A tetranuclear zinc–cerium complex: di­aqua­octa-μ-α-methyl­acryl­ato-di-α-methyl­acryl­ato­di­pyridine­dicerium­dizinc

Wu, B.; Guo, Y.-S.

doi:10.1107/S1600536804019440

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A tetranuclear zinc–cerium complex: diaquaocta-μ-α-methylacrylato-di-α-methylacrylatodipyridinediceriumdizinc

B. Wu and Y.-S. Guo

In the title complex, a centrosymmetric carboxylate-bridged tetranuclear zinc-cerium derivative, [Zn₂Ce₂(C₄H₅O₂)₁₀(C₅H₅N)₂(H₂O)₂], the Ce^III and Zn^II ions are bridged by two bidentate carboxylato groups [Ce

Zn 4.139 (1) Å], while the Ce ions are linked through the three bidentate carboxylate groups [Ce

Ce 4.430 (1) Å]. The Ce atoms are nine-coordinate and the coordination polyhedron is a distorted tricapped trigonal prism. The Zn atoms are four-coordinate with a distorted tetrahedral geometry.

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Supporting information

	Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536804019440/ng6041sup1.cif Contains datablocks global, I
	Structure factor file (CIF format) https://doi.org/10.1107/S1600536804019440/ng6041Isup2.hkl Contains datablock I

CCDC reference: 251595

checkCIF report

Key indicators

Single-crystal X-ray study
T = 273 K
Mean (C-C) = 0.005 Å
R factor = 0.024
wR factor = 0.056
Data-to-parameter ratio = 18.8

checkCIF/PLATON results

No syntax errors found



Alert level B
PLAT220_ALERT_2_B Large Non-Solvent    C     Ueq(max)/Ueq(min) ...       4.22 Ratio
PLAT232_ALERT_2_B Hirshfeld Test Diff (M-X)  Ce     -   O8      ..      10.86 su
PLAT232_ALERT_2_B Hirshfeld Test Diff (M-X)  Ce     -   O9      ..      11.21 su
PLAT242_ALERT_2_B Check Low    U(eq) as Compared to Neighbors  for        C11
PLAT420_ALERT_2_B D-H Without Acceptor       O11    -   H111   ...          ?

Alert level C
PLAT230_ALERT_2_C Hirshfeld Test Diff for    C2     -   C3      ..       5.01 su
PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X)  Ce     -   O7      ..       7.85 su
PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X)  Ce     -   O10     ..       8.32 su
PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X)  Ce     -   O11     ..       6.71 su
PLAT241_ALERT_2_C Check High   U(eq) as Compared to Neighbors  for         O1
PLAT241_ALERT_2_C Check High   U(eq) as Compared to Neighbors  for         O2
PLAT241_ALERT_2_C Check High   U(eq) as Compared to Neighbors  for         O3
PLAT241_ALERT_2_C Check High   U(eq) as Compared to Neighbors  for         O4
PLAT241_ALERT_2_C Check High   U(eq) as Compared to Neighbors  for         O5
PLAT241_ALERT_2_C Check High   U(eq) as Compared to Neighbors  for         O6
PLAT241_ALERT_2_C Check High   U(eq) as Compared to Neighbors  for         O7
PLAT242_ALERT_2_C Check Low    U(eq) as Compared to Neighbors  for         Ce
PLAT242_ALERT_2_C Check Low    U(eq) as Compared to Neighbors  for        C10
PLAT242_ALERT_2_C Check Low    U(eq) as Compared to Neighbors  for        C14
PLAT242_ALERT_2_C Check Low    U(eq) as Compared to Neighbors  for        C15
PLAT242_ALERT_2_C Check Low    U(eq) as Compared to Neighbors  for        C19
PLAT242_ALERT_2_C Check Low    U(eq) as Compared to Neighbors  for        C23
PLAT362_ALERT_2_C Short  C(sp3)-C(sp2) Bond  C11    -   C13    ...       1.40 Ang.
PLAT362_ALERT_2_C Short  C(sp3)-C(sp2) Bond  C23    -   C25    ...       1.40 Ang.

   0 ALERT level A = In general: serious problem
   5 ALERT level B = Potentially serious problem
  19 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
  24 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: Please provide missing details; cell refinement: Please provide missing details; data reduction: Please provide missing details; program(s) used to solve structure: SHELXS97 (Sheldrick, 1997); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: Please provide missing details; software used to prepare material for publication: Please provide missing details.

diaquaocta-µ-α-methylacrylato-di-α-methylacrylatodipyridinediceriumdizinc top

Crystal data top

[Zn₂Ce₂(C₄H₅O₂)₁₀(C₅H₅N)₂(H₂O)₂]	Z = 1
M_r = 1456.05	F(000) = 730
Triclinic, P1	D_x = 1.596 Mg m⁻³
Hall symbol: -P 1	Mo Kα radiation, λ = 0.71069 Å
a = 11.0788 (3) Å	Cell parameters from 5723 reflections
b = 11.9997 (3) Å	θ = 3.0–27.4°
c = 12.4604 (4) Å	µ = 2.33 mm⁻¹
α = 99.336 (1)°	T = 273 K
β = 106.300 (1)°	Prism, colourless
γ = 101.556 (1)°	0.30 × 0.20 × 0.17 mm
V = 1515.09 (8) Å³

Data collection top

Rigaku RAXIS-RAPID diffractometer	6882 independent reflections
Radiation source: fine-focus sealed tube	6062 reflections with I > 2σ(I)
Graphite monochromator	R_int = 0.022
Detector resolution: 10.00 pixels mm^-1	θ_max = 27.4°, θ_min = 1.8°
ω scans	h = −14→14
Absorption correction: multi-scan (ABSCOR; Higashi, 1995)	k = −15→15
T_min = 0.578, T_max = 0.673	l = −16→16
14807 measured reflections

Refinement top

Refinement on F²	Primary atom site location: structure-invariant direct methods
Least-squares matrix: full	Secondary atom site location: difference Fourier map
R[F² > 2σ(F²)] = 0.024	Hydrogen site location: inferred from neighbouring sites
wR(F²) = 0.056	H atoms treated by a mixture of independent and constrained refinement
S = 1.04	w = 1/[σ²(F_o²) + (0.0308P)² + 0.3646P] where P = (F_o² + 2F_c²)/3
6882 reflections	(Δ/σ)_max = 0.003
366 parameters	Δρ_max = 0.33 e Å⁻³
3 restraints	Δρ_min = −0.42 e Å⁻³

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

	x	y	z	U_iso*/U_eq
Ce	0.602287 (12)	0.627898 (10)	0.661472 (10)	0.03596 (5)
Zn	0.68544 (3)	0.94677 (2)	0.88910 (2)	0.04858 (8)
O1	0.6557 (2)	0.84467 (17)	0.98916 (16)	0.0638 (5)
O2	0.6600 (2)	0.69150 (17)	0.86784 (14)	0.0618 (5)
O3	0.5294 (2)	0.96707 (17)	0.78120 (18)	0.0682 (5)
O4	0.4977 (2)	0.78864 (18)	0.68588 (19)	0.0711 (6)
O5	0.83278 (18)	0.96538 (17)	0.83236 (17)	0.0637 (5)
O6	0.78266 (17)	0.80079 (15)	0.70150 (16)	0.0570 (4)
O7	0.38707 (17)	0.54265 (17)	0.69387 (14)	0.0554 (4)
O8	0.37570 (14)	0.50382 (14)	0.51217 (13)	0.0423 (3)
O9	0.59969 (16)	0.42511 (15)	0.70281 (14)	0.0484 (4)
O10	0.79216 (16)	0.54774 (16)	0.75284 (15)	0.0532 (4)
O11	0.5755 (2)	0.72205 (18)	0.48520 (16)	0.0654 (5)
N1	0.7484 (2)	1.10464 (17)	1.00873 (17)	0.0490 (5)
C1	0.8739 (3)	1.1606 (2)	1.0515 (3)	0.0654 (8)
H1	0.9335	1.1290	1.0257	0.079*
C2	0.9180 (4)	1.2652 (3)	1.1339 (3)	0.0873 (11)
H2	1.0062	1.3035	1.1633	0.105*
C3	0.8296 (4)	1.3107 (3)	1.1709 (3)	0.0839 (11)
H3	0.8574	1.3806	1.2264	0.101*
C4	0.7023 (4)	1.2546 (3)	1.1273 (3)	0.0768 (9)
H4	0.6410	1.2849	1.1519	0.092*
C5	0.6649 (3)	1.1518 (3)	1.0459 (2)	0.0636 (7)
H5	0.5768	1.1133	1.0152	0.076*
C6	0.6533 (2)	0.7378 (2)	0.96173 (19)	0.0469 (5)
C7	0.6411 (3)	0.6651 (2)	1.0464 (2)	0.0571 (6)
C8	0.5991 (4)	0.7065 (4)	1.1339 (3)	0.0843 (10)
H8A	0.5883	0.6619	1.1867	0.101*
H8B	0.5812	0.7793	1.1410	0.101*
C9	0.6717 (4)	0.5538 (3)	1.0271 (3)	0.0821 (10)
H9A	0.6527	0.5120	1.0823	0.123*
H9B	0.7625	0.5663	1.0351	0.123*
H9C	0.6204	0.5091	0.9509	0.123*
C10	0.4673 (2)	0.8814 (2)	0.6977 (2)	0.0485 (5)
C11	0.3517 (3)	0.8957 (3)	0.6097 (3)	0.0695 (8)
C12	0.3371 (5)	1.0084 (4)	0.6117 (6)	0.177 (3)
H12A	0.2659	1.0206	0.5587	0.213*
H12B	0.3986	1.0716	0.6660	0.213*
C13	0.2655 (4)	0.7947 (4)	0.5321 (3)	0.1008 (13)
H13A	0.2104	0.8160	0.4685	0.151*
H13B	0.2130	0.7535	0.5700	0.151*
H13C	0.3140	0.7454	0.5045	0.151*
C14	0.8476 (2)	0.9023 (2)	0.7489 (2)	0.0456 (5)
C15	0.9524 (3)	0.9571 (3)	0.7055 (3)	0.0667 (8)
C16	1.0352 (4)	1.0724 (4)	0.7690 (5)	0.1205 (17)
H16A	1.1081	1.0905	0.7418	0.181*
H16B	1.0660	1.0734	0.8493	0.181*
H16C	0.9862	1.1295	0.7578	0.181*
C17	0.9638 (5)	0.8980 (4)	0.6097 (4)	0.1237 (19)
H17A	1.0275	0.9305	0.5803	0.148*
H17B	0.9081	0.8243	0.5724	0.148*
C18	0.3239 (2)	0.4951 (2)	0.59121 (19)	0.0419 (5)
C19	0.1848 (2)	0.4285 (2)	0.5597 (2)	0.0517 (6)
C20	0.1004 (3)	0.4229 (3)	0.4554 (3)	0.0729 (9)
H20A	0.0133	0.3830	0.4358	0.087*
H20B	0.1295	0.4590	0.4033	0.087*
C21	0.1467 (3)	0.3745 (4)	0.6455 (3)	0.0885 (11)
H21A	0.0534	0.3500	0.6230	0.133*
H21B	0.1801	0.4299	0.7184	0.133*
H21C	0.1814	0.3078	0.6519	0.133*
C22	0.7226 (2)	0.4483 (2)	0.74527 (19)	0.0456 (5)
C23	0.7854 (3)	0.3574 (3)	0.7872 (2)	0.0599 (7)
C24	0.9202 (3)	0.3894 (4)	0.8396 (4)	0.1013 (14)
H24A	0.9626	0.3349	0.8662	0.122*
H24B	0.9677	0.4654	0.8479	0.122*
C25	0.7060 (4)	0.2450 (3)	0.7710 (3)	0.0899 (11)
H25A	0.6656	0.2108	0.6902	0.135*
H25B	0.6401	0.2501	0.8063	0.135*
H25C	0.7582	0.1971	0.8054	0.135*
H111	0.584 (4)	0.7950 (10)	0.493 (3)	0.143 (19)*
H112	0.525 (3)	0.686 (2)	0.4188 (15)	0.092 (12)*

Atomic displacement parameters (Å²) top

	U¹¹	U²²	U³³	U¹²	U¹³	U²³
Ce	0.03895 (7)	0.03047 (7)	0.03285 (7)	0.00357 (4)	0.00955 (5)	0.00242 (4)
Zn	0.05048 (16)	0.03740 (15)	0.04845 (15)	0.00332 (12)	0.01294 (13)	−0.00033 (11)
O1	0.0868 (14)	0.0467 (11)	0.0549 (10)	0.0078 (10)	0.0288 (10)	0.0048 (8)
O2	0.0840 (14)	0.0586 (11)	0.0374 (8)	0.0146 (10)	0.0172 (9)	0.0056 (8)
O3	0.0618 (12)	0.0505 (11)	0.0700 (12)	0.0096 (9)	0.0009 (10)	−0.0045 (9)
O4	0.0668 (12)	0.0556 (12)	0.0822 (14)	0.0280 (10)	0.0113 (11)	0.0002 (10)
O5	0.0589 (11)	0.0498 (11)	0.0725 (12)	−0.0009 (9)	0.0280 (10)	−0.0060 (9)
O6	0.0536 (10)	0.0443 (10)	0.0622 (10)	−0.0047 (8)	0.0210 (9)	0.0003 (8)
O7	0.0509 (10)	0.0639 (12)	0.0436 (9)	0.0038 (8)	0.0188 (8)	−0.0011 (8)
O8	0.0405 (8)	0.0427 (9)	0.0425 (8)	0.0064 (7)	0.0183 (7)	0.0032 (6)
O9	0.0471 (9)	0.0447 (9)	0.0479 (9)	0.0050 (7)	0.0112 (8)	0.0114 (7)
O10	0.0470 (9)	0.0479 (10)	0.0561 (10)	0.0057 (8)	0.0080 (8)	0.0118 (8)
O11	0.0856 (15)	0.0451 (11)	0.0486 (10)	0.0018 (10)	0.0055 (10)	0.0126 (8)
N1	0.0532 (12)	0.0382 (11)	0.0451 (10)	0.0042 (9)	0.0100 (9)	0.0015 (8)
C1	0.0548 (15)	0.0508 (16)	0.0700 (17)	0.0085 (12)	0.0007 (14)	−0.0014 (13)
C2	0.071 (2)	0.061 (2)	0.084 (2)	−0.0055 (16)	−0.0173 (18)	−0.0049 (17)
C3	0.110 (3)	0.0511 (18)	0.0628 (18)	0.0150 (19)	0.0029 (19)	−0.0107 (14)
C4	0.104 (3)	0.0545 (18)	0.0679 (18)	0.0197 (18)	0.0323 (19)	−0.0035 (14)
C5	0.0676 (17)	0.0513 (16)	0.0644 (16)	0.0063 (13)	0.0255 (14)	−0.0029 (13)
C6	0.0468 (13)	0.0470 (13)	0.0361 (11)	0.0006 (10)	0.0092 (10)	0.0018 (9)
C7	0.0641 (16)	0.0540 (15)	0.0434 (12)	0.0014 (12)	0.0125 (12)	0.0099 (11)
C8	0.110 (3)	0.092 (3)	0.0658 (19)	0.024 (2)	0.0461 (19)	0.0291 (18)
C9	0.105 (3)	0.062 (2)	0.072 (2)	0.0123 (18)	0.0209 (19)	0.0241 (16)
C10	0.0429 (12)	0.0461 (14)	0.0536 (13)	0.0100 (10)	0.0142 (11)	0.0076 (11)
C11	0.0500 (15)	0.068 (2)	0.0776 (19)	0.0139 (14)	0.0041 (14)	0.0127 (15)
C12	0.114 (4)	0.085 (3)	0.258 (7)	0.026 (3)	−0.061 (4)	0.050 (4)
C13	0.069 (2)	0.109 (3)	0.089 (3)	0.022 (2)	−0.010 (2)	−0.008 (2)
C14	0.0371 (11)	0.0410 (13)	0.0528 (13)	0.0038 (9)	0.0104 (10)	0.0101 (10)
C15	0.0615 (17)	0.0502 (16)	0.094 (2)	0.0049 (13)	0.0392 (16)	0.0196 (15)
C16	0.103 (3)	0.072 (3)	0.173 (5)	−0.027 (2)	0.072 (3)	0.004 (3)
C17	0.152 (4)	0.090 (3)	0.150 (4)	−0.006 (3)	0.117 (4)	0.011 (3)
C18	0.0420 (11)	0.0389 (12)	0.0442 (11)	0.0103 (9)	0.0171 (10)	0.0029 (9)
C19	0.0429 (13)	0.0542 (15)	0.0542 (14)	0.0042 (11)	0.0222 (11)	0.0011 (11)
C20	0.0409 (14)	0.101 (3)	0.0698 (18)	0.0091 (15)	0.0186 (14)	0.0123 (17)
C21	0.069 (2)	0.107 (3)	0.075 (2)	−0.0160 (19)	0.0314 (18)	0.0163 (19)
C22	0.0545 (14)	0.0452 (13)	0.0356 (11)	0.0128 (11)	0.0126 (10)	0.0091 (9)
C23	0.0704 (18)	0.0609 (17)	0.0547 (14)	0.0253 (14)	0.0192 (14)	0.0220 (13)
C24	0.068 (2)	0.089 (3)	0.144 (4)	0.034 (2)	0.009 (2)	0.047 (3)
C25	0.102 (3)	0.070 (2)	0.112 (3)	0.029 (2)	0.034 (2)	0.053 (2)

Geometric parameters (Å, º) top

Ce—O2	2.4183 (16)	C7—C9	1.442 (4)
Ce—O4	2.4614 (19)	C8—H8A	0.9300
Ce—O6	2.4474 (17)	C8—H8B	0.9300
Ce—O7	2.5674 (18)	C9—H9A	0.9600
Ce—O8	2.6385 (15)	C9—H9B	0.9600
Ce—O8ⁱ	2.5652 (15)	C9—H9C	0.9600
Ce—O9	2.5641 (17)	C10—C11	1.495 (4)
Ce—O10	2.5432 (17)	C11—C12	1.390 (5)
Ce—O11	2.6004 (19)	C11—C13	1.398 (5)
Zn—O1	1.931 (2)	C12—H12A	0.9300
Zn—O3	1.956 (2)	C12—H12B	0.9300
Zn—O5	1.9409 (19)	C13—H13A	0.9600
Zn—N1	2.0658 (19)	C13—H13B	0.9600
O1—C6	1.266 (3)	C13—H13C	0.9600
O2—C6	1.240 (3)	C14—C15	1.494 (4)
O3—C10	1.257 (3)	C15—C17	1.339 (5)
O4—C10	1.224 (3)	C15—C16	1.452 (5)
O5—C14	1.254 (3)	C16—H16A	0.9600
O6—C14	1.236 (3)	C16—H16B	0.9600
O7—C18	1.246 (3)	C16—H16C	0.9600
O8—C18	1.279 (3)	C17—H17A	0.9300
O8—Ceⁱ	2.5652 (15)	C17—H17B	0.9300
O9—C22	1.268 (3)	C18—C19	1.495 (3)
O10—C22	1.257 (3)	C19—C20	1.354 (4)
O11—H111	0.847 (10)	C19—C21	1.453 (4)
O11—H112	0.844 (10)	C20—H20A	0.9300
N1—C5	1.325 (4)	C20—H20B	0.9300
N1—C1	1.327 (3)	C21—H21A	0.9600
C1—C2	1.386 (4)	C21—H21B	0.9600
C1—H1	0.9300	C21—H21C	0.9600
C2—C3	1.362 (5)	C22—C23	1.495 (4)
C2—H2	0.9300	C23—C24	1.395 (4)
C3—C4	1.345 (5)	C23—C25	1.404 (5)
C3—H3	0.9300	C24—H24A	0.9300
C4—C5	1.370 (4)	C24—H24B	0.9300
C4—H4	0.9300	C25—H25A	0.9600
C5—H5	0.9300	C25—H25B	0.9600
C6—C7	1.490 (4)	C25—H25C	0.9600
C7—C8	1.362 (4)

O2—Ce—O4	76.57 (7)	O2—C6—O1	122.8 (2)
O2—Ce—O6	79.16 (7)	O2—C6—C7	119.1 (2)
O2—Ce—O7	78.35 (6)	O1—C6—C7	118.1 (2)
O2—Ce—O8	128.29 (6)	C8—C7—C9	124.8 (3)
O2—Ce—O8ⁱ	148.86 (6)	C8—C7—C6	118.3 (3)
O2—Ce—O9	84.03 (6)	C9—C7—C6	116.9 (3)
O2—Ce—O10	72.22 (6)	C7—C8—H8A	120.0
O2—Ce—O11	137.89 (7)	C7—C8—H8B	120.0
O4—Ce—O6	77.73 (7)	H8A—C8—H8B	120.0
O4—Ce—O7	72.93 (7)	C7—C9—H9A	109.5
O4—Ce—O8	86.82 (6)	C7—C9—H9B	109.5
O4—Ce—O8ⁱ	134.43 (6)	H9A—C9—H9B	109.5
O4—Ce—O9	141.34 (7)	C7—C9—H9C	109.5
O4—Ce—O10	144.57 (6)	H9A—C9—H9C	109.5
O4—Ce—O11	70.14 (8)	H9B—C9—H9C	109.5
O6—Ce—O7	146.35 (6)	O4—C10—O3	123.1 (2)
O6—Ce—O8	144.42 (6)	O4—C10—C11	119.5 (2)
O6—Ce—O8ⁱ	101.99 (5)	O3—C10—C11	117.4 (2)
O6—Ce—O9	131.09 (6)	C12—C11—C13	124.8 (3)
O6—Ce—O10	80.30 (6)	C12—C11—C10	117.6 (3)
O6—Ce—O11	69.32 (6)	C13—C11—C10	117.6 (3)
O7—Ce—O8	49.94 (5)	C11—C12—H12A	120.0
O7—Ce—O8ⁱ	110.20 (5)	C11—C12—H12B	120.0
O7—Ce—O9	70.56 (6)	H12A—C12—H12B	120.0
O7—Ce—O10	115.64 (6)	C11—C13—H13A	109.5
O7—Ce—O11	114.14 (7)	C11—C13—H13B	109.5
O8—Ce—O8ⁱ	66.97 (6)	H13A—C13—H13B	109.5
O8—Ce—O9	79.42 (5)	C11—C13—H13C	109.5
O8—Ce—O10	125.93 (5)	H13A—C13—H13C	109.5
O8—Ce—O11	75.34 (6)	H13B—C13—H13C	109.5
O8ⁱ—Ce—O9	71.75 (5)	O6—C14—O5	124.9 (2)
O8ⁱ—Ce—O10	77.28 (5)	O6—C14—C15	119.2 (2)
O8ⁱ—Ce—O11	67.54 (6)	O5—C14—C15	115.9 (2)
O9—Ce—O10	50.80 (5)	C17—C15—C16	123.6 (3)
O9—Ce—O11	137.89 (6)	C17—C15—C14	118.2 (3)
O10—Ce—O11	126.19 (7)	C16—C15—C14	118.1 (3)
O1—Zn—O3	115.89 (10)	C15—C16—H16A	109.5
O1—Zn—O5	124.07 (9)	C15—C16—H16B	109.5
O1—Zn—N1	98.50 (8)	H16A—C16—H16B	109.5
O3—Zn—O5	112.78 (10)	C15—C16—H16C	109.5
O3—Zn—N1	101.22 (8)	H16A—C16—H16C	109.5
O5—Zn—N1	97.50 (8)	H16B—C16—H16C	109.5
C6—O1—Zn	120.27 (16)	C15—C17—H17A	120.0
C6—O2—Ce	158.65 (19)	C15—C17—H17B	120.0
C10—O3—Zn	115.70 (17)	H17A—C17—H17B	120.0
C10—O4—Ce	167.9 (2)	O7—C18—O8	121.1 (2)
C14—O5—Zn	129.11 (16)	O7—C18—C19	119.4 (2)
C14—O6—Ce	155.14 (17)	O8—C18—C19	119.5 (2)
C18—O7—Ce	96.60 (14)	C20—C19—C21	123.2 (3)
C18—O8—Ceⁱ	139.15 (14)	C20—C19—C18	119.5 (2)
C18—O8—Ce	92.38 (12)	C21—C19—C18	117.3 (2)
Ceⁱ—O8—Ce	113.03 (5)	C19—C20—H20A	120.0
C22—O9—Ce	93.76 (14)	C19—C20—H20B	120.0
C22—O10—Ce	95.03 (14)	H20A—C20—H20B	120.0
Ce—O11—H111	121 (3)	C19—C21—H21A	109.5
Ce—O11—H112	122 (2)	C19—C21—H21B	109.5
H111—O11—H112	110.0 (17)	H21A—C21—H21B	109.5
C5—N1—C1	118.3 (2)	C19—C21—H21C	109.5
C5—N1—Zn	120.90 (18)	H21A—C21—H21C	109.5
C1—N1—Zn	120.82 (19)	H21B—C21—H21C	109.5
N1—C1—C2	121.5 (3)	O10—C22—O9	120.4 (2)
N1—C1—H1	119.3	O10—C22—C23	119.7 (2)
C2—C1—H1	119.3	O9—C22—C23	119.9 (2)
C3—C2—C1	118.7 (3)	C24—C23—C25	123.9 (3)
C3—C2—H2	120.7	C24—C23—C22	117.7 (3)
C1—C2—H2	120.7	C25—C23—C22	118.4 (3)
C4—C3—C2	120.0 (3)	C23—C24—H24A	120.0
C4—C3—H3	120.0	C23—C24—H24B	120.0
C2—C3—H3	120.0	H24A—C24—H24B	120.0
C3—C4—C5	118.4 (3)	C23—C25—H25A	109.5
C3—C4—H4	120.8	C23—C25—H25B	109.5
C5—C4—H4	120.8	H25A—C25—H25B	109.5
N1—C5—C4	123.1 (3)	C23—C25—H25C	109.5
N1—C5—H5	118.5	H25A—C25—H25C	109.5
C4—C5—H5	118.5	H25B—C25—H25C	109.5

Symmetry code: (i) −x+1, −y+1, −z+1.

Hydrogen-bond geometry (Å, º) top

D—H···A	D—H	H···A	D···A	D—H···A
O11—H112···O9ⁱ	0.84 (2)	1.85 (2)	2.666 (3)	163 (1)

Symmetry code: (i) −x+1, −y+1, −z+1.

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