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NaNO3 Database

The document provides information about sodium nitrate including its name, empirical formula, crystallographic parameters, quality information, comments, references, and a peak list from its X-ray powder diffraction pattern.

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Erina Rizki Nugrahani
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66 views3 pages

NaNO3 Database

The document provides information about sodium nitrate including its name, empirical formula, crystallographic parameters, quality information, comments, references, and a peak list from its X-ray powder diffraction pattern.

Uploaded by

Erina Rizki Nugrahani
Copyright
© © All Rights Reserved
We take content rights seriously. If you suspect this is your content, claim it here.
Available Formats
Download as RTF, PDF, TXT or read online on Scribd
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Name and formula

Reference code: 01-079-2056

Compound name: Sodium Nitrate

Empirical formula: NNaO3


Chemical formula: NaNO3

Crystallographic parameters

Crystal system: Rhombohedral


Space group: R-3c
Space group number: 167

a (Å): 5.0722
b (Å): 5.0722
c (Å): 16.8346
Alpha (°): 90.0000
Beta (°): 90.0000
Gamma (°): 120.0000

Calculated density (g/cm^3): 2.26


Measured density (g/cm^3): 2.26
Volume of cell (10^6 pm^3): 375.08
Z: 6.00

RIR: 2.21

Subfiles and quality

Subfiles: ICSD Pattern


Inorganic
Quality: Calculated (C)

Comments

ICSD collection code: 067287


Creation Date: 1/1/1970
Modification Date: 1/1/1970
ICSD Collection Code: 067287
Temperature Factor: ATF
Calculated Pattern Original Remarks: REM RVP
Test from ICSD: At least one TF implausible
Additional Patterns: See PDF 72-25 and 85-1467. Correction for preferred orientation in
Rietveld refinement.
References

Primary reference: Calculated from ICSD using POWD-12++


Structure: Ahtee, M., Nurmela, M., Suortti, P., Jaervinen, M., J. Appl. Crystallogr.,
22, 261, (1989)

Peak list
No. h k l d [A] 2Theta[deg] I [%]
1 0 1 2 3.89427 22.817 4.4
2 1 0 4 3.03893 29.367 100.0
3 0 0 6 2.80577 31.869 13.2
4 1 1 0 2.53610 35.364 7.7
5 1 1 3 2.31104 38.940 24.2
6 2 0 2 2.12517 42.503 7.1
7 0 2 4 1.94713 46.608 3.2
8 0 1 8 1.89780 47.894 16.3
9 1 1 6 1.88143 48.337 8.3
10 2 1 1 1.65225 55.577 4.2
11 1 2 2 1.62888 56.446 4.2
12 1 0 10 1.57197 58.684 0.1
13 2 1 4 1.54444 59.836 1.8
14 2 0 8 1.51947 60.922 1.0
15 1 1 9 1.50535 61.555 2.6
16 1 2 5 1.48907 62.303 2.3
17 3 0 0 1.46422 63.482 3.3
18 0 0 12 1.40288 66.608 2.7
19 2 1 7 1.36631 68.635 1.2
20 0 2 10 1.33612 70.412 0.6
21 1 2 8 1.30343 72.453 0.9
22 2 2 0 1.26805 74.813 0.3
23 1 1 12 1.22758 77.731 0.8
24 3 1 2 1.20574 79.414 0.1
25 2 1 10 1.18210 81.330 0.7
26 1 3 4 1.17026 82.330 1.6
27 2 2 6 1.15552 83.614 0.6
28 3 1 5 1.14561 84.504 0.1
29 1 2 11 1.12528 86.399 0.4

Stick Pattern

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