Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1536448
Preview
Coordinates | 1536448.cif |
---|
Chemical name | Na3 (Fe (N H3) (C N)5) (H2 O)7 |
---|---|
Formula | C5 H17 Fe N6 Na3 O7 |
Calculated formula | C5 H17 Fe N6 Na3 O7 |
SMILES | C(#N)[Fe](C#[N])(C#N)(C#N)(C#N)[NH3].O.O.[Na+].O.[Na+].O.[Na+].O.O.O |
Title of publication | The crystal and molecular structure of sodium pentacyanoammineferrate(II) heptahydrate. Role of intermolecular hydrogen-bond interactions |
Authors of publication | Parise, A.R; Castellano, E.E.; Piro, O.E.; Olabe, J.A. |
Journal of publication | Inorganica Chimica Acta |
Year of publication | 2001 |
Journal volume | 319 |
Pages of publication | 199 - 202 |
a | 8.2719 Å |
b | 9.603 Å |
c | 11.3531 Å |
α | 92.01° |
β | 102.646° |
γ | 114.06° |
Cell volume | 795.644 Å3 |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
176429 (current) | 2016-02-13 | cif/ (antanas@kurmis) Replacing _cod_chemical_formula_sum_orig tag with _cod_original_formula_sum tag in multiple entries since the replaced tag is deprecated according to the COD CIF dictionary. |
1536448.cif |
164162 | 2015-10-10 | cif/ Adding structures of 1536448 via cif-deposit CGI script. |
1536448.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.