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Information card for entry 2235180
Preview
Coordinates | 2235180.cif |
---|---|
Structure factors | 2235180.hkl |
Original IUCr paper | HTML |
Chemical name | Bis[<i>trans</i>-dichloridobis(propane-1,3-diamine- κ^2^<i>N</i>,<i>N</i>')chromium(III)] tetrachloridozincate |
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Formula | C12 H40 Cl8 Cr2 N8 Zn |
Calculated formula | C12 H40 Cl8 Cr2 N8 Zn |
SMILES | C1CC[NH2][Cr]2([NH2]1)(Cl)([NH2]CCC[NH2]2)Cl.[Cl-][Zn](Cl)(Cl)[Cl-].C1CC[NH2][Cr]2([NH2]1)([NH2]CCC[NH2]2)(Cl)Cl |
Title of publication | Bis[<i>trans</i>-dichloridobis(propane-1,3-diamine-κ^2^<i>N</i>,<i>N</i>')chromium(III)] tetrachloridozincate determined using synchrotron radiation |
Authors of publication | Moon, Dohyun; Subhan, Md Abdus; Choi, Jong-Ha |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2012 |
Journal volume | 68 |
Journal issue | 6 |
Pages of publication | m832 |
a | 15.141 ± 0.002 Å |
b | 15.141 ± 0.002 Å |
c | 6.422 ± 0.0013 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1472.2 ± 0.4 Å3 |
Cell temperature | 95 ± 2 K |
Ambient diffraction temperature | 95 ± 2 K |
Number of distinct elements | 6 |
Space group number | 86 |
Hermann-Mauguin space group symbol | P 42/n :2 |
Hall space group symbol | -P 4bc |
Residual factor for all reflections | 0.0678 |
Residual factor for significantly intense reflections | 0.0656 |
Weighted residual factors for significantly intense reflections | 0.1952 |
Weighted residual factors for all reflections included in the refinement | 0.1977 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.105 |
Diffraction radiation wavelength | 0.9 Å |
Diffraction radiation type | synchrotron |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2235180.html
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