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Information card for entry 4085125
Preview
Coordinates | 4085125.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C36 H53 Fe4 Ir N2 O12 |
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Calculated formula | C36 H53 Fe4 Ir N2 O12 |
Title of publication | [H3‒nFe4(CO)12(IrCOD)]n−(n= 1, 2) and [H2Fe3(CO)10(IrCOD)]−Bimetallic Fe‒Ir Hydride Carbonyl Clusters |
Authors of publication | Bortoluzzi, Marco; Ciabatti, Iacopo; Femoni, Cristina; Hayatifar, Mohammad; Iapalucci, Maria Carmela; Zacchini, Stefano |
Journal of publication | Organometallics |
Year of publication | 2015 |
Journal volume | 34 |
Journal issue | 1 |
Pages of publication | 189 |
a | 18.9215 ± 0.001 Å |
b | 18.9215 ± 0.001 Å |
c | 12.4689 ± 0.0006 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4464.2 ± 0.4 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 84 |
Hermann-Mauguin space group symbol | P 42/m |
Hall space group symbol | -P 4c |
Residual factor for all reflections | 0.0463 |
Residual factor for significantly intense reflections | 0.0363 |
Weighted residual factors for significantly intense reflections | 0.1 |
Weighted residual factors for all reflections included in the refinement | 0.1083 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.075 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
178740 (current) | 2016-03-21 | cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/51. |
4085125.cif |
130813 | 2015-02-04 | cif/ Updating files of 4085125, 4085126, 4085127 Original log message: Adding full bibliography for 4085125--4085127.cif. |
4085125.cif |
129251 | 2014-12-30 | cif/ Adding structures of 4085125, 4085126, 4085127 via cif-deposit CGI script. |
4085125.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
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.
Users of the data should acknowledge the original authors of the
structural data.