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COD ID ![]() |
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Space group ![]() |
Cell parameters | Cell volume ![]() |
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|---|---|---|---|---|---|---|
| 6000044 | CIF | P3 Pd4 Zr3 | P n m a | 16.387; 3.8258; 9.979 90; 90; 90 | 625.62 | Wang, M. T.; Mcdonald, R.; Mar, A. Ternary early-transition-metal palladium pnictides Zr3Pd4P3, Hf3Pd4P3, HfPdSb, and Nb5Pd4P4 Inorganic Chemistry, 2000, 39, 4936-4941 |
| 6000045 | CIF | H3 P3 Pd4 | P n m a | 16.34; 3.7867; 9.954 90; 90; 90 | 615.9 | Wang, M. T.; Mcdonald, R.; Mar, A. Ternary early-transition-metal palladium pnictides Zr3Pd4P3, Hf3Pd4P3, HfPdSb, and Nb5Pd4P4 Inorganic Chemistry, 2000, 39, 4936-4941 |
| 6000046 | CIF | Hf Pd Sb | P n m a | 6.754; 4.204; 7.701 90; 90; 90 | 218.66 | Wang, M. T.; Mcdonald, R.; Mar, A. Ternary early-transition-metal palladium pnictides Zr3Pd4P3, Hf3Pd4P3, HfPdSb, and Nb5Pd4P4 Inorganic Chemistry, 2000, 39, 4936-4941 |
| 6000047 | CIF | Nb5 P4 Pd4 | I 4/m | 10.3059; 10.3059; 3.6372 90; 90; 90 | 386.31 | Meitian Wang; Robert McDonald; Arthur Mar Ternary early-transition-metal palladium pnictides Zr3Pd4P3, Hf3Pd4P3, HfPdSb, and Nb5Pd4P4 Inorganic Chemistry, 2000, 39, 4936-4941 |
| 6000057 | CIF | Hg2 Mo O4 | P 1 21/c 1 | 5.1131; 9.0183; 10.86 90; 101.01; 90 | 491.553 | Mormann, T. J.; Jeitschko, W. Mercury(I) molybdates and tungstates: Hg2WO4 and two modifications of Hg2MoO4 Inorganic Chemistry, 2000, 39, 4219-4223 |
| 6000058 | CIF | Hg2 Mo O4 | C 1 2/c 1 | 8.7352; 11.5519; 4.9305 90; 115.196; 90 | 450.19 | Mormann, T. J.; Jeitschko, W. Mercury(I) molybdates and tungstates: Hg2WO4 and two modifications of Hg2MoO4 Inorganic Chemistry, 2000, 39, 4219-4223 |
| 6000059 | CIF | Hg2 O4 W | C 1 2/c 1 | 8.73; 11.476; 4.9324 90; 114.86; 90 | 448.37 | Mormann, T. J.; Jeitschko, W. Mercury(I) molybdates and tungstates: Hg2WO4 and two modifications of Hg2MoO4 Inorganic Chemistry, 2000, 39, 4219-4223 |
| 6000065 | CIF | Mn Sc6 Te2 | P -6 2 m | 7.662; 7.662; 3.9041 90; 90; 120 | 198.49 | Maggard, P. A.; Corbett, J. D. Sc6MTe2 (M = Mn, Fe, Co, Ni): Members of the flexible Zr6CoAl2-type family of compounds Inorganic Chemistry, 2000, 39, 4143-4146 |
| 6000066 | CIF | Fe Sc6 Te2 | P -6 2 m | 7.6795; 7.6795; 3.8368 90; 90; 120 | 195.96 | Maggard, P. A.; Corbett, J. D. Sc6MTe2 (M = Mn, Fe, Co, Ni): Members of the flexible Zr6CoAl2-type family of compounds Inorganic Chemistry, 2000, 39, 4143-4146 |
| 6000067 | CIF | Co Sc6 Te2 | P -6 2 m | 7.6977; 7.6977; 3.7855 90; 90; 120 | 194.26 | Maggard, P. A.; Corbett, J. D. Sc6MTe2 (M = Mn, Fe, Co, Ni): Members of the flexible Zr6CoAl2-type family of compounds Inorganic Chemistry, 2000, 39, 4143-4146 |
| 6000068 | CIF | Ni Sc6 Te2 | P -6 2 m | 7.7235; 7.7235; 3.7656 90; 90; 120 | 194.53 | Maggard, P. A.; Corbett, J. D. Sc6MTe2 (M = Mn, Fe, Co, Ni): Members of the flexible Zr6CoAl2-type family of compounds Inorganic Chemistry, 2000, 39, 4143-4146 |
| 6000143 | CIF | F6 Ge5 H17.34 N4 O9.67 | P b c n | 7.0065; 11.7976; 19.52 90; 90; 90 | 1613.52 | Conradsson, T.; Zou, X. D.; Dadachov, M. S. Synthesis and crystal structure of a novel germanate: (NH4)(4)[(GeO2)(3)(GeO1.5F3)(2)] 0.67H(2)O Inorganic Chemistry, 2000, 39, 1716-1720 |
| 6000155 | CIF | C2 N3 Na | P 1 21/n 1 | 6.477; 14.948; 3.5725 90; 93.496; 90 | 345.24 | Jurgens, B.; Irran, E.; Schneider, J.; Schnick, W. Trimerization of NaC2N3 to Na3C6N9 in the solid: Ab initio crystal structure determination of two polymorphs of NaC2N3 and of Na3C6N9 from X-ray powder diffractometry Inorganic Chemistry, 2000, 39, 665-670 |
| 6000157 | CIF | C6 N9 Na3 | P 1 21/n 1 | 11.0482; 23.3806; 3.5162 90; 97.913; 90 | 899.62 | Jurgens, B.; Irran, E.; Schneider, J.; Schnick, W. Trimerization of NaC2N3 to Na3C6N9 in the solid: Ab initio crystal structure determination of two polymorphs of NaC2N3 and of Na3C6N9 from X-ray powder diffractometry Inorganic Chemistry, 2000, 39, 665-670 |
| 6000228 | CIF | C3 H4 O5 P Pr | P 1 21/m 1 | 8.3617; 7.1899; 5.4586 90; 103.784; 90 | 318.72 | Serpaggi, F.; Ferey, G. Hybrid organic-inorganic frameworks (MIL-n). Hydrothermal synthesis of a series of pillared lanthanide carboxyethylphosphonates and X-ray powder ab initio structure determination of MIL-19, Pr[O3P(CH2)(2)CO2] Inorganic Chemistry, 1999, 38, 4741-4744 |
| 6000269 | CIF | Te Zr2 | P n m a | 19.95; 3.8236; 10.6563 90; 90; 90 | 812.87 | Orlygsson, G.; Harbrecht, B. Synthesis and crystal structure of Zr2Te. Distinctions in bonding to isotypic Sc2Te and the relationship to the structures of congeneric Hf2Te and Zr2Se Inorganic Chemistry, 1999, 38, 3377-3383 |
| 6000308 | CIF | Ni2 Sc5 Te2 | P n m a | 17.862; 3.9533; 10.6398 90; 90; 90 | 751.32 | Maggard, P. A.; Corbett, J. D. Sc5Ni2Te2: Synthesis, structure, and bonding of a metal-metal-bonded chain phase, a relative of Gd3MnI3 Inorganic Chemistry, 1999, 38, 1945-1950 |
| 6000389 | CIF | H15 Na Ni4 O22 P4 | P 1 21 1 | 8.374; 12.81; 8.307 90; 106.19; 90 | 855.76 | Hamanaka, N.; Imoto, H. Syntheses, structures, and magnetic properties of metal(II) phosphates with M(OH)(PO4)(2): Layers (M = Ni, Co, Mg) Inorganic Chemistry, 1998, 37, 5844-5850 |
| 6000390 | CIF | Co2 H8 O11 P2 | P c a b | 8.343; 13.093; 15.384 90; 90; 90 | 1680.47 | Hamanaka, N.; Imoto, H. Syntheses, structures, and magnetic properties of metal(II) phosphates with M(OH)(PO4)(2): Layers (M = Ni, Co, Mg) Inorganic Chemistry, 1998, 37, 5844-5850 |
| 6000450 | CIF | H Mn O10 P3 Rb | C 1 2/c 1 | 12.1866; 8.3586; 9.0763 90; 109.067; 90 | 873.82 | Wright, A. J.; Attfield, J. P. Structural, magnetic, and ion-exchange properties of RbMnHP3O10 Inorganic Chemistry, 1998, 37, 3858-3861 |
| 6000479 | CIF | Ba Fe4 H5 Na O25 P6 | P 1 21/c 1 | 9.287; 22.665; 8.966 90; 91.82; 90 | 1886.3 | Korzenski, M. B.; Kolis, J. W. Structural, magnetic, and ion-exchange properties of a new layered alkaline/alkaline earth iron phosphate: NaBaFe4(HPO4)(3)(PO4)(3).H2O Inorganic Chemistry, 2000, 39, 5663-5668 |
| 6000488 | CIF | C3 H13 N2 O8 P2 Zn | P 1 21/c 1 | 5.2677; 13.3025; 14.7833 90; 96.049; 90 | 1030.2 | Amitava Choudhury; Srinivasan Natarajan; C. N. R. Rao Formation of One-, Two-, and Three-Dimensional Open-Framework Zinc Phosphates in the Presence of a Tetramine Inorganic Chemistry, 2000, 39, 4295-4304 |
| 6000489 | CIF | C3 H14 N2 O12 P3 Zn2 | P -1 | 7.5151; 8.2553; 12.9115 98.654; 101.274; 115.791 | 681.69 | Amitava Choudhury; Srinivasan Natarajan; C. N. R. Rao Formation of one-, two-, and three-dimensional open-framework zinc phosphates in the presence of a tetramine Inorganic Chemistry, 2000, 39, 4295-4304 |
| 6000490 | CIF | C3 H11 N2 O8 P2 Zn2 | P -1 | 8.064; 8.457; 9.023 111.9; 108; 103.6 | 498.35 | Choudhury, A.; Natarajan, S.; Rao, C. N. R. Formation of one-, two-, and three-dimensional open-framework zinc phosphates in the presence of a tetramine Inorganic Chemistry, 2000, 39, 4295-4304 |
| 6000491 | CIF | C3 H12 N2 O12 P3 Zn3 | P -1 | 5.218; 8.78; 16.081 89.3; 83.5; 74.3 | 704.56 | Choudhury, A.; Natarajan, S.; Rao, C. N. R. Formation of one-, two-, and three-dimensional open-framework zinc phosphates in the presence of a tetramine Inorganic Chemistry, 2000, 39, 4295-4304 |
| 6000492 | CIF | C3 H11 N2 O16 P4 Zn4 | P 1 21/c 1 | 9.219; 15.239; 10.227 90; 105.2; 90 | 1386.51 | Choudhury, A.; Natarajan, S.; Rao, C. N. R. Formation of one-, two-, and three-dimensional open-framework zinc phosphates in the presence of a tetramine Inorganic Chemistry, 2000, 39, 4295-4304 |
| 6000493 | CIF | H7 N O6.5 P V | I 4/m m m | 6.316; 6.316; 13.54 90; 90; 90 | 540.14 | Junghwan Do; Ranko P. Bontchev; Allan J. Jacobson A Hydrothermal Investigation of the 1/2V~2~O~5~-H~2~C~2~O~4~ / H~3~PO~4~ / NH~4~OH System: Synthesis and Structures of (NH~4~)VOPO~4~1.5H~2~O, (NH~4~) (NH~4~)~0.5~VOPO~4~1.5H~2~O, (NH~4~)~2~[VO(H~2~O)~3~]~2~[VO(H~2~O)][VO(PO~4~)~2~]~2~3H~2~O, and (NH~4~)~2~[VO(HPO~4~)]~2~(C~2~O~4~)H~2~O Inorganic Chemistry, 2000, 39, 3230-3237 |
| 6000494 | CIF | H5 N0.5 O6.5 P V | P 1 21/m 1 | 6.9669; 17.6627; 8.9304 90; 105.347; 90 | 1059.7 | Junghwan Do; Ranko P. Bontchev; Allan J. Jacobson A Hydrothermal Investigation of the 1/2V~2~O~5~-H~2~C~2~O~4~ / H~3~PO~4~ / NH~4~OH System: Synthesis and Structures of (NH~4~)VOPO~4~1.5H~2~O, (NH~4~) (NH~4~)~0.5~VOPO~4~1.5H~2~O, (NH~4~)~2~[VO(H~2~O)~3~]~2~[VO(H~2~O)][VO(PO~4~)~2~]~2~3H~2~O, and (NH~4~)~2~[VO(HPO~4~)]~2~(C~2~O~4~)H~2~O Inorganic Chemistry, 2000, 39, 3230-3237 |
| 6000495 | CIF | H28 N2 O21 P4 V5 | P -1 | 10.2523; 12.263; 12.362 69.041; 65.653; 87.789 | 1311.42 | Do, J.; Bontchev, R. P.; Jacobson, A. J. A hydrothermal investigation of the 1/2V(2)O(5)-H2C2O4/H3PO4/NH4OH system: Synthesis and structures of (NH4)VOPO4.1.5H(2)O, (NH4)(0.5)VOPO4.1.5H(2)O, (NH4)(2)[VO(H2O)(3)](2)[VO(H2O)][VO(PO4)(2)](2).3H(2)O, and (NH4)(2)[VO(HPO4)](2)(C2O4).5H(2)O Inorganic Chemistry, 2000, 39, 3230-3237 |
| 6000496 | CIF | C2 H22 N2 O20 P2 V2 | C 1 2/m 1 | 17.735; 6.418; 22.839 90; 102.017; 90 | 2542.64 | Do, J.; Bontchev, R. P.; Jacobson, A. J. A hydrothermal investigation of the 1/2V(2)O(5)-H2C2O4/H3PO4/NH4OH system: Synthesis and structures of (NH4)VOPO4.1.5H(2)O, (NH4)(0.5)VOPO4.1.5H(2)O, (NH4)(2)[VO(H2O)(3)](2)[VO(H2O)][VO(PO4)(2)](2).3H(2)O, and (NH4)(2)[VO(HPO4)](2)(C2O4).5H(2)O Inorganic Chemistry, 2000, 39, 3230-3237 |
| 6000497 | CIF | C90 H70 N18 O42 V16 | P -1 | 12.2071; 13.8855; 16.9832 69.584; 71.204; 84.64 | 2553.4 | Hagrman, P. J.; Zubieta, J. Structural influences of organonitrogen ligands on vanadium oxide solids. Hydrothermal syntheses and structures of the terpyridine vanadates [V2O4(terpy)(2)](3)[V10O28], [VO2(terpy)][V4O10], and [V9O22(terpy)(3)] Inorganic Chemistry, 2000, 39, 3252-3260 |
| 6000498 | CIF | C15 H11 N3 O12 V5 | P 1 21/n 1 | 7.7771; 10.3595; 25.715 90; 92.286; 90 | 2070.13 | Pamela J. Hagrman; Jon Zubieta Structural influences of organonitrogen ligands on vanadium oxide solids. Hydrothermal syntheses and structures of the terpyridine vanadates [V2O4(terpy)(2)](3)[V10O28], [VO2(terpy)][V4O10], and [V9O22(terpy)(3)] Inorganic Chemistry, 2000, 39, 3252-3260 |
| 6000499 | CIF | C45 H33 N9 O22 V9 | C 1 2/c 1 | 23.7735; 9.4309; 25.3804 90; 112.047; 90 | 5274.3 | Pamela J. Hagrman; Jon Zubieta Structural influences of organonitrogen ligands on vanadium oxide solids. Hydrothermal syntheses and structures of the terpyridine vanadates [V2O4(terpy)(2)](3)[V10O28], [VO2(terpy)][V4O10], and [V9O22(terpy)(3)] Inorganic Chemistry, 2000, 39, 3252-3260 |
| 6000500 | CIF | C12 H36 Ga4 N4 O30 P6 | P 1 21 1 | 8.0248; 25.9554; 9.0127 90; 100.151; 90 | 1847.8 | Kwang-Hwa Lii; Ching-Yeh Chen Synthesis and characterization of (R-C5H14N2)(2)[Ga-4(C2O4)(H2PO4)(2)(PO4)(4)].2H(2)O, a layered gallium phosphatooxalate containing a chiral amine Inorganic Chemistry, 2000, 39, 3374-3378 |
| 6000515 | CIF | H3 O12 P3 Rb2 Zn2 | P 1 21/c 1 | 12.588; 12.717; 7.5827 90; 96.1; 90 | 1207 | Torben R. Jensen; Rita G. Hazell; Thomas Vosegaard; Hans J. Jakobsen New rubidium zinc hydrogen phosphate, Rb2Zn2(HPO4)(3): Synthesis, crystal structure, and P-31 single-crystal nmr Inorganic Chemistry, 2000, 39, 2026-2032 |
| 6000540 | CIF | Cl3 O12 Yb | P 63/m | 9.2197; 9.2197; 5.5352 90; 90; 120 | 407.47 | Favier, F.; Pascal, J. L.; Cunin, F.; Fitch, A. N.; Vaughan, G. Thermal behavior and X-ray powder diffraction structures of two polymorphic phases of anhydrous Yb(ClO4)(3) Inorganic Chemistry, 1998, 37, 1776-1780 |
| 6000541 | CIF | Cl3 O12 Yb | R 3 c :H | 8.1241; 8.1241; 24.0818 90; 90; 120 | 1376.48 | Favier, F.; Pascal, J. L.; Cunin, F.; Fitch, A. N.; Vaughan, G. Thermal behavior and X-ray powder diffraction structures of two polymorphic phases of anhydrous Yb(ClO4)(3) Inorganic Chemistry, 1998, 37, 1776-1780 |
| 6000577 | CIF | Fe O4 P | P 1 21/n 1 | 5.4802; 7.4802; 8.0537 90; 95.708; 90 | 328.51 | Yanning Song; Peter Y. Zavalij; Masatsugu Suzuki; M. Stanley Whittingham New Iron(III) Phosphate Phases: Crystal Structure and Electrochemical and Magnetic Properties Inorganic Chemistry, 2002, 41, 5778-5786 |
| 6000578 | CIF | Fe O4 P | P b c a | 9.171; 9.456; 8.675 90; 90; 90 | 752.3 | Song, Y. N.; Zavalij, P. Y.; Suzuki, M.; Whittingham, M. S. New iron(III) phosphate phases: Crystal structure and electrochemical and magnetic properties Inorganic Chemistry, 2002, 41, 5778-5786 |
| 6000579 | CIF | C10 H8 Cu Mo N2 O4 | P b c a | 12.4823; 9.1699; 19.5647 90; 90; 90 | 2239.4 | Randy S. Rarig; Robert Lam; Peter Y. Zavalij; J. Katana Ngala; Robert L. LaDuca,; John E. Greedan; Jon Zubieta Ligand influences on copper molybdate networks: The structures and magnetism of [Cu(3,4 '-bpy)MoO4], [Cu(3,3 '-bpy)(0.5)MoO4], and [Cu(4,4 '-bpy)(0.5)MoO4].1.5H(2)O Inorganic Chemistry, 2002, 41, 2124-2133 |
| 6000580 | CIF | C5 H4 Cu Mo N O4 | P -1 | 5.4397; 6.813; 10.727 73.909; 78.839; 70.389 | 357.6 | Randy S. Rarig; Robert Lam; Peter Y. Zavalij; J. Katana Ngala; Robert L. LaDuca,; John E. Greedan; Jon Zubieta Ligand influences on copper molybdate networks: The structures and magnetism of [Cu(3,4 '-bpy)MoO4], [Cu(3,3 '-bpy)(0.5)MoO4], and [Cu(4,4 '-bpy)(0.5)MoO4].1.5H(2)O Inorganic Chemistry, 2002, 41, 2124-2133 |
| 6000611 | CIF | Ag0.43 H4 O7 P V | P -1 | 6.287; 6.283; 13.24 80.98; 86.58; 90 | 515.59 | Ayyappan, P.; Ramanan, A.; Torardi, C. C. New metal-intercalated layered vanadyl phosphates, MxVOPO4.yH(2)O (M = Ag, Cu, Zn) Inorganic Chemistry, 1998, 37, 3628-3634 |
| 6000612 | CIF | Cu0.16 H5 O7.5 P V | P -1 | 6.26; 6.249; 7.257 83.62; 73.99; 90.13 | 271.02 | Ayyappan, P.; Ramanan, A.; Torardi, C. C. New metal-intercalated layered vanadyl phosphates, MxVOPO4.yH(2)O (M = Ag, Cu, Zn) Inorganic Chemistry, 1998, 37, 3628-3634 |
| 6000613 | CIF | H5 O7.5 P V Zn0.11 | P -1 | 6.252; 6.248; 7.339 83.24; 73.93; 90 | 273.4 | Ayyappan, P.; Ramanan, A.; Torardi, C. C. New metal-intercalated layered vanadyl phosphates, MxVOPO4.yH(2)O (M = Ag, Cu, Zn) Inorganic Chemistry, 1998, 37, 3628-3634 |
| 6000616 | CIF | Cl4 W | C 1 2/m 1 | 11.782; 6.475; 8.062 90; 131.14; 90 | 463.19 | Kolesnichenko, V.; Swenson, D. C.; Messerle, L. Facile reduction of tungsten halides with nonconventional, mild reductants. I. Tungsten tetrachloride: Several convenient solid-state syntheses, a solution synthesis of highly reactive (WCl4)(x), and the molecular structure of polymeric tungsten tetrachloride Inorganic Chemistry, 1998, 37, 3257-3262 |
| 6000621 | CIF | Ba H3 Na Pd | P 63/m m c | 6.048; 6.048; 6.061 90; 90; 120 | 192 | Malin Olofsson; Mikael Kritikos; Dag Noréus The first trigonal planar transition metal-hydrogen complex in NaBaPdH3 Inorganic Chemistry, 1998, 37, 2900-2902 |
| 6000655 | CIF | H2 O8 P2 Zr | I 41 c d | 11.259; 11.259; 10.764 90; 90; 90 | 1364.5 | Andersen, A. M. K.; Norby, P.; Hanson, J. C.; Vogt, T. Preparation and characterization of a new 3-dimensional zirconium hydrogen phosphate, tau-Zr(HPO4)(2). Determination of the complete crystal structure combining synchrotron x-ray single-crystal diffraction and neutron powder diffraction Inorganic Chemistry, 1998, 37, 876-881 |
| 6000660 | CIF | Sc8 Te3 | C 1 2/m 1 | 28.842; 3.8517; 22.352 90; 122.51; 90 | 2093.99 | Maggard, P. A.; Corbett, J. D. The synthesis, structure, and bonding of Sc8Te3 and Y8Te3. Cooperative matrix and bonding effects in the solid state Inorganic Chemistry, 1998, 37, 814-820 |
| 6000661 | CIF | Te3 Y8 | C 1 2/m 1 | 31.153; 4.0703; 24.375 90; 122.8; 90 | 2598.03 | Maggard, P. A.; Corbett, J. D. The synthesis, structure, and bonding of Sc8Te3 and Y8Te3. Cooperative matrix and bonding effects in the solid state Inorganic Chemistry, 1998, 37, 814-820 |
| 6000664 | CIF | C2 H5 Cu O3 P | P 1 21/c 1 | 10.7773; 5.696; 7.6273 90; 94.47; 90 | 466.8 | Lebideau, J.; Bujoli, B.; Jouanneaux, A.; Payen, C.; Palvadeau, P.; Rouxel, J. Preparation and structure of CU-II(C2H5PO3) - structural transition between its hydrated and dehydrated forms Inorganic Chemistry, 1993, 32, 4617-4620 |
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