Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7205714
Preview
Coordinates | 7205714.cif |
---|---|
Original paper (by DOI) | HTML |
External links | ChemSpider |
Formula | C34 H55 N5 O8 |
---|---|
Calculated formula | C34 H55 N5 O8 |
SMILES | O(C)C(=O)C(NC(=O)[C@H](NC(=O)C(NC(=O)[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)CC(C)C)C(C)C)(C)C)Cc1ccccc1)(C)C |
Title of publication | Fabrication of nanoporous material from a hydrophobic peptide |
Authors of publication | Maity, Sibaprasad; Jana, Poulami; Haldar, Debasish |
Journal of publication | CrystEngComm |
Year of publication | 2011 |
Journal volume | 13 |
Journal issue | 8 |
Pages of publication | 3064 |
a | 10.9742 ± 0.0003 Å |
b | 11.196 ± 0.0003 Å |
c | 32.3795 ± 0.0009 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3978.38 ± 0.19 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 4 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.1031 |
Residual factor for significantly intense reflections | 0.0474 |
Weighted residual factors for significantly intense reflections | 0.1447 |
Weighted residual factors for all reflections included in the refinement | 0.2078 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.814 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
202017 (current) | 2017-10-14 | cif/ Marking COD entries in range 7 that are known to be related to ChemSpider entries using the _cod_related_entry data loop. |
7205714.cif |
180388 | 2016-03-26 | cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/57. |
7205714.cif |
120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7205714.cif |
35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7205714.cif |
31982 | 2012-01-03 | cif/ Removing the last asteriscs from author names, and adding _chemical_name_systematic tags to two entries where the substance name was attached to the author name loop, yielding a very strange co-author name :). |
7205714.cif |
20996 | 2011-06-21 | ../uploads/cif-deposit/cod/cif Adding structures of 7205714 via cif-deposit CGI script. |
7205714.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.