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Information card for entry 1558619
Preview
Coordinates | 1558619.cif |
---|---|
Structure factors | 1558619.hkl |
Original IUCr paper | HTML |
Common name | Os3(CO)8(PTA)4 |
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Chemical name | 1,1,2,2,2,3,3,3-Octacarbonyl-1,1,2,3-tetrakis(1,3,5-triaza-7-phosphatricyclo[3.3.1.1^3,7^]decane-κ<i>P</i>)-<i>triangulo</i>-triosmium(0) |
Formula | C32 H48 N12 O8 Os3 P4 |
Calculated formula | C32 H48 N12 O8 Os3 P4 |
Title of publication | 1,1,2,2,2,3,3,3-Octacarbonyl-1,1,2,3-tetrakis(1,3,5-triaza-7-phosphatricyclo[3.3.1.1^3,7^]decane-κ<i>P</i>)-<i>triangulo</i>-triosmium(0) |
Authors of publication | Marolf, David M.; Brehm, Kristen L.; Lynch, Vincent M.; Powell, Gregory L. |
Journal of publication | IUCrData |
Year of publication | 2020 |
Journal volume | 5 |
Journal issue | 7 |
Pages of publication | x200935 |
a | 18.75 ± 0.0002 Å |
b | 15.8889 ± 0.0002 Å |
c | 27.5984 ± 0.0003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 8222.03 ± 0.16 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.039 |
Residual factor for significantly intense reflections | 0.0321 |
Weighted residual factors for significantly intense reflections | 0.0743 |
Weighted residual factors for all reflections included in the refinement | 0.0761 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.141 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | Yes |
Revision | Date | Message | Files |
---|---|---|---|
254397 (current) | 2020-07-18 | cif/ hkl/ Adding structures of 1558619 via cif-deposit CGI script. |
1558619.cif 1558619.hkl |
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Users of the data should acknowledge the original authors of the
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