Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1508264
Preview
Coordinates | 1508264.cif |
---|---|
Original paper (by DOI) | HTML |
External links | ChemSpider |
Formula | C31 H24 N2 |
---|---|
Calculated formula | C31 H24 N2 |
SMILES | N(c1ccc(cc1)/C=C/c1cccc(c1)c1ncccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Photoluminescence and trans →cis photoisomerization of aminostyrene-conjugated phenylpyridine C^N ligands and their complexes with platinum(II): the styryl position and the amino substituent effects. |
Authors of publication | Lin, Che-Jen; Liu, Yi-Hung; Peng, Shie-Ming; Yang, Jye-Shane |
Journal of publication | The journal of physical chemistry. B |
Year of publication | 2012 |
Journal volume | 116 |
Journal issue | 28 |
Pages of publication | 8222 - 8232 |
a | 9.0927 ± 0.0002 Å |
b | 14.0793 ± 0.0004 Å |
c | 19.015 Å |
α | 111.408 ± 0.002° |
β | 91.151 ± 0.003° |
γ | 90.305 ± 0.002° |
Cell volume | 2265.66 ± 0.09 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 2 K |
Number of distinct elements | 3 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1174 |
Residual factor for significantly intense reflections | 0.0466 |
Weighted residual factors for significantly intense reflections | 0.0977 |
Weighted residual factors for all reflections included in the refinement | 0.1131 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.874 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
201954 (current) | 2017-10-13 | cif/ Marking COD entries in range 1 that are known to be related to ChemSpider entries using the _cod_related_entry data loop. |
1508264.cif |
176729 | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1508264.cif |
113437 | 2014-05-12 | cif/ Updating files of 1508264, 1508265 Original log message: Adding full bibliography for 1508264--1508265.cif. |
1508264.cif |
91932 | 2013-12-28 | cif/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the range 1 CIFs. |
1508264.cif |
66252 | 2012-09-09 | cif/ Adding structures of 1508264, 1508265 via cif-deposit CGI script. |
1508264.cif |
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.