Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7212739
Preview
Coordinates | 7212739.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C16 H20 Au N4 Na O4 S6 |
---|---|
Calculated formula | C16 H20 Au N4 Na O4 S6 |
SMILES | [Na]([OH]C)([OH]C)([OH]C)([OH]C)[n](sn1)c2cc3c(cc12)S[Au]1(S3)Sc2c(S1)cc1c(c2)ns[n]1[Na]([OH]C)([OH]C)([OH]C)([OH]C)[n](sn1)c2cc3c(cc12)S[Au]1(S3)Sc2c(S1)cc1c(c2)nsn1 |
Title of publication | Dimensionality of coordination polymers decided by the type of hybridization of the central carbon atom of the solvent molecule that coordinates to an alkali metal cation: from discrete to 3D networks based on a gold(iii) bis(dithiolene) complex |
Authors of publication | Bolligarla, Ramababu; Das, Samar K. |
Journal of publication | CrystEngComm |
Year of publication | 2010 |
Journal volume | 12 |
Journal issue | 11 |
Pages of publication | 3409 |
a | 7.4087 ± 0.0005 Å |
b | 9.1583 ± 0.0006 Å |
c | 10.1717 ± 0.0007 Å |
α | 63.777 ± 0.001° |
β | 76.735 ± 0.001° |
γ | 86.033 ± 0.001° |
Cell volume | 602.2 ± 0.07 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0155 |
Residual factor for significantly intense reflections | 0.0155 |
Weighted residual factors for significantly intense reflections | 0.0401 |
Weighted residual factors for all reflections included in the refinement | 0.0401 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.125 |
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/7212739.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.