Crystallography Open Database
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Result: there are 354 entries in the selection
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Searching journal of publication like 'Crystals'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1571384 | CIF | C5 H6 Cl2 Cu N4 | P 1 21/n 1 | 8.4622; 10.6392; 9.6678 90; 99.036; 90 | 859.6 | Yamba, Zaina; Peoble, Anna; Novikov, Egor; Castañeda, Raúl; Timofeeva, Tatiana Interplay of Isomorphs and Polymorphs of Amidino-Copper(II) Complexes with Different Halides Crystals, 2024, 14, 319 |
| 1571385 | CIF | C33 H27 F4 Ir N4 O4.25 | P -1 | 12.0056; 13.9227; 21.5251 84.548; 81.768; 87.722 | 3543.5 | Stumbo, Emily E.; Hodge, Emarald K.; Williams, Matthew; Thornton, Diana A.; McMillen, Colin D.; Pienkos, Jared A. Synthesis and Crystallographic Characterization of Heteroleptic Ir(III) Complexes Containing the N-oxide Functional Group and Crystallographic Characterization of Ir(III) N-oxide Precursors Crystals, 2024, 14, 281 |
| 1571386 | CIF | C28.5 H19 Cl F4 Ir N4 O2.5 | P 1 21/c 1 | 20.1167; 16.8038; 17.1342 90; 107.127; 90 | 5535.1 | Stumbo, Emily E.; Hodge, Emarald K.; Williams, Matthew; Thornton, Diana A.; McMillen, Colin D.; Pienkos, Jared A. Synthesis and Crystallographic Characterization of Heteroleptic Ir(III) Complexes Containing the N-oxide Functional Group and Crystallographic Characterization of Ir(III) N-oxide Precursors Crystals, 2024, 14, 281 |
| 1571387 | CIF | C30 H25 Cl4 Ir N4 O3 | P 1 21 1 | 9.3656; 16.9853; 9.5139 90; 91.2046; 90 | 1513.11 | Stumbo, Emily E.; Hodge, Emarald K.; Williams, Matthew; Thornton, Diana A.; McMillen, Colin D.; Pienkos, Jared A. Synthesis and Crystallographic Characterization of Heteroleptic Ir(III) Complexes Containing the N-oxide Functional Group and Crystallographic Characterization of Ir(III) N-oxide Precursors Crystals, 2024, 14, 281 |
| 1571388 | CIF | C30 H25 Cl4 Ir N4 O2 | P 1 21 1 | 9.3682; 16.9395; 9.4088 90; 91.347; 90 | 1492.69 | Stumbo, Emily E.; Hodge, Emarald K.; Williams, Matthew; Thornton, Diana A.; McMillen, Colin D.; Pienkos, Jared A. Synthesis and Crystallographic Characterization of Heteroleptic Ir(III) Complexes Containing the N-oxide Functional Group and Crystallographic Characterization of Ir(III) N-oxide Precursors Crystals, 2024, 14, 281 |
| 1571389 | CIF | C27 H15 F4 Ir N4 O2 | P -1 | 8.815; 12.0339; 22.3146 87.528; 79.542; 89.854 | 2325.6 | Stumbo, Emily E.; Hodge, Emarald K.; Williams, Matthew; Thornton, Diana A.; McMillen, Colin D.; Pienkos, Jared A. Synthesis and Crystallographic Characterization of Heteroleptic Ir(III) Complexes Containing the N-oxide Functional Group and Crystallographic Characterization of Ir(III) N-oxide Precursors Crystals, 2024, 14, 281 |
| 1571390 | CIF | C31 H20 Cl2 F10 Ir N6 P | P 1 21/c 1 | 9.6985; 24.7164; 13.7261 90; 93.775; 90 | 3283.2 | Stumbo, Emily E.; Hodge, Emarald K.; Williams, Matthew; Thornton, Diana A.; McMillen, Colin D.; Pienkos, Jared A. Synthesis and Crystallographic Characterization of Heteroleptic Ir(III) Complexes Containing the N-oxide Functional Group and Crystallographic Characterization of Ir(III) N-oxide Precursors Crystals, 2024, 14, 281 |
| 1571391 | CIF | C32.5 H24 Cl F10 Ir N6 O0.5 P | P -1 | 13.8002; 14.3504; 17.3147 72.193; 89.145; 89.584 | 3264.3 | Stumbo, Emily E.; Hodge, Emarald K.; Williams, Matthew; Thornton, Diana A.; McMillen, Colin D.; Pienkos, Jared A. Synthesis and Crystallographic Characterization of Heteroleptic Ir(III) Complexes Containing the N-oxide Functional Group and Crystallographic Characterization of Ir(III) N-oxide Precursors Crystals, 2024, 14, 281 |
| 1571392 | CIF | C37 H32 Cl2 F10 Ir N6 P | P -1 | 8.6227; 13.5061; 16.6738 104.272; 94.651; 90.132 | 1875.2 | Stumbo, Emily E.; Hodge, Emarald K.; Williams, Matthew; Thornton, Diana A.; McMillen, Colin D.; Pienkos, Jared A. Synthesis and Crystallographic Characterization of Heteroleptic Ir(III) Complexes Containing the N-oxide Functional Group and Crystallographic Characterization of Ir(III) N-oxide Precursors Crystals, 2024, 14, 281 |
| 1571393 | CIF | C30 H22 F6 Ir N6 P | P b c a | 10.8324; 16.0987; 31.5748 90; 90; 90 | 5506.3 | Stumbo, Emily E.; Hodge, Emarald K.; Williams, Matthew; Thornton, Diana A.; McMillen, Colin D.; Pienkos, Jared A. Synthesis and Crystallographic Characterization of Heteroleptic Ir(III) Complexes Containing the N-oxide Functional Group and Crystallographic Characterization of Ir(III) N-oxide Precursors Crystals, 2024, 14, 281 |
| 1571551 | CIF | C90 H80 Cl6 Mn3 N18 O46 | P 1 21/n 1 | 21.266; 19.1361; 25.447 90; 90.517; 90 | 10355.2 | Castro, Jesús; Ferraro, Valentina; Bortoluzzi, Marco Further Insight into the Manganese(II) 2,2′-Bipyridine-1,1′-dioxide Homoleptic Complex: Single-Crystal X-ray Structure Determination of the Perchlorate Salt and DFT Calculations Crystals, 2024, 14, 422 |
| 1571552 | CIF | C90 H80 Cl6 Mn3 N18 O46 | P 1 21/n 1 | 21.302; 19.101; 25.487 90; 90.354; 90 | 10370 | Castro, Jesús; Ferraro, Valentina; Bortoluzzi, Marco Further Insight into the Manganese(II) 2,2′-Bipyridine-1,1′-dioxide Homoleptic Complex: Single-Crystal X-ray Structure Determination of the Perchlorate Salt and DFT Calculations Crystals, 2024, 14, 422 |
| 3000098 | CIF | B2 Ba O4 | R 3 c :H | 12.5269; 12.5269; 12.7181 90; 90; 120 | 1728.38 | Bubnova, Rimma; Volkov, Sergey; Barbara Albert; Filatov, Stanislav Borates‒Crystal Structures of Prospective Nonlinear Optical Materials: High Anisotropy of the Thermal Expansion Caused by Anharmonic Atomic Vibrations Crystals, 2017, 7, 93 |
| 3000099 | CIF | B2 Ba O4 | R 3 c :H | 12.5517; 12.5517; 12.985 90; 90; 120 | 1771.6 | Bubnova, Rimma; Volkov, Sergey; Barbara Albert; Filatov, Stanislav Borates‒Crystal Structures of Prospective Nonlinear Optical Materials: High Anisotropy of the Thermal Expansion Caused by Anharmonic Atomic Vibrations Crystals, 2017, 7, 93 |
| 3000100 | CIF | B2 Ba O4 | R 3 c :H | 12.5806; 12.5806; 12.7947 90; 90; 120 | 1753.7 | Bubnova, Rimma; Volkov, Sergey; Barbara Albert; Filatov, Stanislav Borates‒Crystal Structures of Prospective Nonlinear Optical Materials: High Anisotropy of the Thermal Expansion Caused by Anharmonic Atomic Vibrations Crystals, 2017, 7, 93 |
| 3000101 | CIF | B2 Ba O4 | R 3 c :H | 12.5685; 12.5685; 12.7714 90; 90; 120 | 1747.2 | Bubnova, Rimma; Volkov, Sergey; Barbara Albert; Filatov, Stanislav Borates‒Crystal Structures of Prospective Nonlinear Optical Materials: High Anisotropy of the Thermal Expansion Caused by Anharmonic Atomic Vibrations Crystals, 2017, 7, 93 |
| 3000102 | CIF | B2 Ba O4 | R 3 c :H | 12.582; 12.582; 12.7519 90; 90; 120 | 1748.3 | Bubnova, Rimma; Volkov, Sergey; Barbara Albert; Filatov, Stanislav Borates‒Crystal Structures of Prospective Nonlinear Optical Materials: High Anisotropy of the Thermal Expansion Caused by Anharmonic Atomic Vibrations Crystals, 2017, 7, 93 |
| 3000103 | CIF | B2 Ba O4 | R 3 c :H | 12.5828; 12.5828; 12.7291 90; 90; 120 | 1745.4 | Bubnova, Rimma; Volkov, Sergey; Barbara Albert; Filatov, Stanislav Borates‒Crystal Structures of Prospective Nonlinear Optical Materials: High Anisotropy of the Thermal Expansion Caused by Anharmonic Atomic Vibrations Crystals, 2017, 7, 93 |
| 3000104 | CIF | B2 Ba O4 | R 3 c :H | 12.5868; 12.5868; 12.709 90; 90; 120 | 1743.7 | Bubnova, Rimma; Volkov, Sergey; Barbara Albert; Filatov, Stanislav Borates‒Crystal Structures of Prospective Nonlinear Optical Materials: High Anisotropy of the Thermal Expansion Caused by Anharmonic Atomic Vibrations Crystals, 2017, 7, 93 |
| 3000105 | CIF | B2 Ba O4 | R 3 c :H | 12.5761; 12.5761; 12.6453 90; 90; 120 | 1732.02 | Bubnova, Rimma; Volkov, Sergey; Barbara Albert; Filatov, Stanislav Borates‒Crystal Structures of Prospective Nonlinear Optical Materials: High Anisotropy of the Thermal Expansion Caused by Anharmonic Atomic Vibrations Crystals, 2017, 7, 93 |
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