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Information card for entry 4511735
Preview
| Coordinates | 4511735.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Cu,Mn-2mercaptonicotinic acid red |
|---|---|
| Formula | C18 H24 Cu3 Mn2 N3 O16 S3 |
| Calculated formula | C18 H24 Cu3 Mn2 N3 O16 S3 |
| Title of publication | Stepwise Crystallization: Illustrative Examples of the Use of Metalloligands [Cu6(mna)6]6‒and [Ag6(Hmna)2(mna)4]4‒(H2mna= 2-Mercapto Nicotinic Acid) in the Formation of Heterometallic Two- and Three-Dimensional Assemblies withbrucite,pcu, andsqlTopologies |
| Authors of publication | Kundu, Tanaya; Jana, Ajay Kumar; Natarajan, Srinivasan |
| Journal of publication | Crystal Growth & Design |
| Year of publication | 2014 |
| Journal volume | 14 |
| Journal issue | 9 |
| Pages of publication | 4531 |
| a | 12.3484 ± 0.0006 Å |
| b | 12.466 ± 0.0005 Å |
| c | 14.098 ± 0.0008 Å |
| α | 97.148 ± 0.004° |
| β | 108.384 ± 0.005° |
| γ | 119.315 ± 0.005° |
| Cell volume | 1690.7 ± 0.2 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 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 | 0.0382 |
| Residual factor for significantly intense reflections | 0.0338 |
| Weighted residual factors for significantly intense reflections | 0.0798 |
| Weighted residual factors for all reflections included in the refinement | 0.0829 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179664 (current) | 2016-03-24 | cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/17. |
4511735.cif |
| 122863 | 2014-09-06 | cif/ Updating files of 4511733, 4511734, 4511735, 4511736 Original log message: Adding full bibliography for 4511733--4511736.cif. |
4511735.cif |
| 121003 | 2014-08-01 | cif/ Adding structures of 4511733, 4511734, 4511735, 4511736 via cif-deposit CGI script. |
4511735.cif |
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