Crystallography Open Database

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7201848 CIFC17 H15 Cl3 Cu I N2 S3P -112.7209; 13.0515; 16.7648
68.655; 70.397; 68.19
2341.47Peng, Rong; Deng, Shi-Ren; Li, Mian; Li, Dan; Li, Zao-Ying
Solvent-dependent copper(i) conformational supramolecular pseudo-polymorphs based on a flexible thioether ligand
CrystEngComm, 2008, 10, 590
7201849 CIFC17 H16 Cl2 Cu I N2 S3P 1 21/n 19.252; 16.453; 14.991
90; 104.904; 90
2205.2Peng, Rong; Deng, Shi-Ren; Li, Mian; Li, Dan; Li, Zao-Ying
Solvent-dependent copper(i) conformational supramolecular pseudo-polymorphs based on a flexible thioether ligand
CrystEngComm, 2008, 10, 590
7201850 CIFC16 H14 N2 S3P -17.3357; 8.5934; 13.03
84.285; 79.07; 76.17
781.8Peng, Rong; Deng, Shi-Ren; Li, Mian; Li, Dan; Li, Zao-Ying
Solvent-dependent copper(i) conformational supramolecular pseudo-polymorphs based on a flexible thioether ligand
CrystEngComm, 2008, 10, 590
7201851 CIFC29 H29 Au N O P SP b c a19.0501; 14.5809; 19.5329
90; 90; 90
5425.6Kuan, Fong Sheen; Yei Ho, Soo; Tadbuppa, Primjira P.; Tiekink, Edward R. T.
Electronic and steric control over Au⋯Au, C‒H⋯O and C‒H⋯π interactions in the crystal structures of mononuclear triarylphosphinegold(i) carbonimidothioates: R3PAu[SC(OMe)=NR′] for R = Ph, o-tol, m-tol or p-tol, and R′ = Ph, o-tol, m-tol, p-tol or C6H4NO2-4
CrystEngComm, 2008, 10, 548
7201852 CIFC29 H28 Au N2 O3 P SP -19.5246; 11.8876; 13.279
93.58; 93.252; 112.034
1385.75Kuan, Fong Sheen; Yei Ho, Soo; Tadbuppa, Primjira P.; Tiekink, Edward R. T.
Electronic and steric control over Au⋯Au, C‒H⋯O and C‒H⋯π interactions in the crystal structures of mononuclear triarylphosphinegold(i) carbonimidothioates: R3PAu[SC(OMe)=NR′] for R = Ph, o-tol, m-tol or p-tol, and R′ = Ph, o-tol, m-tol, p-tol or C6H4NO2-4
CrystEngComm, 2008, 10, 548
7201853 CIFC29 H29 Au N O P SP -18.8426; 10.4687; 15.2214
74.347; 82.829; 81.799
1337.4Kuan, Fong Sheen; Yei Ho, Soo; Tadbuppa, Primjira P.; Tiekink, Edward R. T.
Electronic and steric control over Au⋯Au, C‒H⋯O and C‒H⋯π interactions in the crystal structures of mononuclear triarylphosphinegold(i) carbonimidothioates: R3PAu[SC(OMe)=NR′] for R = Ph, o-tol, m-tol or p-tol, and R′ = Ph, o-tol, m-tol, p-tol or C6H4NO2-4
CrystEngComm, 2008, 10, 548
7201854 CIFC30 H31 Au N O P SP -19.7125; 11.0257; 14.7644
111.187; 103.553; 97.693
1390.9Kuan, Fong Sheen; Yei Ho, Soo; Tadbuppa, Primjira P.; Tiekink, Edward R. T.
Electronic and steric control over Au⋯Au, C‒H⋯O and C‒H⋯π interactions in the crystal structures of mononuclear triarylphosphinegold(i) carbonimidothioates: R3PAu[SC(OMe)=NR′] for R = Ph, o-tol, m-tol or p-tol, and R′ = Ph, o-tol, m-tol, p-tol or C6H4NO2-4
CrystEngComm, 2008, 10, 548
7201855 CIFC29.5 H28.5 Au Cl1.5 N2 O3 P SP 1 21/c 17.7818; 25.6944; 14.9227
90; 95.948; 90
2967.7Kuan, Fong Sheen; Yei Ho, Soo; Tadbuppa, Primjira P.; Tiekink, Edward R. T.
Electronic and steric control over Au⋯Au, C‒H⋯O and C‒H⋯π interactions in the crystal structures of mononuclear triarylphosphinegold(i) carbonimidothioates: R3PAu[SC(OMe)=NR′] for R = Ph, o-tol, m-tol or p-tol, and R′ = Ph, o-tol, m-tol, p-tol or C6H4NO2-4
CrystEngComm, 2008, 10, 548
7201856 CIFC27.25 H26 Au N O1.25 P SP -18.134; 13.8225; 13.8274
117.394; 98.515; 101.882
1296.92Kuan, Fong Sheen; Yei Ho, Soo; Tadbuppa, Primjira P.; Tiekink, Edward R. T.
Electronic and steric control over Au⋯Au, C‒H⋯O and C‒H⋯π interactions in the crystal structures of mononuclear triarylphosphinegold(i) carbonimidothioates: R3PAu[SC(OMe)=NR′] for R = Ph, o-tol, m-tol or p-tol, and R′ = Ph, o-tol, m-tol, p-tol or C6H4NO2-4
CrystEngComm, 2008, 10, 548
7201857 CIFC27 H25 Au N O P SP -110.4994; 10.7694; 12.7755
93.047; 114.068; 107.663
1230.54Kuan, Fong Sheen; Yei Ho, Soo; Tadbuppa, Primjira P.; Tiekink, Edward R. T.
Electronic and steric control over Au⋯Au, C‒H⋯O and C‒H⋯π interactions in the crystal structures of mononuclear triarylphosphinegold(i) carbonimidothioates: R3PAu[SC(OMe)=NR′] for R = Ph, o-tol, m-tol or p-tol, and R′ = Ph, o-tol, m-tol, p-tol or C6H4NO2-4
CrystEngComm, 2008, 10, 548
7201858 CIFC26.5 H23.5 Au Cl1.5 N O P SP -18.1461; 13.6666; 13.685
116.509; 99.132; 101.974
1277.56Kuan, Fong Sheen; Yei Ho, Soo; Tadbuppa, Primjira P.; Tiekink, Edward R. T.
Electronic and steric control over Au⋯Au, C‒H⋯O and C‒H⋯π interactions in the crystal structures of mononuclear triarylphosphinegold(i) carbonimidothioates: R3PAu[SC(OMe)=NR′] for R = Ph, o-tol, m-tol or p-tol, and R′ = Ph, o-tol, m-tol, p-tol or C6H4NO2-4
CrystEngComm, 2008, 10, 548
7201859 CIFC30 H31 Au N O P SP b c a18.801; 14.4703; 20.738
90; 90; 90
5641.9Kuan, Fong Sheen; Yei Ho, Soo; Tadbuppa, Primjira P.; Tiekink, Edward R. T.
Electronic and steric control over Au⋯Au, C‒H⋯O and C‒H⋯π interactions in the crystal structures of mononuclear triarylphosphinegold(i) carbonimidothioates: R3PAu[SC(OMe)=NR′] for R = Ph, o-tol, m-tol or p-tol, and R′ = Ph, o-tol, m-tol, p-tol or C6H4NO2-4
CrystEngComm, 2008, 10, 548
7201860 CIFC30 H31 Au N O P SP 1 21/n 110.591; 27.184; 10.6679
90; 113.479; 90
2817.1Kuan, Fong Sheen; Yei Ho, Soo; Tadbuppa, Primjira P.; Tiekink, Edward R. T.
Electronic and steric control over Au⋯Au, C‒H⋯O and C‒H⋯π interactions in the crystal structures of mononuclear triarylphosphinegold(i) carbonimidothioates: R3PAu[SC(OMe)=NR′] for R = Ph, o-tol, m-tol or p-tol, and R′ = Ph, o-tol, m-tol, p-tol or C6H4NO2-4
CrystEngComm, 2008, 10, 548
7201861 CIFC30 H31 Au N O P SP 1 21/c 19.7389; 15.5653; 18.5362
90; 100.931; 90
2758.9Kuan, Fong Sheen; Yei Ho, Soo; Tadbuppa, Primjira P.; Tiekink, Edward R. T.
Electronic and steric control over Au⋯Au, C‒H⋯O and C‒H⋯π interactions in the crystal structures of mononuclear triarylphosphinegold(i) carbonimidothioates: R3PAu[SC(OMe)=NR′] for R = Ph, o-tol, m-tol or p-tol, and R′ = Ph, o-tol, m-tol, p-tol or C6H4NO2-4
CrystEngComm, 2008, 10, 548
7201862 CIFC29 H28.25 Au N2 O3.125 P SP -19.7469; 13.9711; 22.0578
73.618; 82.218; 83.664
2847Kuan, Fong Sheen; Yei Ho, Soo; Tadbuppa, Primjira P.; Tiekink, Edward R. T.
Electronic and steric control over Au⋯Au, C‒H⋯O and C‒H⋯π interactions in the crystal structures of mononuclear triarylphosphinegold(i) carbonimidothioates: R3PAu[SC(OMe)=NR′] for R = Ph, o-tol, m-tol or p-tol, and R′ = Ph, o-tol, m-tol, p-tol or C6H4NO2-4
CrystEngComm, 2008, 10, 548
7201863 CIFC27 H25 Au N O P SP 1 21/n 19.1522; 17.7973; 15.3855
90; 102.508; 90
2446.6Kuan, Fong Sheen; Yei Ho, Soo; Tadbuppa, Primjira P.; Tiekink, Edward R. T.
Electronic and steric control over Au⋯Au, C‒H⋯O and C‒H⋯π interactions in the crystal structures of mononuclear triarylphosphinegold(i) carbonimidothioates: R3PAu[SC(OMe)=NR′] for R = Ph, o-tol, m-tol or p-tol, and R′ = Ph, o-tol, m-tol, p-tol or C6H4NO2-4
CrystEngComm, 2008, 10, 548
7201864 CIFC163 H156 Cu6 N12 O70R 3 :H39.7978; 39.7978; 10.1735
90; 90; 120
13954.7Wisser, Barbara; Chamayou, Anne-Christine; Miller, Robert; Scherer, Wolfgang; Janiak, Christoph
A chiral C3-symmetric hexanuclear triangular-prismatic copper(ii) cluster derived from a highly modular dipeptidic N,N′-terephthaloyl-bis(S-aminocarboxylato) ligand
CrystEngComm, 2008, 10, 461
7201865 CIFC10 H20 Mn2 O14P 21 21 218.6831; 12.128; 15.999
90; 90; 90
1684.8Bai, Yue-Ling; Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun
Structural transformations from a 1-D chain to two 3-D supramolecular isomers via crystal disassembly and reassembly
CrystEngComm, 2008, 10, 472
7201866 CIFC4 H10 Mn O8P 21 21 219.121; 9.3174; 10.414
90; 90; 90
885Bai, Yue-Ling; Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun
Structural transformations from a 1-D chain to two 3-D supramolecular isomers via crystal disassembly and reassembly
CrystEngComm, 2008, 10, 472
7201867 CIFC4 H10 Mn O8P 437.9539; 7.9539; 13.189
90; 90; 90
834.4Bai, Yue-Ling; Tao, Jun; Huang, Rong-Bin; Zheng, Lan-Sun
Structural transformations from a 1-D chain to two 3-D supramolecular isomers via crystal disassembly and reassembly
CrystEngComm, 2008, 10, 472
7201868 CIFC34 H23 N3 O10 S ZnP -18.1839; 10.1779; 19.0655
102.57; 97.287; 93.149
1531.9Gao, Xiao-Ming; Li, Dong-sheng; Wang, Ji-Jiang; Fu, Feng; Wu, Ya-Pan; Hu, Huai-Ming; Wang, Ji-Wu
A novel 1D armed-polyrotaxane chain constructed from a V-shaped tetracarboxylate ligand
CrystEngComm, 2008, 10, 479
7201869 CIFC80 H70 Cu10 Ge2 N16 O71 W18P 1 21/n 115.585; 20.081; 19.023
90; 94.118; 90
5938.1Wang, Jingping; Du, Juan; Niu, Jingyang
Novel hexanuclear copper(ii)-substituted dimeric tungstogermanates
CrystEngComm, 2008, 10, 972
7201870 CIFC96 H68 Cu10 Ge2 N16 O70 W18P 1 21/n 116.3328; 20.719; 18.566
90; 92.293; 90
6277.7Wang, Jingping; Du, Juan; Niu, Jingyang
Novel hexanuclear copper(ii)-substituted dimeric tungstogermanates
CrystEngComm, 2008, 10, 972
7201875 CIFC22 H14 Cl F6 N4 Pt SbP 1 21/c 113.579; 19.011; 19.341
90; 109.96; 90
4693Field, John S.; Ledwaba, Lesibana P.; Munro, Orde Q.; McMillin, David R.
Crystal structures and photoluminescent properties of the orange and yellow forms of [Pt{4′-(o-ClC6H4)trpy}(CN)]SbF6: an example of concomitant polymorphism
CrystEngComm, 2008, 10, 740
7201876 CIFC22 H14 Cl F6 N4 Pt SbP 1 21/c 17.35; 20.328; 15.512
90; 102.55; 90
2262.3Field, John S.; Ledwaba, Lesibana P.; Munro, Orde Q.; McMillin, David R.
Crystal structures and photoluminescent properties of the orange and yellow forms of [Pt{4′-(o-ClC6H4)trpy}(CN)]SbF6: an example of concomitant polymorphism
CrystEngComm, 2008, 10, 740
7201877 CIFC96 H115 N6 O42.5 S6P -111.0638; 12.9848; 19.8264
73.838; 73.607; 87.276
2623Liu, Yu; Li, Qiang; Guo, Dong-Sheng; Chen, Kun
Supramolecular chain-like aggregates and polymeric sandwich complexes constructed from p-sulfonatocalix[4,6]arenes with (8-hydroxy)quinoline guests
CrystEngComm, 2008, 10, 675
7201878 CIFC96 H120 N6 O51 S6P -112.131; 12.741; 17.734
102.191; 103.227; 90.24
2604.1Liu, Yu; Li, Qiang; Guo, Dong-Sheng; Chen, Kun
Supramolecular chain-like aggregates and polymeric sandwich complexes constructed from p-sulfonatocalix[4,6]arenes with (8-hydroxy)quinoline guests
CrystEngComm, 2008, 10, 675
7201879 CIFC55 H63 N3 O25 S4P 1 21/c 112.9696; 23.274; 20.884
90; 103.405; 90
6132.2Liu, Yu; Li, Qiang; Guo, Dong-Sheng; Chen, Kun
Supramolecular chain-like aggregates and polymeric sandwich complexes constructed from p-sulfonatocalix[4,6]arenes with (8-hydroxy)quinoline guests
CrystEngComm, 2008, 10, 675
7201880 CIFC47 H32 Cl3 D N8 O8P -111.648; 13.351; 14.481
81.68; 89.47; 69.17
2080.5Ashmore, Jason; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.
Synthesis and inclusion properties of new nitrated C2− symmetric diquinoline hosts
CrystEngComm, 2008, 10, 839
7201881 CIFC23 H16 N4 O4P b c n7.883; 9.292; 25.355
90; 90; 90
1857.2Ashmore, Jason; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.
Synthesis and inclusion properties of new nitrated C2− symmetric diquinoline hosts
CrystEngComm, 2008, 10, 839
7201882 CIFC26.5 H20 N4 O4P c c n16.642; 19.026; 13.49
90; 90; 90
4271Ashmore, Jason; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.
Synthesis and inclusion properties of new nitrated C2− symmetric diquinoline hosts
CrystEngComm, 2008, 10, 839
7201883 CIFC26.5 H20 N4 O4P 1 21/n 111.192; 17.811; 11.205
90; 95.81; 90
2222.1Ashmore, Jason; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.
Synthesis and inclusion properties of new nitrated C2− symmetric diquinoline hosts
CrystEngComm, 2008, 10, 839
7201884 CIFC39 H76 Cl4 N8 O22P 1 21/n 114.2094; 19.3521; 20.5649
90; 109.282; 90
5337.8Yang, Li-Zi; Jiang, Long; Feng, Xiao-Long; Lu, Tong-Bu
Unusual pH value dependent encapsulation and release of water‒methanol binary guests by a cryptand host
CrystEngComm, 2008, 10, 649
7201885 CIFC36 H62 Cl2 N8 O11P n a 2116.553; 15.1396; 17.253
90; 90; 90
4323.7Yang, Li-Zi; Jiang, Long; Feng, Xiao-Long; Lu, Tong-Bu
Unusual pH value dependent encapsulation and release of water‒methanol binary guests by a cryptand host
CrystEngComm, 2008, 10, 649
7201886 CIFC23 H28 O6P 1 21/a 112.3702; 14.102; 13.0089
90; 108.853; 90
2147.6Sureshan, Kana M.; Uchimaru, Tadafumi; Yao, Yonghui; Watanabe, Yutaka
Strength from weakness: CH⋯π stabilized conformational tuning of benzyl ethers and a consequent co-operative edge-to-face CH⋯π network
CrystEngComm, 2008, 10, 493
7201887 CIFC96 H104 N4 O12P 1 21/c 112.0793; 29.4107; 23.5417
90; 97.9242; 90
8283.6Kato, Shin-ichiro; Nakagaki, Takeshi; Shimasaki, Toshiaki; Shinmyozu, Teruo
Molecular tubes and capsules : Part III. The first X-ray crystallographic evidence of a cyclic aniline trimer via self-complementary N‒H⋯π interactions: the aniline inclusion both inside and outside the macrocyclic cavity
CrystEngComm, 2008, 10, 483
7201888 CIFC110 H120 N11 O12P -110.817; 14.977; 15.724
100.72; 91.127; 102.965
2434.1Kato, Shin-ichiro; Nakagaki, Takeshi; Shimasaki, Toshiaki; Shinmyozu, Teruo
Molecular tubes and capsules : Part III. The first X-ray crystallographic evidence of a cyclic aniline trimer via self-complementary N‒H⋯π interactions: the aniline inclusion both inside and outside the macrocyclic cavity
CrystEngComm, 2008, 10, 483
7201889 CIFC60 H108 Gd2 N12 O92 P2 W24P -112.119; 13.598; 22.21
80.328; 85.395; 67.725
3338.2Zhang, Li-Zhi; Gu, Wen; Liu, Xin; Dong, Zhili; Li, Bing
Solid-state photopolymerization of a photochromic hybrid based on Keggin tungstophosphates
CrystEngComm, 2008, 10, 652
7201890 CIFC30 H54 Gd N6 O46 P W12C 1 2/c 122.058; 12.811; 24.39
90; 107.46; 90
6575Zhang, Li-Zhi; Gu, Wen; Liu, Xin; Dong, Zhili; Li, Bing
Solid-state photopolymerization of a photochromic hybrid based on Keggin tungstophosphates
CrystEngComm, 2008, 10, 652
7201891 CIFC17 H9 Cd0.5 N2 O3.5 S0.5P b c m6.0417; 23.07; 24.165
90; 90; 90
3368.2Lian, Fen-Yan; Jiang, Fei-Long; Yuan, Da-Qiang; Chen, Jiu-Tong; Wu, Ming-Yan; Hong, Mao-Chun
Cd(II)-sulfonyldibenzoilate coordination polymers based on mono-, bi-, tri- and tetranuclear cores as nodes
CrystEngComm, 2008, 10, 905
7201892 CIFC52 H36 Cd2 N4 O12 S2P 1 21/n 116.478; 22.004; 16.494
90; 114.412; 90
5446Lian, Fen-Yan; Jiang, Fei-Long; Yuan, Da-Qiang; Chen, Jiu-Tong; Wu, Ming-Yan; Hong, Mao-Chun
Cd(II)-sulfonyldibenzoilate coordination polymers based on mono-, bi-, tri- and tetranuclear cores as nodes
CrystEngComm, 2008, 10, 905
7201893 CIFC24 H16 Cd N2 O6 SP 1 21/c 112.354; 15.312; 12.315
90; 110.33; 90
2184.4Lian, Fen-Yan; Jiang, Fei-Long; Yuan, Da-Qiang; Chen, Jiu-Tong; Wu, Ming-Yan; Hong, Mao-Chun
Cd(II)-sulfonyldibenzoilate coordination polymers based on mono-, bi-, tri- and tetranuclear cores as nodes
CrystEngComm, 2008, 10, 905
7201894 CIFC38 H25 Cd1.5 N2 O12 S2P -110.94; 13.527; 13.633
106.173; 106.438; 102.124
1764.7Lian, Fen-Yan; Jiang, Fei-Long; Yuan, Da-Qiang; Chen, Jiu-Tong; Wu, Ming-Yan; Hong, Mao-Chun
Cd(II)-sulfonyldibenzoilate coordination polymers based on mono-, bi-, tri- and tetranuclear cores as nodes
CrystEngComm, 2008, 10, 905
7201895 CIFC69 H46 Cd4 N2 O24 S4P -112.887; 12.971; 23.254
74.358; 75.948; 60.853
3240.3Lian, Fen-Yan; Jiang, Fei-Long; Yuan, Da-Qiang; Chen, Jiu-Tong; Wu, Ming-Yan; Hong, Mao-Chun
Cd(II)-sulfonyldibenzoilate coordination polymers based on mono-, bi-, tri- and tetranuclear cores as nodes
CrystEngComm, 2008, 10, 905
7201896 CIFC16 H17 Cd N3 O4A b a 217.076; 16.577; 11.809
90; 90; 90
3343Brown, Kyalamboka A.; Martin, David P.; Supkowski, Ronald M.; LaDuca, Robert L.
Two- and three-dimensional divalent metal coordination polymers constructed from 2,2-dimethylsuccinate and dipyridylamine ligands
CrystEngComm, 2008, 10, 846
7201897 CIFC32 H34 Co2 N6 O8P 1 21/n 116.831; 10.984; 19.584
90; 114.956; 90
3282.5Brown, Kyalamboka A.; Martin, David P.; Supkowski, Ronald M.; LaDuca, Robert L.
Two- and three-dimensional divalent metal coordination polymers constructed from 2,2-dimethylsuccinate and dipyridylamine ligands
CrystEngComm, 2008, 10, 846
7201898 CIFC16 H17 Cu N3 O4C m c a11.664; 15.697; 17.263
90; 90; 90
3160.7Brown, Kyalamboka A.; Martin, David P.; Supkowski, Ronald M.; LaDuca, Robert L.
Two- and three-dimensional divalent metal coordination polymers constructed from 2,2-dimethylsuccinate and dipyridylamine ligands
CrystEngComm, 2008, 10, 846
7201899 CIFC16 H17 N3 Ni O4P b c n16.316; 8.094; 23.421
90; 90; 90
3093Brown, Kyalamboka A.; Martin, David P.; Supkowski, Ronald M.; LaDuca, Robert L.
Two- and three-dimensional divalent metal coordination polymers constructed from 2,2-dimethylsuccinate and dipyridylamine ligands
CrystEngComm, 2008, 10, 846
7201900 CIFC34 H22 B2 Cu F8 N6 O4P 1 21/c 110.2844; 17.7865; 9.3905
90; 94.38; 90
1712.7Wan, Chong-Qing; Chen, Xu-Dong; Mak, Thomas C. W.
Supramolecular frameworks assembled via intermolecular lone pair-aromatic interaction between carbonyl and pyridyl groups
CrystEngComm, 2008, 10, 475
7201901 CIFC36 H27 Cu N9 O11P 1 21/n 19.154; 21.374; 18.717
90; 90.286; 90
3662Wan, Chong-Qing; Chen, Xu-Dong; Mak, Thomas C. W.
Supramolecular frameworks assembled via intermolecular lone pair-aromatic interaction between carbonyl and pyridyl groups
CrystEngComm, 2008, 10, 475

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