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Information card for entry 4130253
Preview
Coordinates | 4130253.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C28 H35 Fe0.5 N4.5 |
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Calculated formula | C28 H35 Fe0.5 N4.5 |
Title of publication | Spin-Crossover in a Pseudo-tetrahedral Bis(formazanate) Iron Complex. |
Authors of publication | Travieso-Puente, Raquel; Broekman, J. O. P.; Chang, Mu-Chieh; Demeshko, Serhiy; Meyer, Franc; Otten, Edwin |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2016 |
Journal volume | 138 |
Journal issue | 17 |
Pages of publication | 5503 - 5506 |
a | 12.1244 ± 0.0007 Å |
b | 14.1187 ± 0.0008 Å |
c | 18.1921 ± 0.001 Å |
α | 90° |
β | 93.083 ± 0.002° |
γ | 90° |
Cell volume | 3109.6 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 13 |
Hermann-Mauguin space group symbol | P 1 2/n 1 |
Hall space group symbol | -P 2yac |
Residual factor for all reflections | 0.077 |
Residual factor for significantly intense reflections | 0.0625 |
Weighted residual factors for significantly intense reflections | 0.1405 |
Weighted residual factors for all reflections included in the refinement | 0.1496 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.132 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4130253.html
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structural data.