Supporting information
Crystallographic Information File (CIF) https://doi.org/10.1107/S2056989015006532/vn2090sup1.cif | |
Structure factor file (CIF format) https://doi.org/10.1107/S2056989015006532/vn2090Isup2.hkl |
CCDC reference: 1004334
Key indicators
- Single-crystal X-ray study
- T = 293 K
- Mean (O-N) = 0.008 Å
- R factor = 0.024
- wR factor = 0.062
- Data-to-parameter ratio = 8.8
checkCIF/PLATON results
No syntax errors found
Alert level B PLAT915_ALERT_3_B Low Friedel Pair Coverage ...................... 11 %
Alert level C PLAT090_ALERT_3_C Poor Data / Parameter Ratio (Zmax > 18) ........ 7.96 Note PLAT242_ALERT_2_C Low Ueq as Compared to Neighbors for ..... N1 Check PLAT242_ALERT_2_C Low Ueq as Compared to Neighbors for ..... N2 Check
Alert level G PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF Please Do ! PLAT042_ALERT_1_G Calc. and Reported MoietyFormula Strings Differ Please Check PLAT199_ALERT_1_G Reported _cell_measurement_temperature ..... (K) 293 Check PLAT200_ALERT_1_G Reported _diffrn_ambient_temperature ..... (K) 293 Check PLAT304_ALERT_4_G Non-Integer Number of Atoms ( 0.50) in Resd. # 4 Check PLAT304_ALERT_4_G Non-Integer Number of Atoms ( 0.50) in Resd. # 5 Check PLAT304_ALERT_4_G Non-Integer Number of Atoms ( 0.50) in Resd. # 6 Check
0 ALERT level A = Most likely a serious problem - resolve or explain 1 ALERT level B = A potentially serious problem, consider carefully 3 ALERT level C = Check. Ensure it is not caused by an omission or oversight 7 ALERT level G = General information/check it is not something unexpected 3 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 2 ALERT type 2 Indicator that the structure model may be wrong or deficient 2 ALERT type 3 Indicator that the structure quality may be low 3 ALERT type 4 Improvement, methodology, query or suggestion 1 ALERT type 5 Informative message, check
Data collection: CAD-4 EXPRESS (Duisenberg, 1992; Macíček & Yordanov, 1992); cell refinement: CAD-4 EXPRESS (Duisenberg, 1992; Macíček & Yordanov, 1992); data reduction: XCAD4 (Harms & Wocadlo, 1995); program(s) used to solve structure: SHELXS97 (Sheldrick, 2008); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008); molecular graphics: DIAMOND (Brandenburg, 2006); software used to prepare material for publication: WinGX (Farrugia, 2012) and publCIF (Westrip, 2010).
NaRb2(NO3)3 | F(000) = 356 |
Mr = 379.96 | Dx = 2.685 Mg m−3 |
Orthorhombic, Pmc21 | Mo Kα radiation, λ = 0.71073 Å |
Hall symbol: P 2c -2 | Cell parameters from 25 reflections |
a = 5.327 (5) Å | θ = 10–15° |
b = 9.079 (4) Å | µ = 10.50 mm−1 |
c = 9.718 (6) Å | T = 293 K |
V = 470.0 (6) Å3 | Parallelepiped, white |
Z = 2 | 0.4 × 0.4 × 0.3 mm |
Enraf–Nonius CAD-4 diffractometer | Rint = 0.038 |
Graphite monochromator | θmax = 28.0°, θmin = 2.2° |
ω/2θ scans | h = −7→7 |
Absorption correction: ψ scan (North et al., 1968) | k = −1→11 |
Tmin = 0.545, Tmax = 0.995 | l = −1→12 |
1474 measured reflections | 2 standard reflections every 120 reflections |
727 independent reflections | intensity decay: 4% |
662 reflections with I > 2σ(I) |
Refinement on F2 | w = 1/[σ2(Fo2) + (0.0532P)2] where P = (Fo2 + 2Fc2)/3 |
Least-squares matrix: full | (Δ/σ)max < 0.001 |
R[F2 > 2σ(F2)] = 0.024 | Δρmax = 0.59 e Å−3 |
wR(F2) = 0.062 | Δρmin = −0.56 e Å−3 |
S = 0.83 | Extinction correction: (SHELXL97; Sheldrick, 2008) |
727 reflections | Extinction coefficient: 0.036 (3) |
83 parameters | Absolute structure: Flack (1983), 63 paires de Friedel |
1 restraint | Absolute structure parameter: −0.009 (16) |
Geometry. All e.s.d.'s (except the e.s.d. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell e.s.d.'s are taken into account individually in the estimation of e.s.d.'s in distances, angles and torsion angles; correlations between e.s.d.'s in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell e.s.d.'s is used for estimating e.s.d.'s involving l.s. planes. |
x | y | z | Uiso*/Ueq | ||
Rb1 | 0.5 | 0.08278 (8) | 0.33461 (7) | 0.0293 (2) | |
Rb2 | 0.5 | 0.37837 (8) | 0.66067 (7) | 0.0312 (2) | |
Na1 | 0 | 0.7007 (3) | 0.6151 (3) | 0.0329 (8) | |
N1 | 1 | 0.0537 (7) | 0.6267 (7) | 0.0292 (15) | |
O1 | 1 | −0.0580 (6) | 0.7033 (7) | 0.0382 (14) | |
O2 | 0.7945 (12) | 0.1047 (6) | 0.5920 (7) | 0.0665 (17) | |
N2 | 0 | 0.4139 (7) | 0.4141 (8) | 0.0263 (14) | |
O3 | 0 | 0.4581 (7) | 0.5370 (6) | 0.0374 (14) | |
O4 | 0.2020 (10) | 0.3901 (5) | 0.3557 (7) | 0.0615 (16) | |
N3 | 0.5 | 0.2516 (6) | 0.9835 (7) | 0.0268 (13) | |
O5 | 0.5 | 0.2981 (6) | 1.1048 (6) | 0.0391 (14) | |
O6 | 0.7029 (8) | 0.2278 (5) | 0.9225 (5) | 0.0443 (11) |
U11 | U22 | U33 | U12 | U13 | U23 | |
Rb1 | 0.0286 (4) | 0.0330 (4) | 0.0263 (4) | 0 | 0 | 0.0045 (3) |
Rb2 | 0.0313 (4) | 0.0257 (3) | 0.0366 (4) | 0 | 0 | 0.0044 (3) |
Na1 | 0.0323 (15) | 0.0263 (15) | 0.0400 (19) | 0 | 0 | −0.0054 (13) |
N1 | 0.037 (3) | 0.022 (3) | 0.029 (4) | 0 | 0 | −0.006 (3) |
O1 | 0.045 (3) | 0.024 (2) | 0.046 (4) | 0 | 0 | 0.005 (2) |
O2 | 0.066 (3) | 0.067 (3) | 0.067 (4) | 0.032 (3) | −0.027 (3) | −0.006 (3) |
N2 | 0.027 (3) | 0.023 (3) | 0.030 (4) | 0 | 0 | −0.002 (3) |
O3 | 0.050 (4) | 0.033 (3) | 0.029 (3) | 0 | 0 | −0.006 (2) |
O4 | 0.053 (3) | 0.062 (3) | 0.069 (4) | 0.007 (2) | 0.032 (3) | 0.000 (3) |
N3 | 0.029 (3) | 0.027 (3) | 0.025 (3) | 0 | 0 | −0.002 (3) |
O5 | 0.057 (4) | 0.033 (3) | 0.027 (3) | 0 | 0 | −0.002 (3) |
O6 | 0.033 (2) | 0.059 (3) | 0.041 (3) | 0.003 (2) | 0.007 (2) | −0.007 (2) |
Rb1—O2 | 2.959 (6) | Na1—N3xii | 2.986 (4) |
Rb1—O2i | 2.959 (6) | Na1—N3vi | 2.986 (4) |
Rb1—O1ii | 2.962 (4) | Na1—Rb1viii | 3.938 (3) |
Rb1—O1iii | 2.962 (4) | Na1—Rb1xiii | 3.938 (3) |
Rb1—O5iv | 2.968 (6) | N1—O2 | 1.235 (6) |
Rb1—O6ii | 3.138 (5) | N1—O2xiv | 1.235 (6) |
Rb1—O6v | 3.138 (5) | N1—O1 | 1.258 (9) |
Rb1—O4i | 3.217 (5) | N1—Rb1xv | 3.565 (5) |
Rb1—O4 | 3.217 (5) | N1—Rb1xvi | 3.565 (5) |
Rb1—O2ii | 3.304 (7) | O1—Na1xvii | 2.352 (6) |
Rb1—O2v | 3.304 (7) | O1—Rb1xv | 2.962 (4) |
Rb1—N3ii | 3.363 (6) | O1—Rb1xvi | 2.962 (4) |
Rb2—O5vi | 2.988 (6) | O2—Rb1xvi | 3.304 (7) |
Rb2—O3vii | 3.010 (4) | N2—O4xviii | 1.236 (6) |
Rb2—O3 | 3.010 (4) | N2—O4 | 1.236 (6) |
Rb2—O2i | 3.014 (5) | N2—O3 | 1.259 (10) |
Rb2—O2 | 3.014 (5) | N2—Rb2xix | 3.597 (5) |
Rb2—O6 | 3.084 (5) | O3—Rb2xix | 3.010 (4) |
Rb2—O6i | 3.084 (5) | O4—Na1xii | 2.702 (7) |
Rb2—O4viii | 3.245 (5) | O4—Rb2vi | 3.245 (5) |
Rb2—O4ix | 3.245 (5) | N3—O6i | 1.252 (5) |
Rb2—N3 | 3.341 (7) | N3—O6 | 1.252 (5) |
Rb2—O4i | 3.364 (7) | N3—O5 | 1.252 (10) |
Rb2—O4 | 3.364 (7) | N3—Na1viii | 2.986 (4) |
Na1—O3 | 2.330 (6) | N3—Na1xiii | 2.986 (4) |
Na1—O1x | 2.352 (6) | N3—Rb1xvi | 3.363 (6) |
Na1—O6xi | 2.536 (5) | O5—Na1viii | 2.665 (3) |
Na1—O6vi | 2.536 (5) | O5—Na1xiii | 2.665 (3) |
Na1—O5xii | 2.665 (3) | O5—Rb1xx | 2.968 (6) |
Na1—O5vi | 2.665 (3) | O5—Rb2viii | 2.988 (6) |
Na1—O4ix | 2.702 (7) | O6—Na1viii | 2.536 (5) |
Na1—O4xiii | 2.702 (7) | O6—Rb1xvi | 3.138 (5) |
O2—Rb1—O2i | 64.0 (3) | O3—Na1—O5vi | 89.52 (14) |
O2—Rb1—O1ii | 147.78 (18) | O1x—Na1—O5vi | 90.56 (14) |
O2i—Rb1—O1ii | 83.83 (19) | O6xi—Na1—O5vi | 126.5 (2) |
O2—Rb1—O1iii | 83.83 (19) | O6vi—Na1—O5vi | 49.27 (16) |
O2i—Rb1—O1iii | 147.78 (18) | O5xii—Na1—O5vi | 175.6 (3) |
O1ii—Rb1—O1iii | 128.1 (2) | O3—Na1—O4ix | 89.6 (2) |
O2—Rb1—O5iv | 126.29 (15) | O1x—Na1—O4ix | 88.2 (2) |
O2i—Rb1—O5iv | 126.29 (15) | O6xi—Na1—O4ix | 164.85 (17) |
O1ii—Rb1—O5iv | 74.08 (13) | O6vi—Na1—O4ix | 117.92 (15) |
O1iii—Rb1—O5iv | 74.08 (13) | O5xii—Na1—O4ix | 115.6 (2) |
O2—Rb1—O6ii | 90.74 (14) | O5vi—Na1—O4ix | 68.66 (17) |
O2i—Rb1—O6ii | 69.38 (13) | O3—Na1—O4xiii | 89.6 (2) |
O1ii—Rb1—O6ii | 74.89 (14) | O1x—Na1—O4xiii | 88.2 (2) |
O1iii—Rb1—O6ii | 111.03 (13) | O6xi—Na1—O4xiii | 117.92 (15) |
O5iv—Rb1—O6ii | 142.79 (13) | O6vi—Na1—O4xiii | 164.85 (17) |
O2—Rb1—O6v | 69.38 (13) | O5xii—Na1—O4xiii | 68.66 (17) |
O2i—Rb1—O6v | 90.74 (14) | O5vi—Na1—O4xiii | 115.6 (2) |
O1ii—Rb1—O6v | 111.03 (13) | O4ix—Na1—O4xiii | 46.9 (2) |
O1iii—Rb1—O6v | 74.89 (14) | O3—Na1—N3xii | 89.85 (16) |
O5iv—Rb1—O6v | 142.79 (13) | O1x—Na1—N3xii | 91.21 (15) |
O6ii—Rb1—O6v | 40.29 (15) | O6xi—Na1—N3xii | 24.50 (15) |
O2—Rb1—O4i | 68.06 (15) | O6vi—Na1—N3xii | 101.72 (19) |
O2i—Rb1—O4i | 98.60 (16) | O5xii—Na1—N3xii | 24.77 (19) |
O1ii—Rb1—O4i | 122.48 (14) | O5vi—Na1—N3xii | 151.0 (2) |
O1iii—Rb1—O4i | 69.48 (15) | O4ix—Na1—N3xii | 140.35 (18) |
O5iv—Rb1—O4i | 58.44 (13) | O4xiii—Na1—N3xii | 93.42 (17) |
O6ii—Rb1—O4i | 158.76 (14) | O3—Na1—N3vi | 89.85 (16) |
O6v—Rb1—O4i | 126.31 (13) | O1x—Na1—N3vi | 91.21 (15) |
O2—Rb1—O4 | 98.60 (16) | O6xi—Na1—N3vi | 101.72 (19) |
O2i—Rb1—O4 | 68.06 (15) | O6vi—Na1—N3vi | 24.50 (15) |
O1ii—Rb1—O4 | 69.48 (15) | O5xii—Na1—N3vi | 151.0 (2) |
O1iii—Rb1—O4 | 122.48 (14) | O5vi—Na1—N3vi | 24.77 (19) |
O5iv—Rb1—O4 | 58.44 (13) | O4ix—Na1—N3vi | 93.42 (17) |
O6ii—Rb1—O4 | 126.31 (13) | O4xiii—Na1—N3vi | 140.35 (18) |
O6v—Rb1—O4 | 158.76 (14) | N3xii—Na1—N3vi | 126.2 (3) |
O4i—Rb1—O4 | 59.1 (2) | O3—Na1—Rb1viii | 130.42 (10) |
O2—Rb1—O2ii | 152.81 (8) | O1x—Na1—Rb1viii | 48.53 (8) |
O2i—Rb1—O2ii | 112.71 (17) | O6xi—Na1—Rb1viii | 133.97 (16) |
O1ii—Rb1—O2ii | 39.33 (14) | O6vi—Na1—Rb1viii | 81.38 (12) |
O1iii—Rb1—O2ii | 94.61 (15) | O5xii—Na1—Rb1viii | 133.96 (17) |
O5iv—Rb1—O2ii | 78.59 (14) | O5vi—Na1—Rb1viii | 48.89 (14) |
O6ii—Rb1—O2ii | 64.39 (14) | O4ix—Na1—Rb1viii | 54.16 (11) |
O6v—Rb1—O2ii | 83.97 (13) | O4xiii—Na1—Rb1viii | 87.31 (14) |
O4i—Rb1—O2ii | 136.59 (15) | N3xii—Na1—Rb1viii | 139.72 (15) |
O4—Rb1—O2ii | 104.94 (15) | N3vi—Na1—Rb1viii | 63.67 (13) |
O2—Rb1—O2v | 112.71 (17) | O3—Na1—Rb1xiii | 130.42 (10) |
O2i—Rb1—O2v | 152.81 (8) | O1x—Na1—Rb1xiii | 48.53 (8) |
O1ii—Rb1—O2v | 94.61 (15) | O6xi—Na1—Rb1xiii | 81.38 (12) |
O1iii—Rb1—O2v | 39.33 (14) | O6vi—Na1—Rb1xiii | 133.97 (15) |
O5iv—Rb1—O2v | 78.59 (14) | O5xii—Na1—Rb1xiii | 48.89 (14) |
O6ii—Rb1—O2v | 83.97 (13) | O5vi—Na1—Rb1xiii | 133.96 (17) |
O6v—Rb1—O2v | 64.39 (14) | O4ix—Na1—Rb1xiii | 87.31 (14) |
O4i—Rb1—O2v | 104.94 (15) | O4xiii—Na1—Rb1xiii | 54.16 (11) |
O4—Rb1—O2v | 136.59 (15) | N3xii—Na1—Rb1xiii | 63.67 (13) |
O2ii—Rb1—O2v | 56.70 (19) | N3vi—Na1—Rb1xiii | 139.72 (15) |
O2—Rb1—N3ii | 72.37 (15) | Rb1viii—Na1—Rb1xiii | 85.12 (9) |
O2i—Rb1—N3ii | 72.37 (15) | O2—N1—O2xiv | 124.8 (8) |
O1ii—Rb1—N3ii | 96.71 (12) | O2—N1—O1 | 117.6 (4) |
O1iii—Rb1—N3ii | 96.71 (12) | O2xiv—N1—O1 | 117.6 (4) |
O5iv—Rb1—N3ii | 156.66 (15) | O2—N1—Rb1xv | 161.2 (5) |
O6ii—Rb1—N3ii | 21.85 (9) | O2xiv—N1—Rb1xv | 67.9 (4) |
O6v—Rb1—N3ii | 21.85 (9) | O1—N1—Rb1xv | 52.02 (16) |
O4i—Rb1—N3ii | 139.09 (12) | O2—N1—Rb1xvi | 67.9 (4) |
O4—Rb1—N3ii | 139.09 (12) | O2xiv—N1—Rb1xvi | 161.2 (5) |
O2ii—Rb1—N3ii | 80.91 (15) | O1—N1—Rb1xvi | 52.02 (16) |
O2v—Rb1—N3ii | 80.91 (15) | Rb1xv—N1—Rb1xvi | 96.68 (18) |
O5vi—Rb2—O3vii | 72.01 (12) | N1—O1—Na1xvii | 122.4 (5) |
O5vi—Rb2—O3 | 72.01 (12) | N1—O1—Rb1xv | 108.42 (16) |
O3vii—Rb2—O3 | 124.4 (2) | Na1xvii—O1—Rb1xv | 94.95 (12) |
O5vi—Rb2—O2i | 140.40 (15) | N1—O1—Rb1xvi | 108.42 (16) |
O3vii—Rb2—O2i | 124.77 (16) | Na1xvii—O1—Rb1xvi | 94.95 (12) |
O3—Rb2—O2i | 69.46 (17) | Rb1xv—O1—Rb1xvi | 128.1 (2) |
O5vi—Rb2—O2 | 140.40 (15) | N1—O2—Rb1 | 132.5 (5) |
O3vii—Rb2—O2 | 69.46 (17) | N1—O2—Rb2 | 135.2 (5) |
O3—Rb2—O2 | 124.77 (16) | Rb1—O2—Rb2 | 88.08 (14) |
O2i—Rb2—O2 | 62.7 (2) | N1—O2—Rb1xvi | 91.9 (4) |
O5vi—Rb2—O6 | 125.87 (14) | Rb1—O2—Rb1xvi | 108.5 (2) |
O3vii—Rb2—O6 | 97.23 (14) | Rb2—O2—Rb1xvi | 91.11 (18) |
O3—Rb2—O6 | 138.26 (14) | O4xviii—N2—O4 | 121.1 (9) |
O2i—Rb2—O6 | 89.98 (15) | O4xviii—N2—O3 | 119.4 (4) |
O2—Rb2—O6 | 68.58 (15) | O4—N2—O3 | 119.4 (4) |
O5vi—Rb2—O6i | 125.87 (14) | O4xviii—N2—Rb2 | 159.2 (5) |
O3vii—Rb2—O6i | 138.26 (13) | O4—N2—Rb2 | 69.2 (4) |
O3—Rb2—O6i | 97.23 (14) | O3—N2—Rb2 | 52.92 (18) |
O2i—Rb2—O6i | 68.58 (15) | O4xviii—N2—Rb2xix | 69.2 (4) |
O2—Rb2—O6i | 89.98 (15) | O4—N2—Rb2xix | 159.3 (5) |
O6—Rb2—O6i | 41.04 (16) | O3—N2—Rb2xix | 52.92 (18) |
O5vi—Rb2—O4viii | 57.95 (13) | Rb2—N2—Rb2xix | 95.54 (18) |
O3vii—Rb2—O4viii | 69.19 (16) | N2—O3—Na1 | 127.6 (5) |
O3—Rb2—O4viii | 120.69 (15) | N2—O3—Rb2 | 107.6 (2) |
O2i—Rb2—O4viii | 156.66 (17) | Na1—O3—Rb2 | 95.57 (15) |
O2—Rb2—O4viii | 114.13 (14) | N2—O3—Rb2xix | 107.6 (2) |
O6—Rb2—O4viii | 68.52 (13) | Na1—O3—Rb2xix | 95.57 (15) |
O6i—Rb2—O4viii | 88.67 (15) | Rb2—O3—Rb2xix | 124.4 (2) |
O5vi—Rb2—O4ix | 57.95 (13) | N2—O4—Na1xii | 96.0 (5) |
O3vii—Rb2—O4ix | 120.69 (15) | N2—O4—Rb1 | 127.6 (4) |
O3—Rb2—O4ix | 69.19 (16) | Na1xii—O4—Rb1 | 82.92 (15) |
O2i—Rb2—O4ix | 114.13 (14) | N2—O4—Rb2vi | 125.5 (4) |
O2—Rb2—O4ix | 156.66 (17) | Na1xii—O4—Rb2vi | 83.53 (17) |
O6—Rb2—O4ix | 88.67 (15) | Rb1—O4—Rb2vi | 106.46 (15) |
O6i—Rb2—O4ix | 68.52 (13) | N2—O4—Rb2 | 90.7 (4) |
O4viii—Rb2—O4ix | 58.6 (2) | Na1xii—O4—Rb2 | 160.12 (19) |
O5vi—Rb2—N3 | 120.62 (15) | Rb1—O4—Rb2 | 78.21 (13) |
O3vii—Rb2—N3 | 117.24 (11) | Rb2vi—O4—Rb2 | 107.71 (17) |
O3—Rb2—N3 | 117.24 (11) | O6i—N3—O6 | 119.5 (7) |
O2i—Rb2—N3 | 85.64 (15) | O6i—N3—O5 | 120.3 (3) |
O2—Rb2—N3 | 85.64 (15) | O6—N3—O5 | 120.3 (3) |
O6—Rb2—N3 | 22.00 (9) | O6i—N3—Na1viii | 176.6 (4) |
O6i—Rb2—N3 | 22.00 (9) | O6—N3—Na1viii | 57.2 (3) |
O4viii—Rb2—N3 | 71.02 (15) | O5—N3—Na1viii | 63.11 (13) |
O4ix—Rb2—N3 | 71.02 (14) | O6i—N3—Na1xiii | 57.2 (3) |
O5vi—Rb2—O4i | 78.96 (13) | O6—N3—Na1xiii | 176.6 (4) |
O3vii—Rb2—O4i | 39.02 (14) | O5—N3—Na1xiii | 63.11 (13) |
O3—Rb2—O4i | 93.33 (15) | Na1viii—N3—Na1xiii | 126.2 (3) |
O2i—Rb2—O4i | 94.40 (14) | O6i—N3—Rb2 | 67.3 (4) |
O2—Rb2—O4i | 65.50 (16) | O6—N3—Rb2 | 67.3 (4) |
O6—Rb2—O4i | 125.14 (12) | O5—N3—Rb2 | 140.2 (4) |
O6i—Rb2—O4i | 155.01 (12) | Na1viii—N3—Rb2 | 110.63 (14) |
O4viii—Rb2—O4i | 105.26 (15) | Na1xiii—N3—Rb2 | 110.63 (14) |
O4ix—Rb2—O4i | 136.46 (9) | O6i—N3—Rb1xvi | 68.9 (3) |
N3—Rb2—O4i | 146.94 (11) | O6—N3—Rb1xvi | 68.9 (3) |
O5vi—Rb2—O4 | 78.96 (13) | O5—N3—Rb1xvi | 135.1 (5) |
O3vii—Rb2—O4 | 93.33 (15) | Na1viii—N3—Rb1xvi | 108.37 (13) |
O3—Rb2—O4 | 39.02 (14) | Na1xiii—N3—Rb1xvi | 108.37 (13) |
O2i—Rb2—O4 | 65.50 (16) | Rb2—N3—Rb1xvi | 84.67 (16) |
O2—Rb2—O4 | 94.40 (14) | N3—O5—Na1viii | 92.12 (15) |
O6—Rb2—O4 | 155.01 (12) | N3—O5—Na1xiii | 92.12 (15) |
O6i—Rb2—O4 | 125.14 (12) | Na1viii—O5—Na1xiii | 175.6 (3) |
O4viii—Rb2—O4 | 136.46 (9) | N3—O5—Rb1xx | 119.1 (4) |
O4ix—Rb2—O4 | 105.26 (14) | Na1viii—O5—Rb1xx | 88.53 (15) |
N3—Rb2—O4 | 146.94 (11) | Na1xiii—O5—Rb1xx | 88.53 (15) |
O4i—Rb2—O4 | 56.31 (18) | N3—O5—Rb2viii | 120.2 (5) |
O3—Na1—O1x | 177.7 (3) | Na1viii—O5—Rb2viii | 89.37 (14) |
O3—Na1—O6xi | 90.1 (2) | Na1xiii—O5—Rb2viii | 89.37 (14) |
O1x—Na1—O6xi | 91.76 (19) | Rb1xx—O5—Rb2viii | 120.7 (2) |
O3—Na1—O6vi | 90.1 (2) | N3—O6—Na1viii | 98.3 (4) |
O1x—Na1—O6vi | 91.76 (19) | N3—O6—Rb2 | 90.7 (4) |
O6xi—Na1—O6vi | 77.2 (2) | Na1viii—O6—Rb2 | 135.6 (2) |
O3—Na1—O5xii | 89.52 (14) | N3—O6—Rb1xvi | 89.2 (4) |
O1x—Na1—O5xii | 90.56 (14) | Na1viii—O6—Rb1xvi | 130.22 (19) |
O6xi—Na1—O5xii | 49.27 (16) | Rb2—O6—Rb1xvi | 93.04 (12) |
O6vi—Na1—O5xii | 126.5 (2) |
Symmetry codes: (i) −x+1, y, z; (ii) −x+1, −y, z−1/2; (iii) −x+2, −y, z−1/2; (iv) x, y, z−1; (v) x, −y, z−1/2; (vi) −x+1, −y+1, z−1/2; (vii) x+1, y, z; (viii) −x+1, −y+1, z+1/2; (ix) x, −y+1, z+1/2; (x) x−1, y+1, z; (xi) x−1, −y+1, z−1/2; (xii) −x, −y+1, z−1/2; (xiii) −x, −y+1, z+1/2; (xiv) −x+2, y, z; (xv) −x+2, −y, z+1/2; (xvi) −x+1, −y, z+1/2; (xvii) x+1, y−1, z; (xviii) −x, y, z; (xix) x−1, y, z; (xx) x, y, z+1. |