Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2221615
Preview
Coordinates | 2221615.cif |
---|---|
Structure factors | 2221615.hkl |
Original IUCr paper | HTML |
Common name | Guanidine mercury iodid |
---|---|
Chemical name | Bis(guanidinium) tetraiodidomercurate(II) |
Formula | C2 H12 Hg I4 N6 |
Calculated formula | C2 H12 Hg I4 N6 |
SMILES | C(=[NH2+])(N)N.C(=[NH2+])(N)N.I[Hg](I)([I-])[I-] |
Title of publication | Bis(guanidinium) tetraiodidomercurate(II) |
Authors of publication | Terao, Hiromitsu; Gesing, Thorsten M.; Ishihara, Hideta; Furukawa, Yoshihiro; Gowda, B. Thimme |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2009 |
Journal volume | 65 |
Journal issue | 5 |
Pages of publication | m503 |
a | 8.981 ± 0.002 Å |
b | 8.996 ± 0.002 Å |
c | 12.302 ± 0.003 Å |
α | 105.8 ± 0.03° |
β | 95.79 ± 0.04° |
γ | 118.46 ± 0.02° |
Cell volume | 808.9 ± 0.5 Å3 |
Cell temperature | 298 K |
Ambient diffraction temperature | 298 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0984 |
Residual factor for significantly intense reflections | 0.0587 |
Weighted residual factors for all reflections | 0.0699 |
Weighted residual factors for significantly intense reflections | 0.1485 |
Weighted residual factors for all reflections included in the refinement | 0.1353 |
Goodness-of-fit parameter for all reflections | 0.81 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
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/2221615.html
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.