Crystallography Open Database

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4509820 CIFC51 H60 Cl2 N6 O11 Pt2 S2P -111.6084; 14.2276; 18.0294
68.226; 82.602; 88.334		2741.7Tzeng, Biing-Chiau; Chiu, Tse-Hao; Lin, Sun-Yi; Yang, Chieh-Min; Chang, Tsung-Yi; Huang, Cyong-Huei; Chang, A. Hsiu-Hua; Lee, Gene-Hsiang
Structural Isomerism of Luminescent Dinuclear Pt(II)-Thiolate Diimines
Crystal Growth & Design, 2009, 9, 5356
4509821 CIFC47 H56 Cl2 N6 O10 Pt2 S2P 1 21/c 114.0251; 12.3473; 34.0632
90; 113.738; 90		5399.7Tzeng, Biing-Chiau; Chiu, Tse-Hao; Lin, Sun-Yi; Yang, Chieh-Min; Chang, Tsung-Yi; Huang, Cyong-Huei; Chang, A. Hsiu-Hua; Lee, Gene-Hsiang
Structural Isomerism of Luminescent Dinuclear Pt(II)-Thiolate Diimines
Crystal Growth & Design, 2009, 9, 5356
4509822 CIFC12 H10 F6 I N PP 1 21/n 17.264; 13.546; 14.967
90; 102.254; 90		1439.2García, Marcos D.; Blanco, Víctor; Platas-Iglesias, Carlos; Peinador, Carlos; Quintela, José M.
Interplay between Halogen/Hydrogen Bonding and Electrostatic Interactions in 1,1′-Bis(4-iodobenzyl)-4,4′-bipyridine-1,1′-diium Salts
Crystal Growth & Design, 2009, 9, 5009
4509823 CIFC24 H24 Br2 I2 N2 O2P 1 21/c 18.8044; 18.017; 8.9314
90; 117.005; 90		1262.3García, Marcos D.; Blanco, Víctor; Platas-Iglesias, Carlos; Peinador, Carlos; Quintela, José M.
Interplay between Halogen/Hydrogen Bonding and Electrostatic Interactions in 1,1′-Bis(4-iodobenzyl)-4,4′-bipyridine-1,1′-diium Salts
Crystal Growth & Design, 2009, 9, 5009
4509824 CIFC24 H24 Cl2 I2 N2 O2P 1 21/c 19.0698; 17.7322; 8.5588
90; 116.193; 90		1235.14García, Marcos D.; Blanco, Víctor; Platas-Iglesias, Carlos; Peinador, Carlos; Quintela, José M.
Interplay between Halogen/Hydrogen Bonding and Electrostatic Interactions in 1,1′-Bis(4-iodobenzyl)-4,4′-bipyridine-1,1′-diium Salts
Crystal Growth & Design, 2009, 9, 5009
4509825 CIFC22.15 H18.46 I3.69 N1.85P b c a12.8509; 13.0624; 45.1287
90; 90; 90		7575.5García, Marcos D.; Blanco, Víctor; Platas-Iglesias, Carlos; Peinador, Carlos; Quintela, José M.
Interplay between Halogen/Hydrogen Bonding and Electrostatic Interactions in 1,1′-Bis(4-iodobenzyl)-4,4′-bipyridine-1,1′-diium Salts
Crystal Growth & Design, 2009, 9, 5009
4509826 CIFC21 H24 O8C 1 2/c 127.851; 4.6754; 16.764
90; 110.908; 90		2039.2Kohmoto, Shigeo; Kuroda, Yu; Kishikawa, Keiki; Masu, Hyuma; Azumaya, Isao
Generation of Square-Shaped Cyclic Dimers vs Zigzag Hydrogen-Bonding Networks and Pseudoconformational Polymorphism of Tethered Benzoic Acids
Crystal Growth & Design, 2009, 9, 5017
4509827 CIFC23 H32 O10P 1 2/c 118.241; 4.4906; 15.404
90; 113.219; 90		1159.6Kohmoto, Shigeo; Kuroda, Yu; Kishikawa, Keiki; Masu, Hyuma; Azumaya, Isao
Generation of Square-Shaped Cyclic Dimers vs Zigzag Hydrogen-Bonding Networks and Pseudoconformational Polymorphism of Tethered Benzoic Acids
Crystal Growth & Design, 2009, 9, 5017
4509828 CIFC24 H27 O8P -15.4919; 12.5958; 17.2079
71.111; 86.297; 85.83		1122.2Kohmoto, Shigeo; Kuroda, Yu; Kishikawa, Keiki; Masu, Hyuma; Azumaya, Isao
Generation of Square-Shaped Cyclic Dimers vs Zigzag Hydrogen-Bonding Networks and Pseudoconformational Polymorphism of Tethered Benzoic Acids
Crystal Growth & Design, 2009, 9, 5017
4509829 CIFC24.5 H26.5 N O8P -15.2438; 12.4009; 17.4032
79.855; 89.499; 89.383		1113.9Kohmoto, Shigeo; Kuroda, Yu; Kishikawa, Keiki; Masu, Hyuma; Azumaya, Isao
Generation of Square-Shaped Cyclic Dimers vs Zigzag Hydrogen-Bonding Networks and Pseudoconformational Polymorphism of Tethered Benzoic Acids
Crystal Growth & Design, 2009, 9, 5017
4509830 CIFC33 H32 O8P -110.016; 11.027; 14.051
79.032; 75.086; 67.286		1376.1Kohmoto, Shigeo; Kuroda, Yu; Kishikawa, Keiki; Masu, Hyuma; Azumaya, Isao
Generation of Square-Shaped Cyclic Dimers vs Zigzag Hydrogen-Bonding Networks and Pseudoconformational Polymorphism of Tethered Benzoic Acids
Crystal Growth & Design, 2009, 9, 5017
4509831 CIFC14 H8 N2 O4P 1 c 113.053; 6.321; 7.45
90; 98.47; 90		608Perman, Jason A.; Dubois, Kevin; Nouar, Farid; Zoccali, Sandra; Wojtas, Łukasz; Eddaoudi, Mohamed; Larsen, Randy W.; Zaworotko, Michael J.
Cocrystal Controlled Solid-State Synthesis of a Thermally Stable Nicotinate Analogue That Sustains an Isostructural Series of Porous Metal−Organic Materials
Crystal Growth & Design, 2009, 9, 5021
4509832 CIFC16.7 H11.05 Cd0.5 N2.65 O5.4P 1 21/c 18.393; 22.2351; 18.7421
90; 94.031; 90		3489Perman, Jason A.; Dubois, Kevin; Nouar, Farid; Zoccali, Sandra; Wojtas, Łukasz; Eddaoudi, Mohamed; Larsen, Randy W.; Zaworotko, Michael J.
Cocrystal Controlled Solid-State Synthesis of a Thermally Stable Nicotinate Analogue That Sustains an Isostructural Series of Porous Metal−Organic Materials
Crystal Growth & Design, 2009, 9, 5021
4511025 CIFC54 H48 N6 O12P b c a19.27; 19.906; 25.249
90; 90; 90		9685Weyna, David R.; Shattock, Tanise; Vishweshwar, Peddy; Zaworotko, Michael J.
Synthesis and Structural Characterization of Cocrystals and Pharmaceutical Cocrystals: Mechanochemistry vs Slow Evaporation from Solution
Crystal Growth & Design, 2009, 9, 1106
4511026 CIFC46 H52 N2 O4P 1 21/c 112.595; 16.2095; 19.9048
90; 93.535; 90		4056Cagulada, Amy M.; Lynch, Daniel E.; Hamilton, Darren G.
Structure and Properties of Modular Components for Applications in Topological Supramolecular Chemistry
Crystal Growth & Design, 2009, 9, 825
4511027 CIFC40 H50 O8P 1 21/c 111.9426; 13.7136; 11.1573
90; 105.743; 90		1758.8Cagulada, Amy M.; Lynch, Daniel E.; Hamilton, Darren G.
Structure and Properties of Modular Components for Applications in Topological Supramolecular Chemistry
Crystal Growth & Design, 2009, 9, 825
4511028 CIFC27 H32 N2 O9P b c a9.2355; 22.702; 24.698
90; 90; 90		5178.3Du, Miao; Zhang, Zhi-Hui; Guo, Wei; Fu, Xiao-Juan
Multi-Component Hydrogen-Bonding Assembly of a Pharmaceutical Agent Pamoic Acid with Piperazine or 4,4′-Bipyridyl: A Channel Hydrated Salt with Multiple-Helical Motifs vs a Bimolecular Cocrystal
Crystal Growth & Design, 2009, 9, 1655
4511029 CIFC33 H24 N2 O6P 1 21/c 116.602; 8.503; 18.58
90; 101.21; 90		2572.8Du, Miao; Zhang, Zhi-Hui; Guo, Wei; Fu, Xiao-Juan
Multi-Component Hydrogen-Bonding Assembly of a Pharmaceutical Agent Pamoic Acid with Piperazine or 4,4′-Bipyridyl: A Channel Hydrated Salt with Multiple-Helical Motifs vs a Bimolecular Cocrystal
Crystal Growth & Design, 2009, 9, 1655
4511030 CIFC10 H18 Cl2 N2 PtP n a 2119.524; 7.5482; 7.9651
90; 90; 90		1173.8Gussenhoven, Emily M.; Jevric, Martyn; Olmstead, Marilyn M.; Fettinger, James C.; Mascal, Mark; Balch, Alan L.
Crystal Packing in Planar Platinum(II) and Palladium(II) Complexes. Hydrogen-Bond-Mediated Supramolecular Assembly of Ten Wedge-Shaped Molecules into a Cyclic Array
Crystal Growth & Design, 2009, 9, 1786
4511031 CIFC18 H48 Fe2 N6 O20 S2I 41 3 215.5863; 15.5863; 15.5863
90; 90; 90		3786.4Li, Cui-Rui; Li, Shi-Li; Zhang, Xian-Ming
D3-Symmetric Supramolecular Cation {(Me2NH2)6(SO4)}4+As a New Template for 3D Homochiral (10,3)-a Metal Oxalates
Crystal Growth & Design, 2009, 9, 1702
4511032 CIFC18 H48 Co2 N6 O20 S2I 41 3 215.4519; 15.4519; 15.4519
90; 90; 90		3689.3Li, Cui-Rui; Li, Shi-Li; Zhang, Xian-Ming
D3-Symmetric Supramolecular Cation {(Me2NH2)6(SO4)}4+As a New Template for 3D Homochiral (10,3)-a Metal Oxalates
Crystal Growth & Design, 2009, 9, 1702
4511033 CIFC18 H48 N6 Ni2 O20 S2I 41 3 215.3105; 15.3105; 15.3105
90; 90; 90		3589Li, Cui-Rui; Li, Shi-Li; Zhang, Xian-Ming
D3-Symmetric Supramolecular Cation {(Me2NH2)6(SO4)}4+As a New Template for 3D Homochiral (10,3)-a Metal Oxalates
Crystal Growth & Design, 2009, 9, 1702
4511034 CIFC17 H12 N5 O5 PbP -18.2899; 8.6388; 12.1
83.76; 88.29; 81.61		852.1Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.
A Series of Lead(II) Complexes with π−π Stackings: Structural Diversities by Varying the Ligands
Crystal Growth & Design, 2009, 9, 1894
4511035 CIFC19 H14 N4 O4 PbP 1 21/c 112.4199; 7.5024; 18.5981
90; 98.681; 90		1713.1Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.
A Series of Lead(II) Complexes with π−π Stackings: Structural Diversities by Varying the Ligands
Crystal Growth & Design, 2009, 9, 1894
4511036 CIFC58 H48 N12 O9 Pb2P -18.8647; 10.648; 27.091
100.12; 90.24; 91.79		2516Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.
A Series of Lead(II) Complexes with π−π Stackings: Structural Diversities by Varying the Ligands
Crystal Growth & Design, 2009, 9, 1894
4511037 CIFC104 H62 N16 O19 Pb4P -19.324; 13.562; 18.148
95.33; 90.47; 100.64		2244.9Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.
A Series of Lead(II) Complexes with π−π Stackings: Structural Diversities by Varying the Ligands
Crystal Growth & Design, 2009, 9, 1894
4511038 CIFC44 H30 N8 O11 Pb2P -17.1636; 9.2479; 15.909
104.98; 91.05; 103.37		987.1Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.
A Series of Lead(II) Complexes with π−π Stackings: Structural Diversities by Varying the Ligands
Crystal Growth & Design, 2009, 9, 1894
4511039 CIFC22 H14 N4 O5 PbP -17.274; 12.231; 12.714
113.17; 96.48; 92.11		1029.2Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.
A Series of Lead(II) Complexes with π−π Stackings: Structural Diversities by Varying the Ligands
Crystal Growth & Design, 2009, 9, 1894
4511040 CIFC44 H32 N10 O10 Pb2P 1 21/n 112.283; 10.59; 15.526
90; 95.14; 90		2011.5Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.
A Series of Lead(II) Complexes with π−π Stackings: Structural Diversities by Varying the Ligands
Crystal Growth & Design, 2009, 9, 1894
4511041 CIFC24 H18 N4 O4 PbP -18.5905; 9.984; 13.171
90.86; 98.33; 111.8		1034.9Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.
A Series of Lead(II) Complexes with π−π Stackings: Structural Diversities by Varying the Ligands
Crystal Growth & Design, 2009, 9, 1894
4511042 CIFC27 H22 N4 O4 PbP -19.1613; 10.42; 12.975
99.34; 90.76; 98.24		1208.7Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.
A Series of Lead(II) Complexes with π−π Stackings: Structural Diversities by Varying the Ligands
Crystal Growth & Design, 2009, 9, 1894
4511043 CIFC66 H40 N8 O8 Pb2P -110.06; 11.932; 12.059
93.42; 91.98; 112.88		1328.6Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.
A Series of Lead(II) Complexes with π−π Stackings: Structural Diversities by Varying the Ligands
Crystal Growth & Design, 2009, 9, 1894
4511044 CIFC54 H37 N8 O13 Pb2P -19.3797; 9.4191; 15.6963
101.071; 90.383; 114.053		1237.17Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.
A Series of Lead(II) Complexes with π−π Stackings: Structural Diversities by Varying the Ligands
Crystal Growth & Design, 2009, 9, 1894
4511045 CIFC27 H19 N4 O4.75 PbP -19.4663; 10.833; 13.159
94.19; 106.42; 105.72		1229.5Yang, Jin; Ma, Jian-Fang; Liu, Ying-Ying; Ma, Ji-Cheng; Batten, Stuart R.
A Series of Lead(II) Complexes with π−π Stackings: Structural Diversities by Varying the Ligands
Crystal Growth & Design, 2009, 9, 1894
4511046 CIFC13 H18 Cl N3 O3 SP 63/m19.69; 19.69; 7.6026
90; 90; 120		2552.6Comotti, Angiolina; Bracco, Silvia; Sozzani, Piero; Hawxwell, Samuel M.; Hu, Chunhua; Ward, Michael D.
Guest Molecules Confined in Amphipathic Crystals as Revealed by X-ray Diffraction and MAS NMR†
Crystal Growth & Design, 2009, 9, 2999
4511047 CIFC16 H14 Cu2 N6P 1 21/n 18.7996; 15.35; 12.1775
90; 94.833; 90		1639Hu, Mei-Hong; Shen, Gui-Lan; Zhang, Jing-Xiang; Yin, Ye-Gao; Li, Dan
New Copper Coordination Polymers Derived fromp- ando-BIMB via Different Reaction Approaches: Toward the Effects of Isomeric Ligands (BIMB = Bis-(imidazol-1-ylmethyl)benzene)
Crystal Growth & Design, 2009, 9, 4533
4511048 CIFC16 H14 Cu2 N6P b c a14.5596; 13.184; 17.4423
90; 90; 90		3348.1Hu, Mei-Hong; Shen, Gui-Lan; Zhang, Jing-Xiang; Yin, Ye-Gao; Li, Dan
New Copper Coordination Polymers Derived fromp- ando-BIMB via Different Reaction Approaches: Toward the Effects of Isomeric Ligands (BIMB = Bis-(imidazol-1-ylmethyl)benzene)
Crystal Growth & Design, 2009, 9, 4533
4511049 CIFC28 H30 Cu N14 OP -18.6729; 13.678; 14.1078
77.424; 76.202; 73.774		1539.9Hu, Mei-Hong; Shen, Gui-Lan; Zhang, Jing-Xiang; Yin, Ye-Gao; Li, Dan
New Copper Coordination Polymers Derived fromp- ando-BIMB via Different Reaction Approaches: Toward the Effects of Isomeric Ligands (BIMB = Bis-(imidazol-1-ylmethyl)benzene)
Crystal Growth & Design, 2009, 9, 4533
4511050 CIFC28 H28 Cu N14P 18.308; 9.3858; 9.4912
104.358; 90.672; 104.581		691.71Hu, Mei-Hong; Shen, Gui-Lan; Zhang, Jing-Xiang; Yin, Ye-Gao; Li, Dan
New Copper Coordination Polymers Derived fromp- ando-BIMB via Different Reaction Approaches: Toward the Effects of Isomeric Ligands (BIMB = Bis-(imidazol-1-ylmethyl)benzene)
Crystal Growth & Design, 2009, 9, 4533
4511051 CIFC24 H14 Cu3 N6P b c n6.8385; 15.397; 21.537
90; 90; 90		2267.7Liu, Can; Ding, You-Bang; Shi, Xu-Hua; Zhang, Dan; Hu, Mei-Hong; Yin, Ye-Gao; Li, Dan
Interpenetrating Metal−Organic Frameworks Assembled from Polypyridine Ligands and Cyanocuprate Catenations
Crystal Growth & Design, 2009, 9, 1275
4511052 CIFC46 H28 Cu7 N16P -17.1824; 11.5203; 14.1814
95.051; 99.992; 102.446		1118.8Liu, Can; Ding, You-Bang; Shi, Xu-Hua; Zhang, Dan; Hu, Mei-Hong; Yin, Ye-Gao; Li, Dan
Interpenetrating Metal−Organic Frameworks Assembled from Polypyridine Ligands and Cyanocuprate Catenations
Crystal Growth & Design, 2009, 9, 1275
4511053 CIFC74.67 H90.67 N2.67 O8R -3 :H53.599; 53.599; 11.0015
90; 90; 120		27371Jacobs, Tia; Lloyd, Gareth O.; Bredenkamp, Martin W.; Barbour, Leonard J.
Co-crystallization of Ionic and Neutral Supramolecular Motifs Derived from Identical Components
Crystal Growth & Design, 2009, 9, 1284
4511054 CIFC18 H15 N3 O11 S3P -18.434; 12.342; 12.702
109.453; 97.697; 102.72		1184.8Katagiri, Kosuke; Kato, Takako; Masu, Hyuma; Tominaga, Masahide; Azumaya, Isao
Pseudopolymorph and Infinite Hydrogen Bonding Network of Cyclic Oligomers ofm-Aminobenzenesulfonic Acid
Crystal Growth & Design, 2009, 9, 1519
4511055 CIFC19 H19 N3 O7 S3P 1 21/n 18.4301; 8.9689; 28.364
90; 91.137; 90		2144.1Katagiri, Kosuke; Kato, Takako; Masu, Hyuma; Tominaga, Masahide; Azumaya, Isao
Pseudopolymorph and Infinite Hydrogen Bonding Network of Cyclic Oligomers ofm-Aminobenzenesulfonic Acid
Crystal Growth & Design, 2009, 9, 1519
4511056 CIFC22 H21 N5 O6 S3P -19.949; 10.949; 11.94
81.215; 75.704; 77.805		1225Katagiri, Kosuke; Kato, Takako; Masu, Hyuma; Tominaga, Masahide; Azumaya, Isao
Pseudopolymorph and Infinite Hydrogen Bonding Network of Cyclic Oligomers ofm-Aminobenzenesulfonic Acid
Crystal Growth & Design, 2009, 9, 1519
4511057 CIFC24 H20 N4 O8 S4I 41/a :215.269; 15.269; 21.613
90; 90; 90		5039Katagiri, Kosuke; Kato, Takako; Masu, Hyuma; Tominaga, Masahide; Azumaya, Isao
Pseudopolymorph and Infinite Hydrogen Bonding Network of Cyclic Oligomers ofm-Aminobenzenesulfonic Acid
Crystal Growth & Design, 2009, 9, 1519
4511058 CIFC9 H14 Al Cl4 NP 1 21/c 18.707; 13.6795; 12.294
90; 93.903; 90		1460.9Mahjoor, Parisa; Latturner, Susan E.
Synthesis and Structural Characterization of [bpyr]4[V4O4Cl12] and [bpyr]4[Bi4Cl16] grown in Ionic Liquid [bpyr][AlCl4] (bpyr = 1-Butylpyridinium)
Crystal Growth & Design, 2009, 9, 1385
4511059 CIFC36 H56 Bi4 Cl16 N4P -110.9179; 11.249; 13.304
109.46; 94.883; 101.055		1492.3Mahjoor, Parisa; Latturner, Susan E.
Synthesis and Structural Characterization of [bpyr]4[V4O4Cl12] and [bpyr]4[Bi4Cl16] grown in Ionic Liquid [bpyr][AlCl4] (bpyr = 1-Butylpyridinium)
Crystal Growth & Design, 2009, 9, 1385
4511060 CIFC36 H56 Cl12 N4 O4 V4C 1 2/c 132.771; 9.4505; 17.5068
90; 106.474; 90		5199.3Mahjoor, Parisa; Latturner, Susan E.
Synthesis and Structural Characterization of [bpyr]4[V4O4Cl12] and [bpyr]4[Bi4Cl16] grown in Ionic Liquid [bpyr][AlCl4] (bpyr = 1-Butylpyridinium)
Crystal Growth & Design, 2009, 9, 1385
4511061 CIFC51 H45 Ag2 B2 F8 N S9C 1 2/c 140.507; 22.03; 22.3662
90; 116.686; 90		17833Huang, Guo; Tsang, Chun-Kwan; Xu, Zhengtao; Li, Kunhao; Zeller, Matthias; Hunter, Allen D.; Chui, Stephen Sin-Yin; Che, Chi-Ming
Flexible Thioether−Ag(I) Interactions for Assembling Large Organic Ligands into Crystalline Networks
Crystal Growth & Design, 2009, 9, 1444

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