Crystallography Open Database

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9017441 CIFFe H Li O5 PP -15.3528; 7.2896; 5.1187
109.359; 97.733; 106.359
174.984Marx, N.; Croguennec, L.; Carlier, D.; Wattiaux, A.; Le Cras, F.; Suard, E.; Delmas, C.
The structure of tavorite LiFePO4(OH) from diffraction and GGA + U studies and its preliminary electrochemical characterization
Dalton Transactions, 2010, 39, 5108-5116
9012105 CIFH In O5 P RbP 43 21 29.4; 9.4; 11.179
90; 90; 90
987.776Lii, K. H.
RbIn(OH)PO4: an indium(III) phosphate containing spirals of corner-sharing InO6 octahedra
Dalton Transactions, 1996, 1996, 815-818
9012104 CIFSe8P 1 21/c 115.018; 14.713; 8.789
90; 93.61; 90
1938.16Foss, O.; Janickis, V.
Crystal structure of gamma-monoclinic selenium Note: structure known as gamma phase Note: gamma-monoclinic selenium is allotrope of cyclo-octaselenium
Dalton Transactions, 1980, 1980, 624-627
9012103 CIFC4 H8 Cu O5C 1 2/c 113.168; 8.564; 13.858
90; 117.02; 90
1392.2Meester, P.; Fletcher, S. R.; Skapski, A. C.
Refined crystal structure of tetra-mu-acetato-bisaquodicopper (II)
Dalton Transactions, 1973, 1973, 2575-2578
9012102 CIFAs4 S5P 1 21/m 17.98; 8.1; 7.14
90; 101; 90
453.036Whitfield, H. J.
Crystal and molecular structure of tetraarsenic pentasulphide
Dalton Transactions, 1973, 1973, 1740-1742
9012101 CIFAs SC 1 2/c 19.957; 9.335; 8.889
90; 102.48; 90
806.698Porter, E. J.; Sheldrick, G. M.
Crystal structure of a new crystalline modification of tetra-arsenic tetrasuphide (2,3,4,8-tetrathia1,2,3,7-tetra-arsatricyclo[3,3,0,0]-octane)
Dalton Transactions, 1972, 1972, 1347-1349
9009748 CIFO3 Sb2P c c n4.8996; 12.449; 5.4103
90; 90; 90
330.002Whitten, A. E.; Dittrich, B.; Spackman, M. A.; Turner, P.; Brown, T. C.
Charge density analysis of two polymorphs of antimony(III) oxide
Dalton Transactions, 2004, 2004, 23-29
9009747 CIFO3 Sb2F d -3 m :211.116; 11.116; 11.116
90; 90; 90
1373.55Whitten, A. E.; Dittrich, B.; Spackman, M. A.; Turner, P.; Brown, T. C.
Charge density analysis of two polymorphs of antimony(III) oxide
Dalton Transactions, 2004, 2004, 23-29
9009746 CIFMg2 O7 V2P 1 21/c 16.599; 8.406; 9.472
90; 100.608; 90
516.443Nielsen, U. G.; Jakobsen, H. J.; Skibsted, J.; Norby, P.
Crystal structure of alpha-Mg2V2O7 from synchrotron X-ray powder diffraction and characterization by 51V MAS NMR spectroscopy Note: z-coordinate of V1 changed as directed by the author, Aug 2005.
Dalton Transactions, 2001, 2001, 3214-3218
7716000 CIFC40 H26 Ce F9 N2 O6P 1 21/n 111.1505; 22.8068; 15.0009
90; 99.925; 90
3757.7Tubau, Ànnia; Gómez-Coca, Silvia; Speed, Saskia; Font-Bardia, Merce; Vicente, Ramon
New series of Mononuclear β-diketonate Cerium(III) Field Induced Single-Molecule Magnets
Dalton Transactions, 2024
7715999 CIFC42 H26 Ce F9 N2 O6P 1 21/c 19.6048; 36.456; 10.9642
90; 93.01; 90
3833.8Tubau, Ànnia; Gómez-Coca, Silvia; Speed, Saskia; Font-Bardia, Merce; Vicente, Ramon
New series of Mononuclear β-diketonate Cerium(III) Field Induced Single-Molecule Magnets
Dalton Transactions, 2024
7715998 CIFC42 H31 Ce F9 N2 O7P -110.8841; 12.3497; 17.1066
88.341; 76.6; 66.494
2046Tubau, Ànnia; Gómez-Coca, Silvia; Speed, Saskia; Font-Bardia, Merce; Vicente, Ramon
New series of Mononuclear β-diketonate Cerium(III) Field Induced Single-Molecule Magnets
Dalton Transactions, 2024
7715997 CIFC57 H41 Ce F9 N3 O7P 1 21/c 115.4985; 17.0389; 20.7744
90; 107.757; 90
5224.7Tubau, Ànnia; Gómez-Coca, Silvia; Speed, Saskia; Font-Bardia, Merce; Vicente, Ramon
New series of Mononuclear β-diketonate Cerium(III) Field Induced Single-Molecule Magnets
Dalton Transactions, 2024
7715996 CIFC45 H29 Ce F9 N3 O6P 4310.5626; 10.5626; 38.185
90; 90; 90
4260.2Tubau, Ànnia; Gómez-Coca, Silvia; Speed, Saskia; Font-Bardia, Merce; Vicente, Ramon
New series of Mononuclear β-diketonate Cerium(III) Field Induced Single-Molecule Magnets
Dalton Transactions, 2024
7715995 CIFC30 H22 Ce F9 O8P 21 21 2110.8091; 14.0772; 21.079
90; 90; 90
3207.42Tubau, Ànnia; Gómez-Coca, Silvia; Speed, Saskia; Font-Bardia, Merce; Vicente, Ramon
New series of Mononuclear β-diketonate Cerium(III) Field Induced Single-Molecule Magnets
Dalton Transactions, 2024
7715994 CIFC30 H22 Ce F9 O8P 21 21 2110.8548; 13.219; 23.317
90; 90; 90
3345.7Tubau, Ànnia; Gómez-Coca, Silvia; Speed, Saskia; Font-Bardia, Merce; Vicente, Ramon
New series of Mononuclear β-diketonate Cerium(III) Field Induced Single-Molecule Magnets
Dalton Transactions, 2024
7715989 CIFC45 H42 Co1.5 F9 Fe N15 O6C 1 2/c 128.9299; 19.9584; 23.2361
90; 100.411; 90
13195.5Yadav, Jyoti; Nandi, Monojit; Kharel, Ranjan; Mukherjee, Moubani; Konar, Sanjit
Thermal and protonation-induced electron transfer coupled spin transition in discrete [Fe2Co3] Prussian Blue Analogue
Dalton Transactions, 2024
7715988 CIFC22 H42 K O6 P3P 21 21 219.5881; 17.1596; 17.2604
90; 90; 90
2839.82Uttendorfer, Maria Katharina; Hierlmeier, Gabriele; Balazs, Gabor; Wolf, Robert
Access to 1,2,3-triphospholide ligands by reduction of di-tert-butyldiphosphatetrahedrane
Dalton Transactions, 2024
7715987 CIFC20 H36 P6C 1 2/c 119.2177; 12.5176; 22.1442
90; 112.755; 90
4912.4Uttendorfer, Maria Katharina; Hierlmeier, Gabriele; Balazs, Gabor; Wolf, Robert
Access to 1,2,3-triphospholide ligands by reduction of di-tert-butyldiphosphatetrahedrane
Dalton Transactions, 2024
7715986 CIFC27 H51 O6 P2 RbP -19.3862; 10.5727; 16.3426
90.511; 98.341; 101.542
1570.99Uttendorfer, Maria Katharina; Hierlmeier, Gabriele; Balazs, Gabor; Wolf, Robert
Access to 1,2,3-triphospholide ligands by reduction of di-tert-butyldiphosphatetrahedrane
Dalton Transactions, 2024
7715985 CIFC20 H33 Fe P3P 1 21/c 110.1779; 12.7916; 16.426
90; 107.87; 90
2035.35Uttendorfer, Maria Katharina; Hierlmeier, Gabriele; Balazs, Gabor; Wolf, Robert
Access to 1,2,3-triphospholide ligands by reduction of di-tert-butyldiphosphatetrahedrane
Dalton Transactions, 2024
7715984 CIFC20 H33 P3 RuP 1 21/c 110.2485; 13.0851; 16.33
90; 107.637; 90
2086.96Uttendorfer, Maria Katharina; Hierlmeier, Gabriele; Balazs, Gabor; Wolf, Robert
Access to 1,2,3-triphospholide ligands by reduction of di-tert-butyldiphosphatetrahedrane
Dalton Transactions, 2024
7715983 CIFC22 H42 O6 P3 RbP 1 21/n 110.3193; 16.0011; 17.6998
90; 106.489; 90
2802.4Uttendorfer, Maria Katharina; Hierlmeier, Gabriele; Balazs, Gabor; Wolf, Robert
Access to 1,2,3-triphospholide ligands by reduction of di-tert-butyldiphosphatetrahedrane
Dalton Transactions, 2024
7715982 CIFC30 H58 Li O9 P3P b c a37.25924; 12.33778; 31.13083
90; 90; 90
14310.7Uttendorfer, Maria Katharina; Hierlmeier, Gabriele; Balazs, Gabor; Wolf, Robert
Access to 1,2,3-triphospholide ligands by reduction of di-tert-butyldiphosphatetrahedrane
Dalton Transactions, 2024
7715981 CIFC48 H42 B2 N2P 1 21/c 114.4866; 9.54883; 27.3251
90; 96.5701; 90
3755.06Zender, Elena; Valverde, Danillo; Neubaur, Robert; Karger, Sebastian; Virovets, Alexander; Bolte, Michael; Lerner, Hans-Wolfram; Olivier, Yoann; Wagner, Matthias
Borylation and rearrangement reactions of azasilaanthracenes to afford B,N-doped nanographenes
Dalton Transactions, 2024
7715980 CIFC34 H32 N2 Si2C 1 2/c 133.9; 12.1623; 15.9963
90; 117.866; 90
5830.5Zender, Elena; Valverde, Danillo; Neubaur, Robert; Karger, Sebastian; Virovets, Alexander; Bolte, Michael; Lerner, Hans-Wolfram; Olivier, Yoann; Wagner, Matthias
Borylation and rearrangement reactions of azasilaanthracenes to afford B,N-doped nanographenes
Dalton Transactions, 2024
7715979 CIFC53 H38 B3 Cl6 N3P -112.7063; 13.7794; 15.4494
114.175; 101.129; 103.186
2274.3Zender, Elena; Valverde, Danillo; Neubaur, Robert; Karger, Sebastian; Virovets, Alexander; Bolte, Michael; Lerner, Hans-Wolfram; Olivier, Yoann; Wagner, Matthias
Borylation and rearrangement reactions of azasilaanthracenes to afford B,N-doped nanographenes
Dalton Transactions, 2024
7715978 CIFC45 H28 B2 N3P -112.53928; 13.09723; 20.87428
104.878; 102.068; 103.795
3081.36Zender, Elena; Valverde, Danillo; Neubaur, Robert; Karger, Sebastian; Virovets, Alexander; Bolte, Michael; Lerner, Hans-Wolfram; Olivier, Yoann; Wagner, Matthias
Borylation and rearrangement reactions of azasilaanthracenes to afford B,N-doped nanographenes
Dalton Transactions, 2024
7715977 CIFC43.75 H29 B2 N3P -113.4369; 15.3305; 16.2651
93.335; 104.594; 95.069
3218.5Zender, Elena; Valverde, Danillo; Neubaur, Robert; Karger, Sebastian; Virovets, Alexander; Bolte, Michael; Lerner, Hans-Wolfram; Olivier, Yoann; Wagner, Matthias
Borylation and rearrangement reactions of azasilaanthracenes to afford B,N-doped nanographenes
Dalton Transactions, 2024
7715976 CIFC77 H72 B3 N7C 1 2/c 123.3411; 16.5921; 18.8439
90; 113.996; 90
6667.1Zender, Elena; Valverde, Danillo; Neubaur, Robert; Karger, Sebastian; Virovets, Alexander; Bolte, Michael; Lerner, Hans-Wolfram; Olivier, Yoann; Wagner, Matthias
Borylation and rearrangement reactions of azasilaanthracenes to afford B,N-doped nanographenes
Dalton Transactions, 2024
7715975 CIFC30 H20 B2 Br2 N2P -110.4916; 11.482; 12.0304
66.894; 72.833; 80.133
1271Zender, Elena; Valverde, Danillo; Neubaur, Robert; Karger, Sebastian; Virovets, Alexander; Bolte, Michael; Lerner, Hans-Wolfram; Olivier, Yoann; Wagner, Matthias
Borylation and rearrangement reactions of azasilaanthracenes to afford B,N-doped nanographenes
Dalton Transactions, 2024
7715974 CIFC48 H45 N3 Si3P 63/m12.6858; 12.6858; 14.316
90; 90; 120
1995.2Zender, Elena; Valverde, Danillo; Neubaur, Robert; Karger, Sebastian; Virovets, Alexander; Bolte, Michael; Lerner, Hans-Wolfram; Olivier, Yoann; Wagner, Matthias
Borylation and rearrangement reactions of azasilaanthracenes to afford B,N-doped nanographenes
Dalton Transactions, 2024
7715973 CIFC34 H32 N2 Si2P 1 21/c 115.0752; 11.9578; 15.9121
90; 93.715; 90
2862.4Zender, Elena; Valverde, Danillo; Neubaur, Robert; Karger, Sebastian; Virovets, Alexander; Bolte, Michael; Lerner, Hans-Wolfram; Olivier, Yoann; Wagner, Matthias
Borylation and rearrangement reactions of azasilaanthracenes to afford B,N-doped nanographenes
Dalton Transactions, 2024
7715972 CIFC57 H74 P4 S2P -19.6607; 17.1058; 17.4524
105.193; 94.859; 101.727
2696Ziółkowska, Aleksandra; Prześniak-Welenc, Marta; Kruczyński, Tomasz; Gamer, Michael T.; Ponikiewski, Łukasz
From phosphanylphosphaalkene to coordination copper and silver polymers containing P-P bond
Dalton Transactions, 2024
7715971 CIFC25 H33 Ag Cl P2 SI 1 2/a 129.324; 9.7516; 18.3994
90; 98.631; 90
5201.8Ziółkowska, Aleksandra; Prześniak-Welenc, Marta; Kruczyński, Tomasz; Gamer, Michael T.; Ponikiewski, Łukasz
From phosphanylphosphaalkene to coordination copper and silver polymers containing P-P bond
Dalton Transactions, 2024
7715970 CIFC46 H66 P4 S2P -18.4421; 9.329; 16.0163
80.56; 88.671; 66.536
1140.18Ziółkowska, Aleksandra; Prześniak-Welenc, Marta; Kruczyński, Tomasz; Gamer, Michael T.; Ponikiewski, Łukasz
From phosphanylphosphaalkene to coordination copper and silver polymers containing P-P bond
Dalton Transactions, 2024
7715969 CIFC25 H33 Ag Cl P2 SI 1 2/a 129.1911; 9.7656; 18.4336
90; 98.632; 90
5195.3Ziółkowska, Aleksandra; Prześniak-Welenc, Marta; Kruczyński, Tomasz; Gamer, Michael T.; Ponikiewski, Łukasz
From phosphanylphosphaalkene to coordination copper and silver polymers containing P-P bond
Dalton Transactions, 2024
7715968 CIFC23 H33 Ag Cl P2 SP -18.6692; 9.7343; 16.9516
90.826; 103.141; 115.892
1242.63Ziółkowska, Aleksandra; Prześniak-Welenc, Marta; Kruczyński, Tomasz; Gamer, Michael T.; Ponikiewski, Łukasz
From phosphanylphosphaalkene to coordination copper and silver polymers containing P-P bond
Dalton Transactions, 2024
7715967 CIFC23 H33 Cl Cu P2 SI 1 2/a 117.2149; 9.9874; 29.208
90; 105.951; 90
4828.4Ziółkowska, Aleksandra; Prześniak-Welenc, Marta; Kruczyński, Tomasz; Gamer, Michael T.; Ponikiewski, Łukasz
From phosphanylphosphaalkene to coordination copper and silver polymers containing P-P bond
Dalton Transactions, 2024
7715966 CIFC25 H33 Cl Cu P2 SI 1 2/a 128.5608; 9.7959; 18.4297
90; 99.998; 90
5077.9Ziółkowska, Aleksandra; Prześniak-Welenc, Marta; Kruczyński, Tomasz; Gamer, Michael T.; Ponikiewski, Łukasz
From phosphanylphosphaalkene to coordination copper and silver polymers containing P-P bond
Dalton Transactions, 2024
7715965 CIFC28 H39 Cr2 N4 Na O21P 1 2 121.0907; 8.6541; 22.8011
90; 110.661; 90
3894.02Dunatov, Marko; Zhao, Zhibo; Žilić, Dijana; Androš Dubraja, Lidija
Homochiral tartrate-bridged dinuclear chromium(III) complex anion with resonance-assisted hydrogen bond for proton conduction
Dalton Transactions, 2024
7715964 CIFC28 H39 Cr2 N4 Na O21P 1 2 121.0907; 8.6541; 22.8011
90; 110.661; 90
3894.02Dunatov, Marko; Zhao, Zhibo; Žilić, Dijana; Androš Dubraja, Lidija
Homochiral tartrate-bridged dinuclear chromium(III) complex anion with resonance-assisted hydrogen bond for proton conduction
Dalton Transactions, 2024
7715963 CIFC28 H39 Cr2 N4 Na O21P 1 2 119.981; 8.7003; 22.9085
90; 99.22; 90
3930.98Dunatov, Marko; Zhao, Zhibo; Žilić, Dijana; Androš Dubraja, Lidija
Homochiral tartrate-bridged dinuclear chromium(III) complex anion with resonance-assisted hydrogen bond for proton conduction
Dalton Transactions, 2024
7715962 CIFC26 H28 N2 O6 PtP 1 21/c 111.5142; 12.2748; 17.2202
90; 96.978; 90
2415.8Li, Zhuoheng; Ekanayake, Akalanka B.; Bartman, Anna E.; Doorn, Jonathan A.; Tivanski, Alexei V.; Pigge, Chris
Detection and disaggregation of amyloid fibrils by luminescent amphiphilic platinum(II) complexes
Dalton Transactions, 2024
7715961 CIFC26 H26 N2 O5 PtP 1 21/c 114.143; 12.3571; 14.0848
90; 107.375; 90
2349.2Li, Zhuoheng; Ekanayake, Akalanka B.; Bartman, Anna E.; Doorn, Jonathan A.; Tivanski, Alexei V.; Pigge, Chris
Detection and disaggregation of amyloid fibrils by luminescent amphiphilic platinum(II) complexes
Dalton Transactions, 2024
7715960 CIFC26 H25 N O4 PtC 1 c 115.5673; 21.225; 6.6731
90; 95.563; 90
2194.5Li, Zhuoheng; Ekanayake, Akalanka B.; Bartman, Anna E.; Doorn, Jonathan A.; Tivanski, Alexei V.; Pigge, Chris
Detection and disaggregation of amyloid fibrils by luminescent amphiphilic platinum(II) complexes
Dalton Transactions, 2024
7715959 CIFC50 H78 Co2 N10 O4 S2P 1 21/c 110.562; 14.568; 17.808
90; 98.219; 90
2711.9Datta, Amitabha; Das, Kuheli; Beyene, Belete; Massera, Chiara; Garribba, Eugenio; El Fallah, M. Salah; Frontera, Antonio; Hung, Chen-Hsiung
Magnetism and DFT Interrogation of A Doubly Carboxylato Bridged Co(II) Derivative Anchored with A ‘Scorpionate’ Precursor: Potential Electrocatalyst for Heterogeneous H2 Evolution
Dalton Transactions, 2024
7715958 CIFC24 H14 B4 Br2 F6 N6 O3P -18.1074; 10.5772; 15.807
91.309; 91.058; 99.216
1337.3Cui, Luxia; Furuta, Ryoji; Harada, Takunori; Konta, Takeru; Hoshino, Yu; Ono, Toshikazu
Simultaneous Discovery of Chiral and Achiral Dyes: Elucidating the Optical Functions of Helical and Flag-Hinged Boron–Tetradentate Complexes
Dalton Transactions, 2024
7715957 CIFC28 H26 B4 F8 N8 O2P -19.2962; 9.8661; 17.0113
84.337; 83.855; 80.627
1525.3Cui, Luxia; Furuta, Ryoji; Harada, Takunori; Konta, Takeru; Hoshino, Yu; Ono, Toshikazu
Simultaneous Discovery of Chiral and Achiral Dyes: Elucidating the Optical Functions of Helical and Flag-Hinged Boron–Tetradentate Complexes
Dalton Transactions, 2024
7715956 CIFC25 H16 B4 Br2 Cl2 F8 N6 O2P 1 21/n 17.3686; 18.9186; 21.9266
90; 91.991; 90
3054.8Cui, Luxia; Furuta, Ryoji; Harada, Takunori; Konta, Takeru; Hoshino, Yu; Ono, Toshikazu
Simultaneous Discovery of Chiral and Achiral Dyes: Elucidating the Optical Functions of Helical and Flag-Hinged Boron–Tetradentate Complexes
Dalton Transactions, 2024

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