Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7038409
Preview
Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 7038409.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C29 H29 N2 O2 Pt |
---|---|
Calculated formula | C29 H29 N2 O2 Pt |
SMILES | [Pt]123Oc4c(c5[n]1c(=Cc1c(CC)c(c(c6ccccc6O3)n21)CC)c(c5CC)CC)cccc4 |
Title of publication | Stable neutral radicals of planar N2O2-type dipyrrin platinum complexes: hybrid radicals of the delocalized organic π-orbital and platinum d-orbital. |
Authors of publication | Yamamura, M.; Takizawa, H.; Gobo, Y.; Nabeshima, T. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 16 |
Pages of publication | 6834 - 6838 |
a | 9.3473 ± 0.0004 Å |
b | 12.3349 ± 0.0005 Å |
c | 20.0843 ± 0.0008 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2315.68 ± 0.16 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 5 |
Space group number | 33 |
Hermann-Mauguin space group symbol | P n 21 a |
Hall space group symbol | P -2ac -2n |
Residual factor for all reflections | 0.0396 |
Residual factor for significantly intense reflections | 0.0319 |
Weighted residual factors for significantly intense reflections | 0.0727 |
Weighted residual factors for all reflections included in the refinement | 0.0763 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
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/7038409.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.