Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 8106396
Preview
Coordinates | 8106396.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | bis[(bis(1<i>H</i>-benzimidazol-2-amine)-κ^2^N,N')sulphate-κO- zinc(II)-methanol(1/1)] |
---|---|
Formula | C30 H36 N12 O10 S2 Zn2 |
Calculated formula | C30 H36 N12 O10 S2 Zn2 |
Title of publication | Crystal structure of tetrakis(1H-benzimidazol-2-amine)-κN)-bis(μ2-sulfonato-κ2 O:O′)dizinc(II) - methanol (1/1), C30H36N12O10S2Zn2 |
Authors of publication | Liu, Yan-Ju; Li, An-Wen; Xing, Chen; Tian, Xiao-Zhi |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2018 |
Journal volume | 233 |
Journal issue | 6 |
Pages of publication | 1053 - 1055 |
a | 22.77 ± 0.011 Å |
b | 12.482 ± 0.006 Å |
c | 14.098 ± 0.007 Å |
α | 90° |
β | 95.054 ± 0.008° |
γ | 90° |
Cell volume | 3991 ± 3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0585 |
Residual factor for significantly intense reflections | 0.039 |
Weighted residual factors for significantly intense reflections | 0.1006 |
Weighted residual factors for all reflections included in the refinement | 0.112 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.042 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/8106396.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.