.12; 10.519
90; 111.243; 90
4328.5Ghiassi, Kamran B.; Chen, Susanne Y.; Wescott, Joseph; Balch, Alan L.; Olmstead, Marilyn M.
New Insights into the Structural Complexity of C60·2S8: Two Crystal Morphologies, Two Phase Changes, Four Polymorphs
Crystal Growth & Design, 2015, 15, 404
4512409 CIFC60 S16P -110.365; 14.694; 29
84.122; 84.602; 75.664
4245.9Ghiassi, Kamran B.; Chen, Susanne Y.; Wescott, Joseph; Balch, Alan L.; Olmstead, Marilyn M.
New Insights into the Structural Complexity of C60·2S8: Two Crystal Morphologies, Two Phase Changes, Four Polymorphs
Crystal Growth & Design, 2015, 15, 404
4512410 CIFC60 S16P 1 21/c 116.1733; 15.8931; 18.5781
90; 113.302; 90
4385.9Ghiassi, Kamran B.; Chen, Susanne Y.; Wescott, Joseph; Balch, Alan L.; Olmstead, Marilyn M.
New Insights into the Structural Complexity of C60·2S8: Two Crystal Morphologies, Two Phase Changes, Four Polymorphs
Crystal Growth & Design, 2015, 15, 404
4512411 CIFC60 S16P 1 c 116.1355; 15.7332; 18.3535
90; 113.283; 90
4279.8Ghiassi, Kamran B.; Chen, Susanne Y.; Wescott, Joseph; Balch, Alan L.; Olmstead, Marilyn M.
New Insights into the Structural Complexity of C60·2S8: Two Crystal Morphologies, Two Phase Changes, Four Polymorphs
Crystal Growth & Design, 2015, 15, 404
4512412 CIFC38 H32 Cl2 N4 O4P 1 21/c 14.7315; 45.263; 7.929
90; 106.911; 90
1624.7Surov, Artem O.; Simagina, Anna A.; Manin, Nikolay G.; Kuzmina, Lyudmila G.; Churakov, Andrei V.; Perlovich, German L.
Fenamate Cocrystals with 4,4′-Bipyridine: Structural and Thermodynamic Aspects
Crystal Growth & Design, 2015, 15, 228
4512413 CIFC38 H28 F6 N4 O4P -19.8384; 10.3962; 25.015
84.632; 81.353; 71.679
2398.4Surov, Artem O.; Simagina, Anna A.; Manin, Nikolay G.; Kuzmina, Lyudmila G.; Churakov, Andrei V.; Perlovich, German L.
Fenamate Cocrystals with 4,4′-Bipyridine: Structural and Thermodynamic Aspects
Crystal Growth & Design, 2015, 15, 228
4512414 CIFC40 H38 N4 O4P -17.3302; 8.6992; 13.6719
106.276; 99.368; 98.738
807.55Surov, Artem O.; Simagina, Anna A.; Manin, Nikolay G.; Kuzmina, Lyudmila G.; Churakov, Andrei V.; Perlovich, German L.
Fenamate Cocrystals with 4,4′-Bipyridine: Structural and Thermodynamic Aspects
Crystal Growth & Design, 2015, 15, 228
4512415 CIFC36 H30 N4 O4P -17.7606; 9.7575; 20.0638
98.293; 92.423; 104.594
1450.01Surov, Artem O.; Simagina, Anna A.; Manin, Nikolay G.; Kuzmina, Lyudmila G.; Churakov, Andrei V.; Perlovich, German L.
Fenamate Cocrystals with 4,4′-Bipyridine: Structural and Thermodynamic Aspects
Crystal Growth & Design, 2015, 15, 228
4512416 CIFC36 H26 F6 N6 O4C 1 2/c 126; 6.7394; 19.854
90; 111.386; 90
3239.4Surov, Artem O.; Simagina, Anna A.; Manin, Nikolay G.; Kuzmina, Lyudmila G.; Churakov, Andrei V.; Perlovich, German L.
Fenamate Cocrystals with 4,4′-Bipyridine: Structural and Thermodynamic Aspects
Crystal Growth & Design, 2015, 15, 228
4512417 CIFC56 H52 N10 O10P -17.59; 11.339; 15.138
76.868; 89.863; 75.754
1227.8Dey, Avishek; Bera, Saibal; Biradha, Kumar
Cocrystals and Salts of Pyridine-3,5-bis(1-methyl-benzimidazole-2-yl) with Pyromellitic Acid: Aromatic Guest Inclusion and Separation via Benzimidazole‒Carboxylic Acid Heterosynthon
Crystal Growth & Design, 2015, 15, 318
4512418 CIFC52 H44 N10 O10P -18.435; 10.432; 13.287
81.612; 75.381; 87.175
1119.1Dey, Avishek; Bera, Saibal; Biradha, Kumar
Cocrystals and Salts of Pyridine-3,5-bis(1-methyl-benzimidazole-2-yl) with Pyromellitic Acid: Aromatic Guest Inclusion and Separation via Benzimidazole‒Carboxylic Acid Heterosynthon
Crystal Growth & Design, 2015, 15, 318
4512419 CIFC78 H60 N10 O18P -110.741; 11.454; 14.658
96.553; 97.07; 111.233
1643.4Dey, Avishek; Bera, Saibal; Biradha, Kumar
Cocrystals and Salts of Pyridine-3,5-bis(1-methyl-benzimidazole-2-yl) with Pyromellitic Acid: Aromatic Guest Inclusion and Separation via Benzimidazole‒Carboxylic Acid Heterosynthon
Crystal Growth & Design, 2015, 15, 318
4512420 CIFC82 H62 N10 O18P -110.635; 11.379; 14.71
97.52; 97.062; 109.545
1636.4Dey, Avishek; Bera, Saibal; Biradha, Kumar
Cocrystals and Salts of Pyridine-3,5-bis(1-methyl-benzimidazole-2-yl) with Pyromellitic Acid: Aromatic Guest Inclusion and Separation via Benzimidazole‒Carboxylic Acid Heterosynthon
Crystal Growth & Design, 2015, 15, 318
4512421 CIFC76 H60 N10 O18P -110.651; 11.362; 14.732
96.914; 96.252; 110.223
1638.9Dey, Avishek; Bera, Saibal; Biradha, Kumar
Cocrystals and Salts of Pyridine-3,5-bis(1-methyl-benzimidazole-2-yl) with Pyromellitic Acid: Aromatic Guest Inclusion and Separation via Benzimidazole‒Carboxylic Acid Heterosynthon
Crystal Growth & Design, 2015, 15, 318
4512422 CIFC77 H59 N10 O19P -110.625; 11.428; 14.773
97.149; 96.088; 110.626
1643.9Dey, Avishek; Bera, Saibal; Biradha, Kumar
Cocrystals and Salts of Pyridine-3,5-bis(1-methyl-benzimidazole-2-yl) with Pyromellitic Acid: Aromatic Guest Inclusion and Separation via Benzimidazole‒Carboxylic Acid Heterosynthon
Crystal Growth & Design, 2015, 15, 318
4512425 CIFNi51.17 Sn103.63 Tb117F m -3 m29.862; 29.862; 29.862
90; 90; 90
26629Reyes, Luis E.; McDougald, Roy N.; McCandless, Gregory T.; Khan, Mojammel; Young, David P.; Chan, Julia Y.
Eutectoid Flux Growth and Physical Properties of Single Crystal Ln117Ni54‒ySn112‒z(Ln = Gd‒Dy)
Crystal Growth & Design, 2015, 15, 295
4512426 CIFDy117 Ni52.62 Sn112F m -3 m29.823; 29.823; 29.823
90; 90; 90
26525Reyes, Luis E.; McDougald, Roy N.; McCandless, Gregory T.; Khan, Mojammel; Young, David P.; Chan, Julia Y.
Eutectoid Flux Growth and Physical Properties of Single Crystal Ln117Ni54‒ySn112‒z(Ln = Gd‒Dy)
Crystal Growth & Design, 2015, 15, 295
4512427 CIFGd117 Ni52.96 Sn107.44F m -3 m30.07; 30.07; 30.07
90; 90; 90
27189Reyes, Luis E.; McDougald, Roy N.; McCandless, Gregory T.; Khan, Mojammel; Young, David P.; Chan, Julia Y.
Eutectoid Flux Growth and Physical Properties of Single Crystal Ln117Ni54‒ySn112‒z(Ln = Gd‒Dy)
Crystal Growth & Design, 2015, 15, 295
4512428 CIFC90 H100 B3 La N10 O22P -114.596; 18.269; 19.118
85.26; 74.4; 68.06
4554Danjo, Hiroshi; Nakagawa, Toshi; Katagiri, Kosuke; Kawahata, Masatoshi; Yoshigai, Seiki; Miyazawa, Toshifumi; Yamaguchi, Kentaro
Formation of Lanthanide(III)-Containing Metallosupramolecular Arrays Induced by Tris(spiroborate) Twin Bowl
Crystal Growth & Design, 2015, 15, 384
4512429 CIFC94.24 H109.89 B3 N11.41 O23.41 YbP -114.7773; 15.2028; 23.987
75.438; 77.575; 66.186
4732.2Danjo, Hiroshi; Nakagawa, Toshi; Katagiri, Kosuke; Kawahata, Masatoshi; Yoshigai, Seiki; Miyazawa, Toshifumi; Yamaguchi, Kentaro
Formation of Lanthanide(III)-Containing Metallosupramolecular Arrays Induced by Tris(spiroborate) Twin Bowl
Crystal Growth & Design, 2015, 15, 384
4512430 CIFC92.24 H105.21 B3 N10.74 O22.75 YP -114.7857; 15.1728; 23.9999
75.508; 77.676; 66.182
4730.3Danjo, Hiroshi; Nakagawa, Toshi; Katagiri, Kosuke; Kawahata, Masatoshi; Yoshigai, Seiki; Miyazawa, Toshifumi; Yamaguchi, Kentaro
Formation of Lanthanide(III)-Containing Metallosupramolecular Arrays Induced by Tris(spiroborate) Twin Bowl
Crystal Growth & Design, 2015, 15, 384
4512431 CIFC94.26 H109.95 B3 N11.42 O23.42 TbP -114.8384; 15.1755; 24.032
75.638; 77.766; 66.201
4758.3Danjo, Hiroshi; Nakagawa, Toshi; Katagiri, Kosuke; Kawahata, Masatoshi; Yoshigai, Seiki; Miyazawa, Toshifumi; Yamaguchi, Kentaro
Formation of Lanthanide(III)-Containing Metallosupramolecular Arrays Induced by Tris(spiroborate) Twin Bowl
Crystal Growth & Design, 2015, 15, 384
4512432 CIFC85.27 H88.53 B3 Eu N8.63 O20.63P 1 21/n 111.896; 28.247; 24.6
90; 99.322; 90
8157Danjo, Hiroshi; Nakagawa, Toshi; Katagiri, Kosuke; Kawahata, Masatoshi; Yoshigai, Seiki; Miyazawa, Toshifumi; Yamaguchi, Kentaro
Formation of Lanthanide(III)-Containing Metallosupramolecular Arrays Induced by Tris(spiroborate) Twin Bowl
Crystal Growth & Design, 2015, 15, 384
4512433 CIFC94.41 H110.29 B3 Er N11.47 O23.47P -114.8047; 15.1935; 24.0208
75.477; 77.533; 66.128
4742.9Danjo, Hiroshi; Nakagawa, Toshi; Katagiri, Kosuke; Kawahata, Masatoshi; Yoshigai, Seiki; Miyazawa, Toshifumi; Yamaguchi, Kentaro
Formation of Lanthanide(III)-Containing Metallosupramolecular Arrays Induced by Tris(spiroborate) Twin Bowl
Crystal Growth & Design, 2015, 15, 384
4512434 CIFC94 H96 B3 N10 O22 YP -115.042; 15.2159; 23.798
77.562; 76.708; 65.607
4783Danjo, Hiroshi; Nakagawa, Toshi; Katagiri, Kosuke; Kawahata, Masatoshi; Yoshigai, Seiki; Miyazawa, Toshifumi; Yamaguchi, Kentaro
Formation of Lanthanide(III)-Containing Metallosupramolecular Arrays Induced by Tris(spiroborate) Twin Bowl
Crystal Growth & Design, 2015, 15, 384
4512435 CIFC11 H16 N4 O3 SnP 1 21/c 111.563; 10.35; 12.463
90; 110.254; 90
1399.3Kundu, Subrata; Mohapatra, Balaram; Mohapatra, Chandrajeet; Verma, Sandeep; Chandrasekhar, Vadapalli
Polymeric, Molecular and Ionic Organotin Complexes Containing Hypoxanthine, Adenine and 2-Aminopurine. Synthesis and Supramolecular Structures
Crystal Growth & Design, 2015, 15, 247
4512436 CIFC40 H68 N8 O6 Sn2P -110.4055; 12.6484; 17.386
77.482; 89.515; 89.422
2233.7Kundu, Subrata; Mohapatra, Balaram; Mohapatra, Chandrajeet; Verma, Sandeep; Chandrasekhar, Vadapalli
Polymeric, Molecular and Ionic Organotin Complexes Containing Hypoxanthine, Adenine and 2-Aminopurine. Synthesis and Supramolecular Structures
Crystal Growth & Design, 2015, 15, 247
4512437 CIFC55 H64 N10 O11 Sn2P -19.6511; 14.2607; 22.0464
96.442; 100.312; 103.215
2868.8Kundu, Subrata; Mohapatra, Balaram; Mohapatra, Chandrajeet; Verma, Sandeep; Chandrasekhar, Vadapalli
Polymeric, Molecular and Ionic Organotin Complexes Containing Hypoxanthine, Adenine and 2-Aminopurine. Synthesis and Supramolecular Structures
Crystal Growth & Design, 2015, 15, 247
4512438 CIFC28 H32 Cl4 N10 O6 SnP n m a12.9349; 21.0223; 13.1337
90; 90; 90
3571.3Kundu, Subrata; Mohapatra, Balaram; Mohapatra, Chandrajeet; Verma, Sandeep; Chandrasekhar, Vadapalli
Polymeric, Molecular and Ionic Organotin Complexes Containing Hypoxanthine, Adenine and 2-Aminopurine. Synthesis and Supramolecular Structures
Crystal Growth & Design, 2015, 15, 247
4512439 CIFC30 H34 Cl4 N10 O4 SnP -17.073; 11.034; 12.475
114.821; 92.83; 99.652
863.3Kundu, Subrata; Mohapatra, Balaram; Mohapatra, Chandrajeet; Verma, Sandeep; Chandrasekhar, Vadapalli
Polymeric, Molecular and Ionic Organotin Complexes Containing Hypoxanthine, Adenine and 2-Aminopurine. Synthesis and Supramolecular Structures
Crystal Growth & Design, 2015, 15, 247
4512440 CIFC34 H20 S4P 1 21/c 113.601; 9.2479; 20.718
90; 92.771; 90
2602.9Mamada, Masashi; Katagiri, Hiroshi; Sakanoue, Tomo; Tokito, Shizuo
Characterization of New Rubrene Analogues with Heteroaryl Substituents
Crystal Growth & Design, 2015, 15, 442
4512441 CIFC34 H20 S4P 1 21/c 113.5656; 9.2311; 20.7014
90; 92.754; 90
2589.3Mamada, Masashi; Katagiri, Hiroshi; Sakanoue, Tomo; Tokito, Shizuo
Characterization of New Rubrene Analogues with Heteroaryl Substituents
Crystal Growth & Design, 2015, 15, 442
4512442 CIFC38 H28 S4P 21 21 219.599; 13.287; 25.015
90; 90; 90
3190Mamada, Masashi; Katagiri, Hiroshi; Sakanoue, Tomo; Tokito, Shizuo
Characterization of New Rubrene Analogues with Heteroaryl Substituents
Crystal Growth & Design, 2015, 15, 442
4512443 CIFC34 H20 O4P -110.553; 11.34; 16.568
83.481; 89.45; 64.275
1772.9Mamada, Masashi; Katagiri, Hiroshi; Sakanoue, Tomo; Tokito, Shizuo
Characterization of New Rubrene Analogues with Heteroaryl Substituents
Crystal Growth & Design, 2015, 15, 442
4512444 CIFC34 H20 O4P 1 21/c 114.386; 8.452; 21.794
90; 116.994; 90
2361.2Mamada, Masashi; Katagiri, Hiroshi; Sakanoue, Tomo; Tokito, Shizuo
Characterization of New Rubrene Analogues with Heteroaryl Substituents
Crystal Growth & Design, 2015, 15, 442
4512445 CIFC38 H28 O4P -18.5037; 13.244; 14.277
62.458; 80.781; 74.581
1373.1Mamada, Masashi; Katagiri, Hiroshi; Sakanoue, Tomo; Tokito, Shizuo
Characterization of New Rubrene Analogues with Heteroaryl Substituents
Crystal Growth & Design, 2015, 15, 442
4512446 CIFC33 H54.26 N5 O16.28P 1 21 18.338; 24.218; 34.991
90; 91.43; 90
7064Białońska, Agata; Ciunik, Zbigniew
Dielectrically Controlled Priority of Interactions in Molecular Recognition
Crystal Growth & Design, 2015, 15, 358
4512447 CIFC33.5 H41.25 N5 O14.62P 1 21 112.488; 9.092; 31.175
90; 97.39; 90
3510.2Białońska, Agata; Ciunik, Zbigniew
Dielectrically Controlled Priority of Interactions in Molecular Recognition
Crystal Growth & Design, 2015, 15, 358
4512448 CIFC56 H88.5 N7 O27.5P 1 21 120.962; 7.304; 21.824
90; 114.79; 90
3033.5Białońska, Agata; Ciunik, Zbigniew
Dielectrically Controlled Priority of Interactions in Molecular Recognition
Crystal Growth & Design, 2015, 15, 358
4512449 CIFC24 H46 N2 O8P -19.0851; 12.8719; 12.9349
100.258; 90.572; 93.606
1485.17Tang, Yuanyuan; Sun, Zhihua; Ji, Chengmin; Li, Lina; Zhang, Shuquan; Chen, Tianliang; Luo, Junhua
Hydrogen-Bonded Displacive-Type Ferroelastic Phase Transition in a New Entangled Supramolecular Compound
Crystal Growth & Design, 2015, 15, 457
4512450 CIFC12 H23 N O4C 1 2/c 116.6386; 19.8615; 9.0962
90; 92.422; 90
3003.3Tang, Yuanyuan; Sun, Zhihua; Ji, Chengmin; Li, Lina; Zhang, Shuquan; Chen, Tianliang; Luo, Junhua
Hydrogen-Bonded Displacive-Type Ferroelastic Phase Transition in a New Entangled Supramolecular Compound
Crystal Growth & Design, 2015, 15, 457
4512461 CIFC18 H61 La2 Mn N6 O53 V13P b c a23.711; 24.389; 25.303
90; 90; 90
14632.4Liu, Ding; Lu, Ying; Tan, Hua-Qiao; Wang, Ting-Ting; Wang, En-Bo
Series of Organic‒Inorganic Hybrid Rare Earth Derivatives Based on [MnV13O38]7‒Polyoxoanion: Syntheses, Structures, and Magnetic and Electrochemical Properties
Crystal Growth & Design, 2015, 15, 103
4512462 CIFC24 H53 La2 Mn N4 O62 V13P 1 21/n 113.0427; 22.8795; 22.2207
90; 97.357; 90
6576.3Liu, Ding; Lu, Ying; Tan, Hua-Qiao; Wang, Ting-Ting; Wang, En-Bo
Series of Organic‒Inorganic Hybrid Rare Earth Derivatives Based on [MnV13O38]7‒Polyoxoanion: Syntheses, Structures, and Magnetic and Electrochemical Properties
Crystal Growth & Design, 2015, 15, 103
4512463 CIFC24 H53 Ce2 Mn N4 O62 V13P 1 21/n 113.021; 22.787; 22.153
90; 97.44; 90
6518Liu, Ding; Lu, Ying; Tan, Hua-Qiao; Wang, Ting-Ting; Wang, En-Bo
Series of Organic‒Inorganic Hybrid Rare Earth Derivatives Based on [MnV13O38]7‒Polyoxoanion: Syntheses, Structures, and Magnetic and Electrochemical Properties
Crystal Growth & Design, 2015, 15, 103
4512464 CIFC7.5 H42.5 Ce2 Mn N2.5 O53 V13P -114.379; 22.686; 23.782
89.45; 80.52; 77.84
7478Liu, Ding; Lu, Ying; Tan, Hua-Qiao; Wang, Ting-Ting; Wang, En-Bo
Series of Organic‒Inorganic Hybrid Rare Earth Derivatives Based on [MnV13O38]7‒Polyoxoanion: Syntheses, Structures, and Magnetic and Electrochemical Properties
Crystal Growth & Design, 2015, 15, 103
4512465 CIFC3 H33 K2 Mn N Nd O51 V13P 1 21/n 112.619; 19.525; 21.983
90; 95.07; 90
5395Liu, Ding; Lu, Ying; Tan, Hua-Qiao; Wang, Ting-Ting; Wang, En-Bo
Series of Organic‒Inorganic Hybrid Rare Earth Derivatives Based on [MnV13O38]7‒Polyoxoanion: Syntheses, Structures, and Magnetic and Electrochemical Properties
Crystal Growth & Design, 2015, 15, 103
4512466 CIFC9 H41 Mn N1.5 O56.5 Pr1.5 V13P -112.959; 21.707; 21.853
86.36; 83.99; 86.79
6094Liu, Ding; Lu, Ying; Tan, Hua-Qiao; Wang, Ting-Ting; Wang, En-Bo
Series of Organic‒Inorganic Hybrid Rare Earth Derivatives Based on [MnV13O38]7‒Polyoxoanion: Syntheses, Structures, and Magnetic and Electrochemical Properties
Crystal Growth & Design, 2015, 15, 103
4512467 CIFC76 H76 Mn3 N26 O13 W2C 1 2/c 112.6227; 24.6013; 32.699
90; 99.702; 90
10008.9Yang, Fei-Lin; Yuan, Ai-Hua; Zhou, Hu; Zhou, Hong-Bo; Yang, Dan; Song, You; Li, Yi-Zhi
Syntheses, Structures, and Magnetic Properties of Three Manganese(II)-Octacyanotungstate(V) Bimetallic Compounds with Linear Ligands
Crystal Growth & Design, 2015, 15, 176
4512468 CIFC76 H68 Mn3 N40 O10 W2P -110.6761; 16.1012; 18.0131
103.521; 106.261; 108.668
2632.1Yang, Fei-Lin; Yuan, Ai-Hua; Zhou, Hu; Zhou, Hong-Bo; Yang, Dan; Song, You; Li, Yi-Zhi
Syntheses, Structures, and Magnetic Properties of Three Manganese(II)-Octacyanotungstate(V) Bimetallic Compounds with Linear Ligands
Crystal Growth & Design, 2015, 15, 176
4512469 CIFC100 H86 Mn3 N50 O8 W2P 1 21/c 113.6349; 34.8022; 12.2471
90; 102.085; 90
5682.8Yang, Fei-Lin; Yuan, Ai-Hua; Zhou, Hu; Zhou, Hong-Bo; Yang, Dan; Song, You; Li, Yi-Zhi
Syntheses, Structures, and Magnetic Properties of Three Manganese(II)-Octacyanotungstate(V) Bimetallic Compounds with Linear Ligands
Crystal Growth & Design, 2015, 15, 176

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