Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1573860
Preview
Coordinates | 1573860.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C15 H13 N O2 |
---|---|
Calculated formula | C15 H13 N O2 |
Title of publication | Non-Conjugated Alkyl Chains Engineering to Tune Condensed State Photophysical and Supramolecular Assembly Properties |
Authors of publication | Meher, Niranjan; Khatun, Mst Nasima; Parui, Retwik; Iyer, Parameswar K. |
Journal of publication | Nanoscale |
Year of publication | 2025 |
a | 9.3455 ± 0.0009 Å |
b | 6.8284 ± 0.0006 Å |
c | 19.0394 ± 0.0017 Å |
α | 90° |
β | 97.03 ± 0.003° |
γ | 90° |
Cell volume | 1205.86 ± 0.19 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0879 |
Residual factor for significantly intense reflections | 0.0599 |
Weighted residual factors for significantly intense reflections | 0.1612 |
Weighted residual factors for all reflections included in the refinement | 0.1911 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
297626 (current) | 2025-02-07 | cif/ Adding structures of 1573856, 1573857, 1573858, 1573859, 1573860, 1573861, 1573862 via cif-deposit CGI script. |
1573860.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.