Buy article online - an online subscription or single-article purchase is required to access this article.
Download citation
Download citation
link to html
A new inorganic-organic hybrid, bis(utane-1,4-diammonium) bis(hydrogenphosphato)­penta­molybdate monohydrate, (C4H14N2)2[Mo5O15(H2PO4)2]·H2O, has been determined. The structure contains the molecular ion [Mo5O15(HPO4)2]4- built of an Mo5 oxo-anion ring capped by two protonated PO4 tetrahedra linked by means of edge and corner sharing. A complex hydrogen-bonding network involving interactions between the organic counter-cation sand inorganic anions is observed.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536805001856/ac6148sup1.cif
Contains datablocks global, I

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S1600536805001856/ac6148Isup2.hkl
Contains datablock I

CCDC reference: 269353

Key indicators

  • Single-crystal X-ray study
  • T = 273 K
  • Mean [sigma](C-C) = 0.005 Å
  • R factor = 0.027
  • wR factor = 0.075
  • Data-to-parameter ratio = 12.8

checkCIF/PLATON results

No syntax errors found



Alert level B PLAT420_ALERT_2_B D-H Without Acceptor O1W - H2W ... ?
0 ALERT level A = In general: serious problem 1 ALERT level B = Potentially serious problem 0 ALERT level C = Check and explain 0 ALERT level G = General alerts; check 0 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 1 ALERT type 2 Indicator that the structure model may be wrong or deficient 0 ALERT type 3 Indicator that the structure quality may be low 0 ALERT type 4 Improvement, methodology, query or suggestion

Computing details top

Data collection: SMART (Bruker, 1997); cell refinement: SMART; data reduction: SAINT (Bruker, 1997); program(s) used to solve structure: SHELXS97 (Sheldrick, 1990); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: SHELXTL (Bruker, 1998) and Diamond (Klaus, 1999); software used to prepare material for publication: SHELXTL.

bis(butane-1,4-diammonium) bis(hydrogenphosphato)pentamolybdate monohydrate, top
Crystal data top
(C4H14N2)2[Mo5O15(H2PO4)2]·H2OF(000) = 4320
Mr = 1110.02Dx = 2.554 Mg m3
Orthorhombic, PbcaMo Kα radiation, λ = 0.71073 Å
Hall symbol: -P 2ac 2abCell parameters from 8918 reflections
a = 19.4776 (16) Åθ = 2.4–28.3°
b = 14.0453 (11) ŵ = 2.33 mm1
c = 21.1035 (17) ÅT = 273 K
V = 5773.3 (8) Å3Block, colorless
Z = 80.35 × 0.20 × 0.12 mm
Data collection top
Bruker SMART CCD area-detector
diffractometer
5372 independent reflections
Radiation source: fine-focus sealed tube5289 reflections with I > 2σ(I)
Graphite monochromatorRint = 0.067
φ and ω scansθmax = 25.5°, θmin = 2.0°
Absorption correction: multi-scan
(SADABS; Bruker, 2000)
h = 2323
Tmin = 0.571, Tmax = 0.752k = 1617
41302 measured reflectionsl = 2525
Refinement top
Refinement on F2Primary atom site location: structure-invariant direct methods
Least-squares matrix: fullSecondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.027Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.075H-atom parameters constrained
S = 1.28 w = 1/[σ2(Fo2) + (0.0372P)2 + 6.1694P]
where P = (Fo2 + 2Fc2)/3
5372 reflections(Δ/σ)max = 0.001
420 parametersΔρmax = 0.67 e Å3
0 restraintsΔρmin = 1.42 e Å3
Special details top

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.

Refinement. Refinement of F2 against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F2, conventional R-factors R are based on F, with F set to zero for negative F2. The threshold expression of F2 > σ(F2) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F2 are statistically about twice as large as those based on F, and R- factors based on ALL data will be even larger.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2) top
xyzUiso*/Ueq
Mo10.742210 (13)0.802916 (18)0.618878 (12)0.01797 (8)
Mo20.574306 (13)0.793388 (18)0.659101 (13)0.01952 (8)
Mo30.728973 (14)0.878777 (19)0.877404 (12)0.01999 (9)
Mo40.838192 (14)0.846643 (18)0.752507 (12)0.01977 (9)
Mo50.566457 (13)0.890838 (18)0.821084 (13)0.01946 (9)
P10.68567 (4)0.71073 (5)0.76677 (4)0.01713 (16)
P20.68748 (4)0.97195 (5)0.72401 (4)0.01557 (15)
O10.78934 (13)0.70844 (16)0.59310 (12)0.0306 (5)
O20.74196 (12)0.87963 (17)0.55643 (12)0.0295 (5)
O30.65248 (11)0.74502 (15)0.61258 (10)0.0219 (4)
O40.81121 (11)0.87220 (15)0.66736 (10)0.0216 (4)
O50.74774 (11)0.73412 (15)0.72407 (10)0.0211 (4)
O60.67238 (11)0.88793 (14)0.67971 (10)0.0193 (4)
O70.51561 (12)0.70462 (17)0.64624 (12)0.0306 (5)
O80.54797 (14)0.88055 (18)0.60907 (13)0.0344 (6)
O90.62482 (11)0.68073 (15)0.72737 (11)0.0219 (4)
O100.54705 (12)0.84210 (15)0.73893 (11)0.0249 (5)
O110.53313 (14)0.80416 (17)0.86783 (13)0.0350 (6)
O120.50904 (12)0.98204 (16)0.83097 (11)0.0264 (5)
O130.62337 (11)1.00362 (15)0.75775 (10)0.0208 (4)
O140.66667 (11)0.79504 (14)0.80987 (10)0.0205 (4)
O150.63951 (11)0.93615 (15)0.87485 (10)0.0221 (5)
O160.72285 (14)0.80675 (19)0.94152 (12)0.0372 (6)
O170.77222 (13)0.97581 (17)0.90577 (12)0.0335 (6)
O180.74474 (11)0.94827 (15)0.77168 (10)0.0204 (4)
O190.80327 (11)0.81389 (15)0.83490 (10)0.0223 (4)
O200.89375 (12)0.75377 (18)0.74443 (12)0.0316 (5)
O210.88894 (13)0.94274 (18)0.76624 (13)0.0332 (5)
O220.71487 (12)1.05157 (14)0.67790 (11)0.0252 (5)
O230.70808 (14)0.63025 (16)0.81421 (11)0.0318 (5)
N10.62567 (15)0.0390 (2)1.11890 (14)0.0277 (6)
N20.62929 (15)0.14530 (19)0.86939 (13)0.0263 (6)
N30.34222 (19)0.9621 (3)0.47668 (17)0.0522 (10)
N40.49966 (15)0.8857 (2)0.27993 (14)0.0292 (6)
C10.61874 (18)0.0181 (2)1.05008 (17)0.0299 (7)
C20.58450 (17)0.0774 (2)1.04039 (16)0.0266 (7)
C30.57524 (17)0.1026 (3)0.97074 (17)0.0292 (7)
C40.64066 (17)0.1347 (2)0.93902 (15)0.0258 (7)
C50.3974 (2)0.8968 (3)0.49671 (18)0.0368 (8)
C60.46018 (19)0.9066 (3)0.45515 (18)0.0356 (8)
C70.44741 (17)0.8851 (2)0.38598 (17)0.0285 (7)
C80.51056 (16)0.9084 (2)0.34797 (15)0.0269 (7)
H22B0.62720.09350.85050.057 (15)*
H3B0.55630.04550.94870.043 (12)*
H7A0.41030.92460.36890.030 (10)*
H2A0.60880.12151.05700.029 (12)*
H3A0.54480.15050.96510.041 (12)*
H8B0.54780.87440.35880.040 (11)*
H42C0.48220.82690.27620.072 (17)*
H6B0.49520.87080.47050.065 (15)*
H2B0.54040.07371.05700.040 (11)*
H1A0.59510.06751.03140.050 (13)*
H7B0.43350.82340.38400.028 (10)*
H12A0.58800.04641.13620.025 (10)*
H8A0.51350.97910.34400.039 (11)*
H1P0.70800.56300.79880.039 (11)*
H1B0.66450.02391.02830.036 (11)*
H4A0.65700.19620.95340.052 (13)*
H12B0.64300.09601.11550.063 (16)*
H22C0.66050.18280.84910.056 (14)*
H4B0.67760.08030.93890.065 (15)*
H12C0.65660.00351.13790.040 (11)*
H22A0.58400.16750.85680.064 (16)*
H42B0.53980.88150.25560.064 (16)*
H5B0.38050.82920.49490.054 (13)*
H5A0.41110.91540.54100.036 (11)*
H42A0.46960.93290.25990.042 (12)*
H6A0.47340.97530.45640.055 (14)*
H2P0.71351.11220.68840.048 (13)*
H32A0.35691.02190.47940.079*
H32B0.30590.95440.50180.079*
H32C0.33040.94920.43690.079*
H1W0.84890.13430.92340.048 (13)*
H2W0.89010.18460.98310.048 (13)*
O1W0.8674 (2)0.1355 (4)0.9583 (3)0.0995 (17)
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Mo10.01703 (14)0.01652 (14)0.02034 (15)0.00051 (9)0.00165 (9)0.00050 (9)
Mo20.01616 (14)0.01764 (14)0.02475 (16)0.00061 (9)0.00176 (10)0.00303 (10)
Mo30.02128 (15)0.01856 (14)0.02011 (15)0.00348 (10)0.00234 (10)0.00084 (9)
Mo40.01518 (15)0.02002 (15)0.02411 (15)0.00135 (9)0.00094 (9)0.00187 (10)
Mo50.01691 (14)0.01637 (14)0.02511 (16)0.00009 (9)0.00342 (10)0.00257 (10)
P10.0176 (4)0.0124 (3)0.0214 (4)0.0009 (3)0.0023 (3)0.0003 (3)
P20.0147 (3)0.0121 (3)0.0199 (4)0.0004 (3)0.0012 (3)0.0005 (3)
O10.0301 (13)0.0268 (12)0.0350 (13)0.0070 (10)0.0062 (10)0.0036 (10)
O20.0295 (12)0.0307 (12)0.0282 (13)0.0011 (10)0.0003 (10)0.0082 (10)
O30.0221 (11)0.0190 (10)0.0246 (11)0.0010 (9)0.0000 (9)0.0040 (8)
O40.0181 (11)0.0233 (11)0.0235 (11)0.0016 (8)0.0010 (9)0.0039 (8)
O50.0172 (10)0.0205 (10)0.0256 (11)0.0016 (8)0.0027 (8)0.0039 (9)
O60.0161 (10)0.0175 (10)0.0244 (11)0.0011 (8)0.0001 (8)0.0030 (8)
O70.0228 (12)0.0311 (13)0.0379 (13)0.0075 (10)0.0018 (10)0.0067 (10)
O80.0348 (14)0.0303 (13)0.0379 (14)0.0073 (11)0.0066 (11)0.0012 (10)
O90.0195 (11)0.0183 (10)0.0278 (11)0.0041 (8)0.0018 (9)0.0022 (9)
O100.0175 (11)0.0254 (12)0.0320 (12)0.0018 (8)0.0003 (9)0.0075 (9)
O110.0351 (14)0.0260 (12)0.0437 (15)0.0049 (10)0.0142 (12)0.0030 (10)
O120.0212 (11)0.0254 (12)0.0326 (12)0.0039 (9)0.0041 (9)0.0039 (9)
O130.0183 (10)0.0172 (10)0.0269 (11)0.0038 (8)0.0008 (9)0.0014 (8)
O140.0187 (10)0.0175 (10)0.0253 (11)0.0012 (8)0.0005 (8)0.0028 (8)
O150.0218 (11)0.0204 (10)0.0243 (11)0.0032 (9)0.0004 (8)0.0039 (8)
O160.0434 (15)0.0379 (14)0.0303 (13)0.0115 (12)0.0034 (11)0.0097 (11)
O170.0325 (13)0.0286 (13)0.0393 (14)0.0017 (10)0.0102 (11)0.0098 (11)
O180.0182 (10)0.0190 (10)0.0239 (11)0.0030 (8)0.0031 (8)0.0009 (8)
O190.0206 (11)0.0225 (10)0.0239 (11)0.0041 (9)0.0016 (9)0.0018 (8)
O200.0237 (12)0.0336 (13)0.0376 (13)0.0098 (10)0.0011 (10)0.0015 (10)
O210.0243 (12)0.0338 (13)0.0414 (14)0.0071 (10)0.0041 (11)0.0013 (11)
O220.0301 (12)0.0157 (10)0.0299 (12)0.0030 (9)0.0021 (10)0.0043 (9)
O230.0469 (15)0.0181 (11)0.0304 (13)0.0067 (10)0.0004 (11)0.0042 (9)
N10.0266 (15)0.0233 (14)0.0333 (15)0.0033 (12)0.0005 (12)0.0050 (11)
N20.0310 (15)0.0222 (14)0.0257 (14)0.0055 (11)0.0025 (12)0.0016 (11)
N30.048 (2)0.066 (2)0.0421 (19)0.0276 (19)0.0087 (17)0.0002 (18)
N40.0245 (15)0.0348 (15)0.0284 (15)0.0021 (12)0.0020 (12)0.0006 (12)
C10.0330 (18)0.0251 (16)0.0314 (17)0.0001 (14)0.0017 (14)0.0001 (13)
C20.0247 (16)0.0304 (17)0.0247 (16)0.0010 (14)0.0019 (13)0.0003 (13)
C30.0233 (16)0.0376 (19)0.0266 (18)0.0015 (14)0.0001 (13)0.0044 (14)
C40.0254 (16)0.0256 (16)0.0265 (17)0.0026 (13)0.0017 (13)0.0007 (13)
C50.039 (2)0.043 (2)0.0287 (18)0.0049 (16)0.0019 (16)0.0051 (15)
C60.0301 (18)0.048 (2)0.0287 (18)0.0008 (16)0.0015 (15)0.0014 (16)
C70.0223 (16)0.0327 (18)0.0303 (18)0.0019 (14)0.0007 (13)0.0024 (13)
C80.0240 (16)0.0267 (17)0.0301 (17)0.0005 (13)0.0002 (13)0.0018 (13)
O1W0.072 (3)0.097 (3)0.130 (4)0.019 (3)0.045 (3)0.033 (3)
Geometric parameters (Å, º) top
Mo1—O21.702 (2)N1—C11.488 (4)
Mo1—O11.703 (2)N1—H12A0.8259
Mo1—O31.932 (2)N1—H12B0.8717
Mo1—O41.949 (2)N1—H12C0.9389
Mo1—O62.219 (2)N2—C41.493 (4)
Mo1—O52.424 (2)N2—H22B0.8311
Mo2—O81.696 (2)N2—H22C0.9114
Mo2—O71.713 (2)N2—H22A0.9721
Mo2—O101.894 (2)N3—C51.475 (5)
Mo2—O31.935 (2)N3—H32A0.8900
Mo2—O92.355 (2)N3—H32B0.8900
Mo2—O62.367 (2)N3—H32C0.8900
Mo3—O161.694 (2)N4—C81.486 (4)
Mo3—O171.710 (2)N4—H42C0.8965
Mo3—O151.921 (2)N4—H42B0.9361
Mo3—O191.931 (2)N4—H42A0.9797
Mo3—O142.211 (2)C1—C21.512 (5)
Mo3—O182.455 (2)C1—H1A0.9216
Mo4—O211.698 (2)C1—H1B1.0065
Mo4—O201.703 (2)C2—C31.523 (5)
Mo4—O41.906 (2)C2—H2A0.8544
Mo4—O191.923 (2)C2—H2B0.9297
Mo4—O182.348 (2)C3—C41.508 (5)
Mo4—O52.442 (2)C3—H3B0.9970
Mo5—O111.696 (2)C3—H3A0.9044
Mo5—O121.713 (2)C4—H4A0.9689
Mo5—O101.902 (2)C4—H4B1.0498
Mo5—O151.928 (2)C5—C61.510 (5)
Mo5—O132.350 (2)C5—H5B1.0061
Mo5—O142.383 (2)C5—H5A1.0066
P1—O91.508 (2)C6—C71.511 (5)
P1—O141.538 (2)C6—H6B0.9080
P1—O51.543 (2)C6—H6A0.9986
P1—O231.572 (2)C7—C81.504 (5)
P2—O131.505 (2)C7—H7A0.9804
P2—O61.534 (2)C7—H7B0.9088
P2—O181.538 (2)C8—H8B0.8981
P2—O221.576 (2)C8—H8A0.9985
O22—H2P0.8802O1W—H1W0.8193
O23—H1P0.9995O1W—H2W0.9690
O2—Mo1—O1104.33 (12)Mo1—O5—Mo489.95 (7)
O2—Mo1—O3102.15 (11)P2—O6—Mo1130.48 (12)
O1—Mo1—O397.92 (11)P2—O6—Mo2134.29 (12)
O2—Mo1—O495.30 (10)Mo1—O6—Mo294.96 (7)
O1—Mo1—O4100.66 (11)P1—O9—Mo2118.55 (12)
O3—Mo1—O4150.44 (9)Mo2—O10—Mo5152.26 (13)
O2—Mo1—O696.05 (10)P2—O13—Mo5117.47 (12)
O1—Mo1—O6159.17 (10)P1—O14—Mo3131.20 (12)
O3—Mo1—O673.25 (8)P1—O14—Mo5133.67 (12)
O4—Mo1—O681.39 (9)Mo3—O14—Mo594.89 (7)
O2—Mo1—O5164.08 (10)Mo3—O15—Mo5123.20 (11)
O1—Mo1—O587.59 (10)P2—O18—Mo4125.50 (12)
O3—Mo1—O586.30 (8)P2—O18—Mo3126.13 (12)
O4—Mo1—O571.80 (8)Mo4—O18—Mo390.68 (7)
O6—Mo1—O573.25 (7)Mo4—O19—Mo3124.90 (11)
O8—Mo2—O7102.99 (12)P2—O22—H2P121.3
O8—Mo2—O10102.02 (11)P1—O23—H1P118.2
O7—Mo2—O10102.52 (11)C1—N1—H12A112.0
O8—Mo2—O3100.10 (11)C1—N1—H12B97.7
O7—Mo2—O3100.91 (10)H12A—N1—H12B105.3
O10—Mo2—O3143.00 (10)C1—N1—H12C110.5
O8—Mo2—O9172.77 (11)H12A—N1—H12C117.5
O7—Mo2—O983.50 (10)H12B—N1—H12C111.8
O10—Mo2—O979.38 (9)C4—N2—H22B113.1
O3—Mo2—O975.28 (8)C4—N2—H22C114.8
O8—Mo2—O687.33 (11)H22B—N2—H22C108.3
O7—Mo2—O6167.43 (10)C4—N2—H22A115.7
O10—Mo2—O681.96 (9)H22B—N2—H22A96.1
O3—Mo2—O669.82 (8)H22C—N2—H22A107.0
O9—Mo2—O685.83 (7)C5—N3—H32A109.5
O16—Mo3—O17103.36 (13)C5—N3—H32B109.5
O16—Mo3—O15102.07 (11)H32A—N3—H32B109.5
O17—Mo3—O1597.03 (11)C5—N3—H32C109.5
O16—Mo3—O1998.16 (11)H32A—N3—H32C109.5
O17—Mo3—O1999.76 (11)H32B—N3—H32C109.5
O15—Mo3—O19149.87 (9)C8—N4—H42C109.6
O16—Mo3—O1499.12 (11)C8—N4—H42B115.1
O17—Mo3—O14156.92 (10)H42C—N4—H42B102.1
O15—Mo3—O1472.97 (8)C8—N4—H42A110.9
O19—Mo3—O1482.00 (9)H42C—N4—H42A111.1
O16—Mo3—O18166.54 (10)H42B—N4—H42A107.7
O17—Mo3—O1886.54 (10)N1—C1—C2110.3 (3)
O15—Mo3—O1885.48 (8)N1—C1—H1A108.3
O19—Mo3—O1870.84 (8)C2—C1—H1A112.9
O14—Mo3—O1872.20 (7)N1—C1—H1B110.5
O21—Mo4—O20104.83 (13)C2—C1—H1B113.6
O21—Mo4—O499.89 (11)H1A—C1—H1B100.8
O20—Mo4—O4103.00 (11)C1—C2—C3112.9 (3)
O21—Mo4—O19103.99 (11)C1—C2—H2A110.1
O20—Mo4—O1997.59 (11)C3—C2—H2A107.1
O4—Mo4—O19143.12 (10)C1—C2—H2B107.9
O21—Mo4—O1886.48 (10)C3—C2—H2B105.5
O20—Mo4—O18167.20 (10)H2A—C2—H2B113.4
O4—Mo4—O1880.46 (9)C4—C3—C2113.4 (3)
O19—Mo4—O1873.47 (8)C4—C3—H3B110.2
O21—Mo4—O5167.57 (10)C2—C3—H3B107.9
O20—Mo4—O586.45 (10)C4—C3—H3A105.9
O4—Mo4—O572.02 (8)C2—C3—H3A112.1
O19—Mo4—O579.17 (9)H3B—C3—H3A107.2
O18—Mo4—O582.91 (8)N2—C4—C3109.9 (3)
O11—Mo5—O12102.48 (12)N2—C4—H4A105.6
O11—Mo5—O10101.29 (12)C3—C4—H4A113.9
O12—Mo5—O10104.50 (11)N2—C4—H4B99.9
O11—Mo5—O15100.20 (12)C3—C4—H4B111.3
O12—Mo5—O1599.40 (10)H4A—C4—H4B115.0
O10—Mo5—O15143.32 (9)N3—C5—C6111.5 (3)
O11—Mo5—O13174.27 (11)N3—C5—H5B109.6
O12—Mo5—O1382.72 (9)C6—C5—H5B109.3
O10—Mo5—O1379.51 (9)N3—C5—H5A107.3
O15—Mo5—O1376.36 (8)C6—C5—H5A107.6
O11—Mo5—O1488.05 (10)H5B—C5—H5A111.5
O12—Mo5—O14165.73 (9)C5—C6—C7114.2 (3)
O10—Mo5—O1482.47 (9)C5—C6—H6B110.5
O15—Mo5—O1468.91 (8)C7—C6—H6B111.0
O13—Mo5—O1486.43 (7)C5—C6—H6A106.3
O9—P1—O14110.62 (12)C7—C6—H6A105.2
O9—P1—O5110.69 (12)H6B—C6—H6A109.3
O14—P1—O5111.71 (12)C8—C7—C6109.7 (3)
O9—P1—O23111.62 (14)C8—C7—H7A106.5
O14—P1—O23104.10 (12)C6—C7—H7A111.2
O5—P1—O23107.91 (13)C8—C7—H7B115.2
O13—P2—O6110.90 (12)C6—C7—H7B106.5
O13—P2—O18110.87 (12)H7A—C7—H7B107.7
O6—P2—O18111.79 (12)N4—C8—C7110.6 (3)
O13—P2—O22111.32 (12)N4—C8—H8B104.3
O6—P2—O22103.56 (12)C7—C8—H8B114.2
O18—P2—O22108.17 (13)N4—C8—H8A98.1
Mo1—O3—Mo2121.95 (11)C7—C8—H8A107.9
Mo4—O4—Mo1126.22 (11)H8B—C8—H8A120.2
P1—O5—Mo1125.79 (12)H1W—O1W—H2W134.3
P1—O5—Mo4124.03 (12)
O2—Mo1—O3—Mo293.94 (15)O13—Mo5—O10—Mo259.3 (3)
O1—Mo1—O3—Mo2159.47 (14)O14—Mo5—O10—Mo228.4 (3)
O4—Mo1—O3—Mo230.9 (3)O6—P2—O13—Mo559.01 (15)
O6—Mo1—O3—Mo21.20 (11)O18—P2—O13—Mo565.79 (15)
O5—Mo1—O3—Mo272.42 (13)O22—P2—O13—Mo5173.75 (12)
O8—Mo2—O3—Mo184.49 (15)O12—Mo5—O13—P2176.95 (15)
O7—Mo2—O3—Mo1170.03 (14)O10—Mo5—O13—P270.67 (14)
O10—Mo2—O3—Mo141.5 (2)O15—Mo5—O13—P281.49 (14)
O9—Mo2—O3—Mo189.81 (13)O14—Mo5—O13—P212.33 (13)
O6—Mo2—O3—Mo11.14 (11)O9—P1—O14—Mo3177.82 (15)
O21—Mo4—O4—Mo1171.63 (15)O5—P1—O14—Mo354.04 (19)
O20—Mo4—O4—Mo180.50 (16)O23—P1—O14—Mo362.15 (19)
O19—Mo4—O4—Mo141.7 (2)O9—P1—O14—Mo54.9 (2)
O18—Mo4—O4—Mo186.93 (14)O5—P1—O14—Mo5118.84 (16)
O5—Mo4—O4—Mo11.35 (12)O23—P1—O14—Mo5124.97 (17)
O2—Mo1—O4—Mo4171.82 (15)O16—Mo3—O14—P184.22 (18)
O1—Mo1—O4—Mo482.50 (16)O17—Mo3—O14—P1109.0 (3)
O3—Mo1—O4—Mo445.5 (3)O15—Mo3—O14—P1175.86 (19)
O6—Mo1—O4—Mo476.47 (14)O19—Mo3—O14—P112.83 (16)
O5—Mo1—O4—Mo41.37 (12)O18—Mo3—O14—P185.18 (16)
O9—P1—O5—Mo133.15 (18)O16—Mo3—O14—Mo5100.94 (11)
O14—P1—O5—Mo190.59 (16)O17—Mo3—O14—Mo565.9 (3)
O23—P1—O5—Mo1155.57 (14)O15—Mo3—O14—Mo51.02 (8)
O9—P1—O5—Mo4152.20 (13)O19—Mo3—O14—Mo5162.01 (9)
O14—P1—O5—Mo428.46 (18)O18—Mo3—O14—Mo589.65 (8)
O23—P1—O5—Mo485.39 (16)O11—Mo5—O14—P182.61 (19)
O2—Mo1—O5—P195.7 (4)O12—Mo5—O14—P1139.4 (4)
O1—Mo1—O5—P1125.24 (16)O10—Mo5—O14—P119.05 (17)
O3—Mo1—O5—P127.14 (15)O15—Mo5—O14—P1175.67 (19)
O4—Mo1—O5—P1132.71 (16)O13—Mo5—O14—P198.92 (17)
O6—Mo1—O5—P146.47 (14)O11—Mo5—O14—Mo3102.76 (11)
O2—Mo1—O5—Mo437.9 (4)O12—Mo5—O14—Mo335.2 (4)
O1—Mo1—O5—Mo4101.19 (10)O10—Mo5—O14—Mo3155.58 (9)
O3—Mo1—O5—Mo4160.71 (8)O15—Mo5—O14—Mo31.04 (8)
O4—Mo1—O5—Mo40.86 (8)O13—Mo5—O14—Mo375.71 (8)
O6—Mo1—O5—Mo487.10 (8)O16—Mo3—O15—Mo597.48 (15)
O21—Mo4—O5—P183.3 (5)O17—Mo3—O15—Mo5157.19 (15)
O20—Mo4—O5—P1121.14 (16)O19—Mo3—O15—Mo533.6 (3)
O4—Mo4—O5—P1133.96 (16)O14—Mo3—O15—Mo51.50 (12)
O19—Mo4—O5—P122.71 (14)O18—Mo3—O15—Mo571.25 (13)
O18—Mo4—O5—P151.73 (14)O11—Mo5—O15—Mo385.32 (15)
O21—Mo4—O5—Mo151.5 (5)O12—Mo5—O15—Mo3170.07 (14)
O20—Mo4—O5—Mo1104.02 (10)O10—Mo5—O15—Mo339.8 (2)
O4—Mo4—O5—Mo10.88 (8)O13—Mo5—O15—Mo390.00 (13)
O19—Mo4—O5—Mo1157.55 (9)O14—Mo5—O15—Mo31.43 (11)
O18—Mo4—O5—Mo183.11 (7)O13—P2—O18—Mo4156.50 (13)
O13—P2—O6—Mo1177.45 (14)O6—P2—O18—Mo432.20 (18)
O18—P2—O6—Mo153.17 (19)O22—P2—O18—Mo481.19 (16)
O22—P2—O6—Mo163.05 (18)O13—P2—O18—Mo333.90 (17)
O13—P2—O6—Mo25.0 (2)O6—P2—O18—Mo390.40 (16)
O18—P2—O6—Mo2119.26 (16)O22—P2—O18—Mo3156.21 (13)
O22—P2—O6—Mo2124.52 (17)O21—Mo4—O18—P2119.29 (17)
O2—Mo1—O6—P283.70 (17)O20—Mo4—O18—P288.2 (5)
O1—Mo1—O6—P2108.1 (3)O4—Mo4—O18—P218.64 (15)
O3—Mo1—O6—P2175.40 (18)O19—Mo4—O18—P2134.99 (16)
O4—Mo1—O6—P210.76 (16)O5—Mo4—O18—P254.23 (14)
O5—Mo1—O6—P284.24 (16)O21—Mo4—O18—Mo3103.59 (10)
O2—Mo1—O6—Mo2101.73 (10)O20—Mo4—O18—Mo348.9 (5)
O1—Mo1—O6—Mo266.4 (3)O4—Mo4—O18—Mo3155.76 (9)
O3—Mo1—O6—Mo20.83 (8)O19—Mo4—O18—Mo32.13 (8)
O4—Mo1—O6—Mo2163.80 (9)O5—Mo4—O18—Mo382.89 (7)
O5—Mo1—O6—Mo290.32 (8)O16—Mo3—O18—P298.3 (5)
O8—Mo2—O6—P283.14 (19)O17—Mo3—O18—P2123.87 (16)
O7—Mo2—O6—P2131.3 (4)O15—Mo3—O18—P226.53 (15)
O10—Mo2—O6—P219.40 (17)O19—Mo3—O18—P2134.55 (16)
O3—Mo2—O6—P2175.07 (19)O14—Mo3—O18—P247.02 (14)
O9—Mo2—O6—P299.24 (17)O16—Mo3—O18—Mo438.4 (5)
O8—Mo2—O6—Mo1102.63 (11)O17—Mo3—O18—Mo499.43 (10)
O7—Mo2—O6—Mo143.0 (5)O15—Mo3—O18—Mo4163.23 (8)
O10—Mo2—O6—Mo1154.83 (10)O19—Mo3—O18—Mo42.15 (8)
O3—Mo2—O6—Mo10.85 (8)O14—Mo3—O18—Mo489.68 (8)
O9—Mo2—O6—Mo174.99 (8)O21—Mo4—O19—Mo378.66 (16)
O14—P1—O9—Mo258.95 (16)O20—Mo4—O19—Mo3173.92 (15)
O5—P1—O9—Mo265.43 (15)O4—Mo4—O19—Mo350.2 (2)
O23—P1—O9—Mo2174.36 (12)O18—Mo4—O19—Mo33.30 (12)
O7—Mo2—O9—P1174.95 (16)O5—Mo4—O19—Mo389.03 (14)
O10—Mo2—O9—P170.87 (14)O16—Mo3—O19—Mo4175.20 (15)
O3—Mo2—O9—P181.94 (14)O17—Mo3—O19—Mo479.64 (16)
O6—Mo2—O9—P111.72 (13)O15—Mo3—O19—Mo443.3 (3)
O8—Mo2—O10—Mo5113.8 (3)O14—Mo3—O19—Mo477.06 (14)
O7—Mo2—O10—Mo5139.8 (3)O18—Mo3—O19—Mo43.20 (12)
O3—Mo2—O10—Mo511.7 (4)N1—C1—C2—C3179.4 (3)
O9—Mo2—O10—Mo559.0 (3)C1—C2—C3—C476.2 (4)
O6—Mo2—O10—Mo528.2 (3)C2—C3—C4—N2172.4 (3)
O11—Mo5—O10—Mo2114.9 (3)N3—C5—C6—C760.1 (5)
O12—Mo5—O10—Mo2138.9 (3)C5—C6—C7—C8173.2 (3)
O15—Mo5—O10—Mo29.9 (4)C6—C7—C8—N4178.8 (3)
 

Subscribe to Acta Crystallographica Section E: Crystallographic Communications

The full text of this article is available to subscribers to the journal.

If you have already registered and are using a computer listed in your registration details, please email support@iucr.org for assistance.

Buy online

You may purchase this article in PDF and/or HTML formats. For purchasers in the European Community who do not have a VAT number, VAT will be added at the local rate. Payments to the IUCr are handled by WorldPay, who will accept payment by credit card in several currencies. To purchase the article, please complete the form below (fields marked * are required), and then click on `Continue'.
E-mail address* 
Repeat e-mail address* 
(for error checking) 

Format*   PDF (US $40)
   HTML (US $40)
   PDF+HTML (US $50)
In order for VAT to be shown for your country javascript needs to be enabled.

VAT number 
(non-UK EC countries only) 
Country* 
 

Terms and conditions of use
Contact us

Follow Acta Cryst. E
Sign up for e-alerts
Follow Acta Cryst. on Twitter
Follow us on facebook
Sign up for RSS feeds