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In the title compound, [Zn(C5H2N2O4)(C10H8N2)]n, the ZnII atom is six-coordinated in an octa­hedral geometry by two carboxyl­ate O atoms and two N atoms from two imidazole-4,5-dicarboxyl­ate ligands, and two N atoms from a 2,2′-bipyridine ligand. The asymmetric unit contains two formula units. The imidazole-4,5-dicarboxyl­ate ligand bridges two ZnII atoms to form a one-dimensional zigzag chain structure.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536807014420/hy2050sup1.cif
Contains datablocks I, global

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S1600536807014420/hy2050Isup2.hkl
Contains datablock I

CCDC reference: 1296347

Key indicators

  • Single-crystal X-ray study
  • T = 292 K
  • Mean [sigma](C-C)= 0.003 Å
  • R factor = 0.029
  • wR factor = 0.074
  • Data-to-parameter ratio = 13.0

checkCIF/PLATON results

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No errors found in this datablock

Computing details top

Data collection: SMART (Bruker, 2001); cell refinement: SAINT (Bruker, 2001); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 1997); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: SHELXTL (Bruker, 2001) and Mercury (Macrae et al., 2006); software used to prepare material for publication: SHELXTL.

catena-Poly[[(2,2'-bipyridine-κ2N,N')zinc(II)]- µ-imidazole-4,5-dicarboxylato-κ4N1,O5:N3,O4] top
Crystal data top
[Zn(C5H2N2O4)(C10H8N2)]F(000) = 1520
Mr = 375.64Dx = 1.746 Mg m3
Monoclinic, P21/cMo Kα radiation, λ = 0.71073 Å
Hall symbol: -P 2ybcCell parameters from 5520 reflections
a = 20.470 (1) Åθ = 2.3–26.0°
b = 9.6494 (5) ŵ = 1.75 mm1
c = 14.7843 (7) ÅT = 292 K
β = 101.783 (1)°Block, colorless
V = 2858.7 (2) Å30.27 × 0.23 × 0.21 mm
Z = 8
Data collection top
Bruker SMART APEX CCD
diffractometer
5621 independent reflections
Radiation source: fine-focus sealed tube4913 reflections with I > 2σ(I)
Graphite monochromatorRint = 0.027
φ and ω scansθmax = 26.0°, θmin = 2.3°
Absorption correction: multi-scan
(SAINT-Plus; Bruker, 2001)
h = 2520
Tmin = 0.629, Tmax = 0.691k = 1110
15264 measured reflectionsl = 1718
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)] = 0.029Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.074H-atom parameters constrained
S = 1.05 w = 1/[σ2(Fo2) + (0.0391P)2 + 1.2625P]
where P = (Fo2 + 2Fc2)/3
5621 reflections(Δ/σ)max = 0.001
433 parametersΔρmax = 0.43 e Å3
0 restraintsΔρmin = 0.40 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
Zn10.097901 (12)0.59581 (3)0.319707 (17)0.01956 (8)
Zn20.399412 (11)0.47522 (3)0.714412 (16)0.01726 (8)
C10.02127 (10)0.3690 (2)0.27867 (15)0.0198 (4)
H10.03470.36880.33510.024*
C40.08027 (11)0.4931 (2)0.12798 (15)0.0206 (5)
C270.18385 (12)0.4734 (3)0.62208 (17)0.0323 (6)
H270.15230.53890.59570.039*
C140.26992 (12)0.8757 (2)0.36444 (15)0.0244 (5)
H140.27680.96990.35670.029*
O60.46696 (7)0.63637 (16)0.48931 (9)0.0209 (3)
O50.41454 (7)0.49639 (15)0.57124 (10)0.0185 (3)
C160.52318 (10)0.6783 (2)0.79889 (14)0.0184 (4)
H160.52530.66890.86200.022*
C290.21219 (12)0.2442 (3)0.67708 (18)0.0335 (6)
H290.20010.15470.69020.040*
O10.08405 (8)0.45828 (17)0.04491 (10)0.0250 (4)
O20.11830 (8)0.57759 (16)0.17576 (11)0.0244 (3)
C300.27827 (11)0.2847 (2)0.69560 (16)0.0252 (5)
H300.31070.21980.72000.030*
N80.55730 (9)0.77603 (18)0.76236 (11)0.0173 (4)
C150.20630 (11)0.8209 (2)0.34595 (15)0.0237 (5)
H150.17050.87990.32490.028*
C260.25108 (11)0.5085 (2)0.64542 (14)0.0208 (5)
N20.04569 (8)0.28124 (18)0.20963 (12)0.0184 (4)
C120.31098 (11)0.6491 (2)0.40568 (15)0.0248 (5)
H120.34630.58830.42530.030*
N70.48589 (9)0.59596 (18)0.73549 (12)0.0171 (4)
N50.34006 (9)0.67336 (19)0.67812 (12)0.0219 (4)
N30.16331 (9)0.42239 (19)0.37696 (13)0.0205 (4)
N10.02439 (9)0.45712 (18)0.25850 (12)0.0184 (4)
N60.29768 (9)0.41348 (19)0.67987 (12)0.0199 (4)
N40.19397 (9)0.68611 (18)0.35704 (12)0.0196 (4)
C20.01343 (10)0.3154 (2)0.14047 (14)0.0182 (4)
C170.54077 (10)0.7531 (2)0.66909 (14)0.0161 (4)
C90.27634 (11)0.3555 (2)0.43767 (15)0.0243 (5)
H90.32120.37940.45390.029*
C190.45729 (10)0.5860 (2)0.56654 (14)0.0169 (4)
C180.49727 (10)0.6431 (2)0.65252 (14)0.0167 (4)
C240.23366 (12)0.7599 (3)0.60140 (17)0.0306 (6)
H240.18900.74300.57540.037*
C110.24583 (11)0.6010 (2)0.38736 (14)0.0193 (5)
C60.14443 (12)0.2930 (2)0.38996 (16)0.0264 (5)
H60.09930.27140.37400.032*
C30.02966 (10)0.4231 (2)0.17031 (14)0.0173 (4)
C280.16437 (12)0.3401 (3)0.63858 (19)0.0385 (6)
H280.11960.31530.62390.046*
C250.27549 (11)0.6523 (2)0.63946 (14)0.0216 (5)
C80.25607 (12)0.2218 (2)0.44974 (16)0.0279 (5)
H80.28720.15410.47350.033*
C70.18875 (12)0.1893 (2)0.42605 (17)0.0283 (5)
H70.17380.10010.43420.034*
C100.22865 (11)0.4543 (2)0.40084 (14)0.0199 (5)
C210.36413 (12)0.8021 (2)0.67954 (17)0.0289 (5)
H210.40870.81700.70690.035*
C130.32285 (11)0.7883 (3)0.39455 (16)0.0266 (5)
H130.36620.82250.40730.032*
C230.25949 (14)0.8922 (3)0.60283 (19)0.0369 (6)
H230.23250.96570.57750.044*
C220.32590 (14)0.9144 (3)0.64225 (19)0.0364 (6)
H220.34441.00260.64370.044*
O70.55437 (8)0.81893 (17)0.52023 (10)0.0295 (4)
H7A0.52550.75870.50990.044*
O40.00496 (8)0.26604 (17)0.00931 (10)0.0273 (4)
H4A0.03100.32950.00900.041*
C200.56730 (10)0.8472 (2)0.60587 (14)0.0195 (4)
C50.02691 (11)0.2338 (2)0.05391 (15)0.0205 (5)
O80.60134 (8)0.94846 (16)0.64083 (10)0.0218 (3)
O30.06777 (8)0.13640 (16)0.04731 (10)0.0251 (3)
Atomic displacement parameters (Å2) top
U11U22U33U12U13U23
Zn10.01433 (14)0.01608 (14)0.02600 (15)0.00008 (9)0.00125 (10)0.00087 (10)
Zn20.01451 (14)0.01593 (14)0.02065 (14)0.00018 (9)0.00196 (10)0.00301 (10)
C10.0177 (11)0.0215 (11)0.0195 (10)0.0009 (9)0.0025 (8)0.0004 (9)
C40.0166 (11)0.0198 (11)0.0252 (11)0.0047 (9)0.0041 (9)0.0029 (9)
C270.0182 (12)0.0417 (15)0.0350 (13)0.0048 (11)0.0004 (10)0.0003 (12)
C140.0287 (13)0.0199 (12)0.0244 (11)0.0063 (10)0.0049 (9)0.0016 (9)
O60.0222 (8)0.0241 (8)0.0155 (7)0.0024 (6)0.0017 (6)0.0005 (6)
O50.0166 (8)0.0198 (8)0.0183 (7)0.0038 (6)0.0016 (6)0.0027 (6)
C160.0199 (11)0.0197 (11)0.0147 (10)0.0005 (9)0.0017 (8)0.0007 (8)
C290.0295 (14)0.0316 (14)0.0387 (14)0.0111 (11)0.0054 (11)0.0033 (11)
O10.0250 (9)0.0273 (9)0.0248 (8)0.0004 (7)0.0099 (7)0.0005 (7)
O20.0182 (8)0.0256 (9)0.0298 (8)0.0056 (7)0.0060 (7)0.0012 (7)
C300.0233 (12)0.0224 (12)0.0287 (12)0.0025 (9)0.0025 (9)0.0001 (10)
N80.0182 (9)0.0175 (9)0.0155 (8)0.0010 (7)0.0022 (7)0.0020 (7)
C150.0234 (12)0.0198 (12)0.0270 (11)0.0005 (9)0.0034 (9)0.0033 (9)
C260.0178 (11)0.0272 (12)0.0169 (10)0.0026 (9)0.0024 (9)0.0010 (9)
N20.0157 (9)0.0198 (9)0.0186 (9)0.0010 (7)0.0012 (7)0.0008 (7)
C120.0184 (11)0.0250 (12)0.0289 (12)0.0007 (9)0.0001 (9)0.0051 (10)
N70.0182 (9)0.0166 (9)0.0159 (9)0.0015 (7)0.0022 (7)0.0003 (7)
N50.0205 (10)0.0210 (10)0.0251 (10)0.0028 (8)0.0065 (8)0.0014 (8)
N30.0168 (9)0.0189 (10)0.0249 (9)0.0009 (7)0.0025 (7)0.0018 (8)
N10.0148 (9)0.0193 (10)0.0197 (9)0.0003 (7)0.0004 (7)0.0010 (7)
N60.0169 (9)0.0227 (10)0.0199 (9)0.0002 (7)0.0039 (7)0.0012 (7)
N40.0165 (9)0.0186 (10)0.0224 (9)0.0010 (7)0.0007 (7)0.0002 (7)
C20.0148 (10)0.0192 (11)0.0195 (10)0.0023 (8)0.0010 (8)0.0006 (8)
C170.0148 (10)0.0167 (11)0.0166 (10)0.0005 (8)0.0025 (8)0.0005 (8)
C90.0184 (11)0.0264 (12)0.0260 (11)0.0025 (9)0.0004 (9)0.0005 (10)
C190.0147 (10)0.0171 (11)0.0187 (10)0.0029 (8)0.0030 (8)0.0010 (8)
C180.0150 (10)0.0178 (11)0.0167 (10)0.0016 (8)0.0016 (8)0.0009 (8)
C240.0255 (13)0.0359 (15)0.0308 (13)0.0115 (11)0.0065 (10)0.0075 (11)
C110.0187 (11)0.0210 (12)0.0177 (10)0.0001 (9)0.0021 (8)0.0000 (8)
C60.0216 (12)0.0246 (12)0.0324 (12)0.0034 (10)0.0044 (10)0.0023 (10)
C30.0137 (10)0.0170 (11)0.0203 (10)0.0031 (8)0.0013 (8)0.0009 (8)
C280.0181 (12)0.0455 (17)0.0495 (16)0.0076 (11)0.0011 (11)0.0085 (13)
C250.0217 (11)0.0261 (12)0.0184 (10)0.0061 (9)0.0072 (9)0.0029 (9)
C80.0284 (13)0.0219 (12)0.0306 (13)0.0076 (10)0.0001 (10)0.0034 (10)
C70.0308 (13)0.0170 (11)0.0362 (13)0.0011 (10)0.0047 (11)0.0042 (10)
C100.0189 (11)0.0217 (12)0.0182 (10)0.0008 (9)0.0017 (8)0.0009 (9)
C210.0278 (13)0.0256 (13)0.0358 (13)0.0026 (10)0.0124 (11)0.0007 (10)
C130.0190 (12)0.0315 (13)0.0283 (12)0.0073 (10)0.0022 (9)0.0023 (10)
C230.0399 (16)0.0292 (15)0.0442 (15)0.0185 (12)0.0146 (13)0.0108 (12)
C220.0454 (17)0.0196 (13)0.0490 (16)0.0064 (11)0.0207 (13)0.0044 (11)
O70.0393 (10)0.0307 (9)0.0191 (8)0.0170 (8)0.0074 (7)0.0019 (7)
O40.0296 (9)0.0293 (9)0.0230 (8)0.0035 (7)0.0054 (7)0.0054 (7)
C200.0191 (11)0.0201 (11)0.0190 (10)0.0011 (9)0.0036 (8)0.0005 (9)
C50.0177 (11)0.0207 (12)0.0212 (11)0.0033 (9)0.0006 (9)0.0001 (9)
O80.0246 (8)0.0206 (8)0.0210 (8)0.0073 (7)0.0065 (6)0.0011 (6)
O30.0248 (9)0.0241 (8)0.0248 (8)0.0040 (7)0.0014 (7)0.0052 (7)
Geometric parameters (Å, º) top
Zn1—N12.0780 (17)C12—C131.381 (3)
Zn1—N2i2.0839 (18)C12—C111.385 (3)
Zn1—N42.1185 (18)C12—H120.9300
Zn1—N32.2015 (18)N7—C181.372 (3)
Zn1—O3i2.2124 (16)N5—C211.335 (3)
Zn1—O22.2577 (16)N5—C251.344 (3)
Zn2—N72.0888 (17)N3—C61.333 (3)
Zn2—N8ii2.1150 (17)N3—C101.348 (3)
Zn2—N62.1256 (18)N1—C31.370 (3)
Zn2—O8ii2.1588 (15)N4—C111.344 (3)
Zn2—O52.2104 (14)C2—C31.376 (3)
Zn2—N52.2701 (18)C2—C51.480 (3)
C1—N11.341 (3)C17—C181.375 (3)
C1—N21.342 (3)C17—C201.483 (3)
C1—H10.9300C9—C81.378 (3)
C4—O21.243 (3)C9—C101.394 (3)
C4—O11.291 (3)C9—H90.9300
C4—C31.479 (3)C19—C181.471 (3)
C27—C281.383 (4)C24—C231.381 (4)
C27—C261.391 (3)C24—C251.389 (3)
C27—H270.9300C24—H240.9300
C14—C131.374 (3)C11—C101.482 (3)
C14—C151.380 (3)C6—C71.382 (3)
C14—H140.9300C6—H60.9300
O6—C191.293 (3)C28—H280.9300
O5—C191.242 (2)C8—C71.387 (3)
C16—N71.342 (3)C8—H80.9300
C16—N81.350 (3)C7—H70.9300
C16—H160.9300C21—C221.384 (3)
C29—C301.380 (3)C21—H210.9300
C29—C281.382 (4)C13—H130.9300
C29—H290.9300C23—C221.382 (4)
C30—N61.340 (3)C23—H230.9300
C30—H300.9300C22—H220.9300
N8—C171.369 (3)O7—C201.269 (3)
N8—Zn2iii2.1150 (17)O7—H7A0.8200
C15—N41.341 (3)O4—C51.283 (3)
C15—H150.9300O4—H4A0.8200
C26—N61.346 (3)C20—O81.249 (3)
C26—C251.483 (3)C5—O31.249 (3)
N2—C21.366 (3)O8—Zn2iii2.1588 (15)
N2—Zn1iv2.0839 (18)O3—Zn1iv2.2124 (16)
N1—Zn1—N2i99.63 (7)C6—N3—Zn1126.60 (15)
N1—Zn1—N4158.35 (7)C10—N3—Zn1114.83 (14)
N2i—Zn1—N496.34 (7)C1—N1—C3104.70 (17)
N1—Zn1—N390.42 (7)C1—N1—Zn1141.89 (15)
N2i—Zn1—N3168.09 (7)C3—N1—Zn1112.21 (14)
N4—Zn1—N375.71 (7)C30—N6—C26119.05 (19)
N1—Zn1—O3i101.10 (6)C30—N6—Zn2121.94 (15)
N2i—Zn1—O3i78.97 (6)C26—N6—Zn2118.93 (15)
N4—Zn1—O3i96.21 (6)C15—N4—C11118.53 (19)
N3—Zn1—O3i92.92 (6)C15—N4—Zn1123.70 (15)
N1—Zn1—O278.24 (6)C11—N4—Zn1117.60 (14)
N2i—Zn1—O293.23 (6)N2—C2—C3108.57 (18)
N4—Zn1—O286.39 (6)N2—C2—C5119.06 (19)
N3—Zn1—O295.06 (6)C3—C2—C5132.3 (2)
O3i—Zn1—O2172.00 (6)N8—C17—C18108.79 (18)
N7—Zn2—N8ii99.70 (7)N8—C17—C20119.25 (18)
N7—Zn2—N6162.00 (7)C18—C17—C20131.87 (19)
N8ii—Zn2—N698.15 (7)C8—C9—C10119.1 (2)
N7—Zn2—O8ii95.52 (6)C8—C9—H9120.5
N8ii—Zn2—O8ii79.51 (6)C10—C9—H9120.5
N6—Zn2—O8ii89.98 (6)O5—C19—O6123.21 (19)
N7—Zn2—O579.11 (6)O5—C19—C18119.09 (18)
N8ii—Zn2—O595.94 (6)O6—C19—C18117.65 (18)
N6—Zn2—O596.77 (6)N7—C18—C17108.58 (17)
O8ii—Zn2—O5172.37 (6)N7—C18—C19118.85 (18)
N7—Zn2—N587.81 (7)C17—C18—C19131.97 (19)
N8ii—Zn2—N5171.91 (7)C23—C24—C25118.8 (2)
N6—Zn2—N574.24 (7)C23—C24—H24120.6
O8ii—Zn2—N5102.90 (6)C25—C24—H24120.6
O5—Zn2—N582.46 (6)N4—C11—C12121.6 (2)
N1—C1—N2113.52 (19)N4—C11—C10115.81 (19)
N1—C1—H1123.2C12—C11—C10122.6 (2)
N2—C1—H1123.2N3—C6—C7123.2 (2)
O2—C4—O1124.0 (2)N3—C6—H6118.4
O2—C4—C3118.1 (2)C7—C6—H6118.4
O1—C4—C3117.83 (19)N1—C3—C2108.43 (18)
C28—C27—C26119.3 (2)N1—C3—C4119.44 (19)
C28—C27—H27120.4C2—C3—C4131.9 (2)
C26—C27—H27120.4C29—C28—C27119.3 (2)
C13—C14—C15118.6 (2)C29—C28—H28120.3
C13—C14—H14120.7C27—C28—H28120.3
C15—C14—H14120.7N5—C25—C24122.0 (2)
C19—O5—Zn2110.85 (12)N5—C25—C26115.46 (19)
N7—C16—N8113.64 (18)C24—C25—C26122.4 (2)
N7—C16—H16123.2C9—C8—C7119.3 (2)
N8—C16—H16123.2C9—C8—H8120.4
C30—C29—C28118.4 (2)C7—C8—H8120.4
C30—C29—H29120.8C6—C7—C8118.3 (2)
C28—C29—H29120.8C6—C7—H7120.8
C4—O2—Zn1111.83 (14)C8—C7—H7120.8
N6—C30—C29122.8 (2)N3—C10—C9121.6 (2)
N6—C30—H30118.6N3—C10—C11115.69 (19)
C29—C30—H30118.6C9—C10—C11122.7 (2)
C16—N8—C17104.38 (17)N5—C21—C22123.1 (2)
C16—N8—Zn2iii143.48 (14)N5—C21—H21118.5
C17—N8—Zn2iii108.64 (13)C22—C21—H21118.5
N4—C15—C14122.8 (2)C14—C13—C12119.3 (2)
N4—C15—H15118.6C14—C13—H13120.3
C14—C15—H15118.6C12—C13—H13120.3
N6—C26—C27121.1 (2)C24—C23—C22119.4 (2)
N6—C26—C25116.01 (19)C24—C23—H23120.3
C27—C26—C25122.8 (2)C22—C23—H23120.3
C1—N2—C2104.78 (17)C23—C22—C21118.3 (2)
C1—N2—Zn1iv142.73 (15)C23—C22—H22120.8
C2—N2—Zn1iv110.93 (13)C21—C22—H22120.8
C13—C12—C11119.2 (2)C20—O7—H7A109.5
C13—C12—H12120.4C5—O4—H4A109.5
C11—C12—H12120.4O8—C20—O7124.5 (2)
C16—N7—C18104.60 (17)O8—C20—C17117.60 (18)
C16—N7—Zn2141.11 (15)O7—C20—C17117.94 (19)
C18—N7—Zn2110.18 (13)O3—C5—O4123.9 (2)
C21—N5—C25118.36 (19)O3—C5—C2118.15 (19)
C21—N5—Zn2127.02 (15)O4—C5—C2117.94 (19)
C25—N5—Zn2113.93 (14)C20—O8—Zn2iii112.79 (13)
C6—N3—C10118.56 (19)C5—O3—Zn1iv111.57 (13)
N7—Zn2—O5—C1911.92 (14)O2—Zn1—N4—C1190.68 (16)
N8ii—Zn2—O5—C19110.69 (14)C1—N2—C2—C30.1 (2)
N6—Zn2—O5—C19150.35 (14)Zn1iv—N2—C2—C3169.07 (13)
N5—Zn2—O5—C1977.30 (14)C1—N2—C2—C5177.65 (18)
O1—C4—O2—Zn1176.07 (16)Zn1iv—N2—C2—C58.5 (2)
C3—C4—O2—Zn10.8 (2)C16—N8—C17—C180.2 (2)
N1—Zn1—O2—C42.57 (15)Zn2iii—N8—C17—C18163.96 (14)
N2i—Zn1—O2—C4101.74 (15)C16—N8—C17—C20177.20 (18)
N4—Zn1—O2—C4162.10 (15)Zn2iii—N8—C17—C2013.0 (2)
N3—Zn1—O2—C486.81 (15)Zn2—O5—C19—O6167.14 (16)
C28—C29—C30—N61.6 (4)Zn2—O5—C19—C1810.1 (2)
N7—C16—N8—C170.5 (2)C16—N7—C18—C170.4 (2)
N7—C16—N8—Zn2iii153.75 (18)Zn2—N7—C18—C17161.89 (14)
C13—C14—C15—N40.7 (3)C16—N7—C18—C19172.54 (18)
C28—C27—C26—N63.0 (4)Zn2—N7—C18—C1910.2 (2)
C28—C27—C26—C25173.3 (2)N8—C17—C18—N70.1 (2)
N1—C1—N2—C20.0 (2)C20—C17—C18—N7176.3 (2)
N1—C1—N2—Zn1iv163.13 (17)N8—C17—C18—C19170.8 (2)
N8—C16—N7—C180.6 (2)C20—C17—C18—C195.6 (4)
N8—C16—N7—Zn2152.40 (17)O5—C19—C18—N70.3 (3)
N8ii—Zn2—N7—C16102.5 (2)O6—C19—C18—N7177.10 (18)
N6—Zn2—N7—C1685.0 (3)O5—C19—C18—C17170.2 (2)
O8ii—Zn2—N7—C1622.2 (2)O6—C19—C18—C177.2 (3)
O5—Zn2—N7—C16163.3 (2)C15—N4—C11—C121.0 (3)
N5—Zn2—N7—C1680.5 (2)Zn1—N4—C11—C12174.34 (16)
N8ii—Zn2—N7—C18105.44 (14)C15—N4—C11—C10178.20 (19)
N6—Zn2—N7—C1867.0 (3)Zn1—N4—C11—C106.4 (2)
O8ii—Zn2—N7—C18174.29 (14)C13—C12—C11—N41.5 (3)
O5—Zn2—N7—C1811.19 (13)C13—C12—C11—C10177.7 (2)
N5—Zn2—N7—C1871.54 (14)C10—N3—C6—C70.6 (3)
N7—Zn2—N5—C212.31 (19)Zn1—N3—C6—C7179.70 (18)
N6—Zn2—N5—C21179.1 (2)C1—N1—C3—C20.1 (2)
O8ii—Zn2—N5—C2192.85 (19)Zn1—N1—C3—C2170.47 (14)
O5—Zn2—N5—C2181.61 (19)C1—N1—C3—C4175.13 (18)
N7—Zn2—N5—C25167.90 (15)Zn1—N1—C3—C44.8 (2)
N6—Zn2—N5—C2510.66 (14)N2—C2—C3—N10.1 (2)
O8ii—Zn2—N5—C2596.93 (15)C5—C2—C3—N1177.3 (2)
O5—Zn2—N5—C2588.60 (15)N2—C2—C3—C4174.3 (2)
N1—Zn1—N3—C620.78 (19)C5—C2—C3—C42.8 (4)
N2i—Zn1—N3—C6127.0 (3)O2—C4—C3—N12.6 (3)
N4—Zn1—N3—C6176.0 (2)O1—C4—C3—N1179.75 (18)
O3i—Zn1—N3—C680.36 (19)O2—C4—C3—C2171.3 (2)
O2—Zn1—N3—C699.01 (19)O1—C4—C3—C25.8 (3)
N1—Zn1—N3—C10159.51 (15)C30—C29—C28—C271.6 (4)
N2i—Zn1—N3—C1052.7 (4)C26—C27—C28—C290.6 (4)
N4—Zn1—N3—C103.69 (15)C21—N5—C25—C240.0 (3)
O3i—Zn1—N3—C1099.35 (15)Zn2—N5—C25—C24171.14 (17)
O2—Zn1—N3—C1081.28 (15)C21—N5—C25—C26176.39 (19)
N2—C1—N1—C30.1 (2)Zn2—N5—C25—C2612.5 (2)
N2—C1—N1—Zn1165.50 (17)C23—C24—C25—N50.5 (3)
N2i—Zn1—N1—C1100.2 (2)C23—C24—C25—C26176.6 (2)
N4—Zn1—N1—C1122.8 (3)N6—C26—C25—N56.7 (3)
N3—Zn1—N1—C173.4 (2)C27—C26—C25—N5169.8 (2)
O3i—Zn1—N1—C119.6 (2)N6—C26—C25—C24176.9 (2)
O2—Zn1—N1—C1168.5 (2)C27—C26—C25—C246.6 (3)
N2i—Zn1—N1—C395.09 (14)C10—C9—C8—C70.8 (3)
N4—Zn1—N1—C341.9 (3)N3—C6—C7—C80.1 (4)
N3—Zn1—N1—C391.32 (14)C9—C8—C7—C60.8 (4)
O3i—Zn1—N1—C3175.62 (13)C6—N3—C10—C90.6 (3)
O2—Zn1—N1—C33.76 (13)Zn1—N3—C10—C9179.70 (16)
C29—C30—N6—C260.7 (3)C6—N3—C10—C11178.08 (19)
C29—C30—N6—Zn2177.32 (18)Zn1—N3—C10—C111.7 (2)
C27—C26—N6—C303.0 (3)C8—C9—C10—N30.1 (3)
C25—C26—N6—C30173.52 (19)C8—C9—C10—C11178.7 (2)
C27—C26—N6—Zn2179.76 (17)N4—C11—C10—N33.0 (3)
C25—C26—N6—Zn23.2 (2)C12—C11—C10—N3177.8 (2)
N7—Zn2—N6—C30174.08 (19)N4—C11—C10—C9175.6 (2)
N8ii—Zn2—N6—C3013.41 (18)C12—C11—C10—C93.6 (3)
O8ii—Zn2—N6—C3065.99 (17)C25—N5—C21—C220.7 (3)
O5—Zn2—N6—C30110.43 (17)Zn2—N5—C21—C22169.15 (18)
N5—Zn2—N6—C30169.40 (18)C15—C14—C13—C120.2 (3)
N7—Zn2—N6—C262.6 (3)C11—C12—C13—C140.8 (3)
N8ii—Zn2—N6—C26169.94 (16)C25—C24—C23—C220.3 (4)
O8ii—Zn2—N6—C26110.66 (16)C24—C23—C22—C210.4 (4)
O5—Zn2—N6—C2672.92 (16)N5—C21—C22—C230.9 (4)
N5—Zn2—N6—C267.25 (15)N8—C17—C20—O83.5 (3)
C14—C15—N4—C110.1 (3)C18—C17—C20—O8172.7 (2)
C14—C15—N4—Zn1175.14 (16)N8—C17—C20—O7176.03 (19)
N1—Zn1—N4—C15129.0 (2)C18—C17—C20—O77.8 (4)
N2i—Zn1—N4—C158.41 (18)N2—C2—C5—O30.2 (3)
N3—Zn1—N4—C15179.40 (19)C3—C2—C5—O3177.1 (2)
O3i—Zn1—N4—C1587.96 (18)N2—C2—C5—O4178.63 (19)
O2—Zn1—N4—C1584.44 (18)C3—C2—C5—O41.7 (3)
N1—Zn1—N4—C1146.1 (3)O7—C20—O8—Zn2iii172.29 (18)
N2i—Zn1—N4—C11176.46 (15)C17—C20—O8—Zn2iii8.3 (2)
N3—Zn1—N4—C115.48 (15)O4—C5—O3—Zn1iv170.43 (17)
O3i—Zn1—N4—C1196.92 (16)C2—C5—O3—Zn1iv8.4 (2)
Symmetry codes: (i) x, y+1/2, z+1/2; (ii) x+1, y1/2, z+3/2; (iii) x+1, y+1/2, z+3/2; (iv) x, y1/2, z+1/2.
Hydrogen-bond geometry (Å, º) top
D—H···AD—HH···AD···AD—H···A
O7—H7A···O60.821.672.486 (2)180
O4—H4A···O10.821.672.485 (2)179
C9—H9···O50.932.573.387 (3)148
C12—H12···O50.932.483.246 (3)139
C12—H12···O60.932.503.182 (3)130
C13—H13···O8v0.932.453.077 (3)124
C16—H16···O7vi0.932.303.204 (2)165
Symmetry codes: (v) x+1, y+2, z+1; (vi) x, y+3/2, z+1/2.
 

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