Literature DB >> 21587377

Poly[[tris-(N,N-dimethyl-formamide)(μ(4)-5-nitro-isophthalato)(μ(3)-5-nitro-isophthalato)dicobalt(II)] N,N-dimethyl-formamide monosolvate].

Meng Su, Zhan-Dong Huang, Huang Sun, Guang Yang, Seik Weng Ng.   

Abstract

In the polymeric title compound, [Co(2)(C(3)H(7)NO)(3)(C(8)H(3)NO(6))(2)]·C(3)H(7)NO, one 5-nitro-isophthalate dianion has its two carboxyl-ate groups chelating to one Co(II) atom while simultaneously coordinating to another metal atom in a μ(4)-bridging mode. The other 5-nitro-isophthalte dianion has one carboxyl-ate group chelating to a metal atom whereas the other bridges two metal atoms in a μ(3)-bridging mode. Both metal atoms show an octa-hedral coordination. The polymer adopts a layer motif, with the lattice dimethyl-formamide mol-ecules occupying the space between adjacent layers.

Entities:  

Year:  2010        PMID: 21587377      PMCID: PMC2983205          DOI: 10.1107/S1600536810035270

Source DB:  PubMed          Journal:  Acta Crystallogr Sect E Struct Rep Online        ISSN: 1600-5368


Related literature

For adducts of cobalt 5-nitro­isophthalate, see: Chen et al. (2006 ▶); Du et al. (2008 ▶); Guo et al. (2006 ▶); Liu et al. (2008 ▶); Luo et al. (2003 ▶); Wang et al. (2008 ▶, 2009 ▶); Xie et al. (2006 ▶); Ye et al. (2008a ▶,b ▶); Yuan et al. (2009 ▶); Zhou et al. (2004 ▶).

Experimental

Crystal data

[Co2(C3H7NO)3(C8H3NO6)2]·C3H7NO M = 828.47 Monoclinic, a = 10.0833 (12) Å b = 17.0887 (19) Å c = 21.074 (2) Å β = 92.910 (2)° V = 3626.7 (7) Å3 Z = 4 Mo Kα radiation μ = 0.99 mm−1 T = 293 K 0.40 × 0.30 × 0.30 mm

Data collection

Bruker SMART diffractometer Absorption correction: multi-scan (SADABS; Sheldrick, 1996 ▶) T min = 0.796, T max = 1 21143 measured reflections 7876 independent reflections 5128 reflections with I > 2σ(I) R int = 0.036

Refinement

R[F 2 > 2σ(F 2)] = 0.048 wR(F 2) = 0.132 S = 0.99 7876 reflections 477 parameters 54 restraints H-atom parameters constrained Δρmax = 0.57 e Å−3 Δρmin = −0.45 e Å−3 Data collection: SMART (Bruker, 1999 ▶); cell refinement: SAINT (Bruker, 1999 ▶); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 2008 ▶); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008 ▶); molecular graphics: OLEX (Dolomanov et al., 2003 ▶) and X-SEED (Barbour, 2001 ▶); software used to prepare material for publication: publCIF (Westrip, 2010 ▶). Crystal structure: contains datablocks global, I. DOI: 10.1107/S1600536810035270/bt5344sup1.cif Structure factors: contains datablocks I. DOI: 10.1107/S1600536810035270/bt5344Isup2.hkl Additional supplementary materials: crystallographic information; 3D view; checkCIF report
[Co2(C3H7NO)3(C8H3NO6)2]·C3H7NOF(000) = 1704
Mr = 828.47Dx = 1.517 Mg m3
Monoclinic, P21/cMo Kα radiation, λ = 0.71073 Å
Hall symbol: -P 2ybcCell parameters from 1014 reflections
a = 10.0833 (12) Åθ = 2.3–26.7°
b = 17.0887 (19) ŵ = 0.99 mm1
c = 21.074 (2) ÅT = 293 K
β = 92.910 (2)°Block, purple
V = 3626.7 (7) Å30.40 × 0.30 × 0.30 mm
Z = 4
Bruker SMART diffractometer7876 independent reflections
Radiation source: fine-focus sealed tube5128 reflections with I > 2σ(I)
graphiteRint = 0.036
ω scansθmax = 27.0°, θmin = 2.0°
Absorption correction: multi-scan (SADABS; Sheldrick, 1996)h = −12→11
Tmin = 0.796, Tmax = 1k = −21→20
21143 measured reflectionsl = −24→26
Refinement on F2Primary atom site location: structure-invariant direct methods
Least-squares matrix: fullSecondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.048Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.132H-atom parameters constrained
S = 0.99w = 1/[σ2(Fo2) + (0.0741P)2 + 0.1674P] where P = (Fo2 + 2Fc2)/3
7876 reflections(Δ/σ)max = 0.001
477 parametersΔρmax = 0.57 e Å3
54 restraintsΔρmin = −0.45 e Å3
xyzUiso*/Ueq
Co10.54070 (4)0.62850 (2)0.36883 (2)0.03535 (14)
Co20.75875 (4)0.69413 (2)0.25276 (2)0.03577 (14)
O10.7161 (2)0.61369 (15)0.41609 (12)0.0509 (6)
O20.8391 (2)0.65261 (16)0.33703 (12)0.0536 (7)
O31.3188 (2)0.63449 (18)0.35333 (13)0.0615 (8)
O41.4234 (2)0.60440 (14)0.44350 (11)0.0452 (6)
O51.1571 (3)0.5635 (2)0.63158 (14)0.0841 (10)
O60.9466 (3)0.5792 (2)0.62357 (14)0.0890 (11)
O70.5916 (2)0.62286 (13)0.25975 (14)0.0584 (7)
O80.5266 (3)0.52567 (16)0.31596 (14)0.0641 (8)
O90.3476 (2)0.28716 (13)0.21118 (12)0.0447 (6)
O100.4601 (3)0.24599 (14)0.12880 (13)0.0548 (7)
O110.6418 (4)0.4515 (2)−0.00474 (17)0.0982 (12)
O120.7008 (6)0.5587 (3)0.0369 (2)0.160 (2)
O130.8704 (3)0.60593 (15)0.20713 (13)0.0634 (8)
O140.9230 (3)0.76957 (15)0.25177 (13)0.0619 (7)
O150.6900 (3)0.72766 (15)0.16294 (12)0.0599 (7)
O161.0622 (10)0.7746 (4)0.5743 (4)0.236 (4)
N11.0547 (3)0.5774 (2)0.60062 (15)0.0565 (8)
N20.6509 (4)0.4948 (3)0.03991 (19)0.0781 (11)
N31.0517 (3)0.53017 (18)0.20161 (17)0.0715 (11)
N41.1460 (3)0.7832 (2)0.24308 (18)0.0788 (11)
N50.6043 (3)0.82156 (18)0.09718 (13)0.0572 (9)
N60.9621 (7)0.8134 (3)0.4885 (3)0.1170 (18)
C10.8239 (3)0.62893 (19)0.39168 (17)0.0385 (8)
C20.9490 (3)0.61717 (18)0.43297 (16)0.0361 (7)
C31.0713 (3)0.62258 (19)0.40590 (16)0.0390 (8)
H31.07520.63460.36300.047*
C41.1879 (3)0.6102 (2)0.44235 (16)0.0381 (8)
C51.1835 (3)0.5940 (2)0.50582 (16)0.0411 (8)
H51.26120.58510.53050.049*
C61.0611 (3)0.5913 (2)0.53248 (16)0.0399 (8)
C70.9434 (3)0.60096 (19)0.49684 (16)0.0394 (8)
H70.86210.59660.51550.047*
C81.3176 (3)0.6162 (2)0.41043 (18)0.0411 (8)
C90.5582 (3)0.5522 (2)0.2641 (2)0.0454 (9)
C100.5511 (3)0.50093 (19)0.20667 (17)0.0400 (8)
C110.4916 (3)0.42749 (18)0.21119 (16)0.0389 (8)
H110.45620.41270.24930.047*
C120.4843 (3)0.37624 (18)0.16031 (16)0.0374 (7)
C130.5376 (3)0.3984 (2)0.10396 (17)0.0458 (9)
H130.53580.36460.06940.055*
C140.5937 (4)0.4717 (2)0.10006 (18)0.0525 (10)
C150.6007 (4)0.5237 (2)0.15018 (18)0.0509 (9)
H150.63820.57300.14580.061*
C160.4250 (3)0.29629 (19)0.16771 (17)0.0391 (8)
C170.9538 (4)0.5620 (2)0.2306 (2)0.0616 (11)
H170.94740.54990.27340.074*
C181.0674 (8)0.5465 (4)0.1361 (3)0.180 (4)
H18A1.00400.58550.12190.269*
H18B1.05320.49960.11170.269*
H18C1.15560.56560.13060.269*
C191.1493 (5)0.4793 (3)0.2333 (3)0.132 (3)
H19A1.12190.46700.27510.198*
H19B1.23370.50540.23650.198*
H19C1.15690.43190.20920.198*
C201.0260 (4)0.7575 (2)0.2246 (2)0.0653 (11)
H201.01930.72760.18770.078*
C211.1625 (6)0.8289 (5)0.2992 (3)0.167 (4)
H21A1.08660.82240.32440.250*
H21B1.17100.88310.28800.250*
H21C1.24090.81230.32320.250*
C221.2638 (5)0.7666 (4)0.2097 (3)0.123 (2)
H22A1.23990.73910.17110.184*
H22B1.32280.73490.23600.184*
H22C1.30710.81480.19990.184*
C230.6784 (3)0.7969 (2)0.14649 (15)0.0503 (9)
H230.72520.83420.17070.060*
C240.5276 (6)0.7661 (3)0.0572 (2)0.099 (2)
H24A0.54590.71380.07160.149*
H24B0.55200.77130.01390.149*
H24C0.43460.77690.05970.149*
C250.5940 (4)0.9038 (2)0.08090 (19)0.0641 (11)
H25A0.65640.93320.10730.096*
H25B0.50560.92180.08750.096*
H25C0.61320.91080.03710.096*
C260.9403 (11)0.7817 (4)0.5443 (5)0.175 (4)
H260.85890.76730.55960.210*
C271.0928 (11)0.8320 (7)0.4728 (6)0.267 (6)
H27A1.15420.81430.50610.400*
H27B1.10090.88760.46800.400*
H27C1.11230.80660.43370.400*
C280.8669 (10)0.8325 (5)0.4374 (4)0.176 (4)
H28A0.78260.80960.44560.265*
H28B0.89720.81240.39810.265*
H28C0.85770.88840.43440.265*
U11U22U33U12U13U23
Co10.0234 (2)0.0368 (2)0.0459 (3)−0.00044 (18)0.00267 (17)0.0023 (2)
Co20.0301 (2)0.0324 (2)0.0445 (3)0.00062 (18)−0.00140 (18)0.00308 (19)
O10.0218 (12)0.0657 (16)0.0653 (17)−0.0010 (11)0.0021 (11)0.0089 (13)
O20.0333 (14)0.0776 (18)0.0495 (16)0.0072 (13)−0.0015 (11)0.0134 (14)
O30.0308 (14)0.105 (2)0.0496 (17)−0.0015 (14)0.0063 (11)0.0135 (15)
O40.0236 (12)0.0602 (15)0.0515 (15)0.0024 (11)0.0001 (10)0.0052 (12)
O50.073 (2)0.128 (3)0.0500 (18)0.019 (2)−0.0080 (15)0.0166 (18)
O60.066 (2)0.144 (3)0.059 (2)0.004 (2)0.0244 (16)0.0161 (19)
O70.0414 (15)0.0348 (13)0.098 (2)−0.0069 (11)−0.0058 (14)−0.0051 (13)
O80.075 (2)0.0554 (17)0.0625 (19)−0.0133 (15)0.0114 (15)−0.0148 (14)
O90.0435 (14)0.0315 (12)0.0598 (16)−0.0068 (10)0.0106 (12)−0.0034 (11)
O100.0599 (17)0.0379 (14)0.0683 (18)−0.0077 (12)0.0183 (13)−0.0083 (13)
O110.128 (3)0.104 (3)0.066 (2)−0.006 (2)0.035 (2)0.008 (2)
O120.243 (6)0.148 (4)0.096 (3)−0.123 (4)0.055 (3)0.006 (3)
O130.0591 (18)0.0579 (16)0.0722 (19)0.0208 (14)−0.0057 (14)−0.0053 (14)
O140.0412 (15)0.0610 (17)0.085 (2)−0.0156 (13)0.0186 (14)−0.0011 (15)
O150.080 (2)0.0464 (15)0.0516 (16)0.0092 (14)−0.0116 (14)0.0047 (13)
O160.329 (8)0.147 (5)0.223 (6)0.002 (6)−0.068 (6)−0.057 (5)
N10.054 (2)0.070 (2)0.046 (2)0.0064 (17)0.0045 (17)0.0046 (16)
N20.087 (3)0.089 (3)0.059 (3)−0.026 (2)0.013 (2)0.011 (2)
N30.072 (3)0.068 (2)0.077 (3)0.031 (2)0.028 (2)0.009 (2)
N40.045 (2)0.097 (3)0.095 (3)−0.014 (2)0.008 (2)0.003 (2)
N50.067 (2)0.0534 (19)0.0494 (19)0.0082 (17)−0.0100 (16)0.0036 (15)
N60.134 (5)0.098 (4)0.120 (4)−0.012 (3)0.020 (4)−0.034 (3)
C10.0256 (17)0.0405 (18)0.049 (2)0.0047 (14)0.0006 (14)0.0002 (16)
C20.0226 (15)0.0384 (17)0.047 (2)0.0009 (13)0.0020 (13)0.0032 (15)
C30.0296 (17)0.0478 (19)0.0393 (19)−0.0016 (15)0.0001 (14)0.0044 (15)
C40.0255 (16)0.0474 (19)0.041 (2)−0.0011 (14)0.0003 (13)0.0005 (15)
C50.0293 (17)0.0479 (19)0.046 (2)0.0005 (15)−0.0047 (14)−0.0006 (16)
C60.0349 (18)0.0449 (19)0.0397 (19)0.0038 (15)0.0018 (14)0.0041 (15)
C70.0262 (17)0.0438 (18)0.049 (2)0.0032 (14)0.0089 (14)0.0034 (16)
C80.0228 (17)0.049 (2)0.052 (2)−0.0035 (14)0.0025 (15)0.0001 (17)
C90.0286 (18)0.038 (2)0.069 (3)−0.0006 (15)−0.0030 (17)−0.0078 (18)
C100.0320 (18)0.0347 (17)0.053 (2)−0.0024 (14)0.0014 (15)0.0011 (16)
C110.0298 (17)0.0367 (18)0.050 (2)−0.0007 (14)0.0031 (14)0.0028 (15)
C120.0287 (16)0.0349 (17)0.048 (2)0.0004 (14)−0.0018 (14)−0.0023 (15)
C130.043 (2)0.047 (2)0.047 (2)−0.0009 (17)−0.0013 (16)−0.0033 (17)
C140.050 (2)0.057 (2)0.051 (2)−0.0101 (19)0.0047 (18)0.0104 (19)
C150.049 (2)0.0386 (19)0.065 (3)−0.0122 (17)−0.0025 (18)0.0105 (18)
C160.0316 (18)0.0357 (18)0.049 (2)−0.0005 (14)−0.0046 (15)−0.0023 (16)
C170.062 (3)0.062 (3)0.061 (3)0.009 (2)0.009 (2)0.006 (2)
C180.281 (11)0.150 (7)0.117 (6)0.123 (7)0.099 (6)0.046 (5)
C190.105 (5)0.165 (6)0.128 (5)0.084 (5)0.029 (4)0.041 (5)
C200.051 (3)0.071 (3)0.073 (3)−0.015 (2)0.001 (2)−0.007 (2)
C210.084 (5)0.256 (10)0.159 (7)−0.058 (6)−0.004 (4)−0.110 (7)
C220.049 (3)0.177 (7)0.146 (6)−0.008 (4)0.026 (3)−0.008 (5)
C230.054 (2)0.054 (2)0.043 (2)0.0032 (19)0.0003 (17)0.0010 (18)
C240.136 (5)0.072 (3)0.085 (4)0.001 (3)−0.055 (3)−0.002 (3)
C250.076 (3)0.059 (3)0.057 (3)0.015 (2)−0.005 (2)0.009 (2)
C260.238 (9)0.122 (6)0.169 (7)−0.015 (6)0.044 (7)−0.062 (6)
C270.241 (10)0.278 (10)0.282 (10)−0.034 (8)0.011 (8)−0.061 (8)
C280.197 (8)0.158 (6)0.171 (7)0.023 (6)−0.014 (6)−0.016 (6)
Co1—O12.001 (2)C2—C31.388 (4)
Co1—O3i2.247 (2)C3—C41.387 (4)
Co1—O4i2.058 (2)C3—H30.9300
Co1—O72.383 (3)C4—C51.369 (5)
Co1—C8i2.465 (3)C4—C81.504 (4)
Co1—O82.082 (3)C5—C61.383 (5)
Co1—O10ii2.008 (2)C5—H50.9300
Co2—O22.042 (2)C6—C71.382 (4)
Co2—O72.091 (2)C7—H70.9300
Co2—O9ii2.082 (2)C8—Co1iii2.465 (3)
Co2—O132.139 (3)C9—C101.493 (5)
Co2—O142.100 (2)C10—C151.371 (5)
Co2—O152.063 (2)C10—C111.396 (4)
O1—C11.253 (4)C11—C121.383 (5)
O2—C11.238 (4)C11—H110.9300
O3—C81.244 (4)C12—C131.381 (5)
O3—Co1iii2.247 (2)C12—C161.503 (4)
O4—C81.260 (4)C13—C141.379 (5)
O4—Co1iii2.058 (2)C13—H130.9300
O5—N11.216 (4)C14—C151.379 (5)
O6—N11.215 (4)C15—H150.9300
O7—C91.259 (4)C17—H170.9300
O8—C91.240 (4)C18—H18A0.9600
O9—C161.243 (4)C18—H18B0.9600
O9—Co2iv2.082 (2)C18—H18C0.9600
O10—C161.251 (4)C19—H19A0.9600
O10—Co1iv2.008 (2)C19—H19B0.9600
O11—N21.196 (5)C19—H19C0.9600
O12—N21.206 (5)C20—H200.9300
O13—C171.214 (4)C21—H21A0.9600
O14—C201.229 (4)C21—H21B0.9600
O15—C231.237 (4)C21—H21C0.9600
O16—C261.359 (8)C22—H22A0.9600
N1—C61.460 (5)C22—H22B0.9600
N2—C141.473 (5)C22—H22C0.9600
N3—C171.305 (5)C23—H230.9300
N3—C181.426 (6)C24—H24A0.9600
N3—C191.450 (5)C24—H24B0.9600
N4—C201.326 (5)C24—H24C0.9600
N4—C211.421 (6)C25—H25A0.9600
N4—C221.439 (5)C25—H25B0.9600
N5—C231.318 (4)C25—H25C0.9600
N5—C251.449 (4)C26—H260.9300
N5—C241.463 (5)C27—H27A0.9600
N6—C261.322 (8)C27—H27B0.9600
N6—C271.411 (8)C27—H27C0.9600
N6—C281.444 (7)C28—H28A0.9600
C1—C21.509 (4)C28—H28B0.9600
C2—C71.378 (5)C28—H28C0.9600
O1—Co1—O10ii96.82 (11)O3—C8—C4120.1 (3)
O1—Co1—O4i97.00 (10)O4—C8—C4118.2 (3)
O10ii—Co1—O4i100.24 (10)O3—C8—Co1iii65.20 (18)
O1—Co1—O8101.20 (11)O4—C8—Co1iii56.52 (16)
O10ii—Co1—O8148.98 (12)C4—C8—Co1iii174.2 (3)
O4i—Co1—O8102.36 (11)O8—C9—O7119.8 (4)
O1—Co1—O3i157.87 (10)O8—C9—C10119.8 (3)
O10ii—Co1—O3i87.29 (11)O7—C9—C10120.4 (4)
O4i—Co1—O3i60.88 (9)C15—C10—C11119.5 (3)
O8—Co1—O3i85.42 (12)C15—C10—C9122.2 (3)
O1—Co1—O7104.29 (10)C11—C10—C9118.4 (3)
O10ii—Co1—O793.78 (9)C12—C11—C10121.5 (3)
O4i—Co1—O7152.88 (9)C12—C11—H11119.3
O8—Co1—O757.43 (10)C10—C11—H11119.3
O3i—Co1—O797.09 (9)C13—C12—C11119.0 (3)
O1—Co1—C8i127.71 (11)C13—C12—C16120.9 (3)
O10ii—Co1—C8i94.08 (11)C11—C12—C16120.1 (3)
O4i—Co1—C8i30.72 (10)C14—C13—C12118.6 (3)
O8—Co1—C8i94.58 (11)C14—C13—H13120.7
O3i—Co1—C8i30.16 (10)C12—C13—H13120.7
O7—Co1—C8i125.81 (10)C13—C14—C15123.0 (3)
O2—Co2—O15173.94 (11)C13—C14—N2118.3 (4)
O2—Co2—O9ii97.87 (10)C15—C14—N2118.7 (4)
O15—Co2—O9ii88.15 (10)C10—C15—C14118.3 (3)
O2—Co2—O791.26 (11)C10—C15—H15120.8
O15—Co2—O789.54 (11)C14—C15—H15120.8
O9ii—Co2—O789.27 (10)O9—C16—O10127.3 (3)
O2—Co2—O1486.77 (11)O9—C16—C12117.3 (3)
O15—Co2—O1492.79 (11)O10—C16—C12115.4 (3)
O9ii—Co2—O1487.47 (10)O13—C17—N3126.3 (4)
O7—Co2—O14175.92 (11)O13—C17—H17116.9
O2—Co2—O1387.22 (11)N3—C17—H17116.9
O15—Co2—O1386.74 (10)N3—C18—H18A109.5
O9ii—Co2—O13174.03 (10)N3—C18—H18B109.5
O7—Co2—O1393.76 (11)H18A—C18—H18B109.5
O14—Co2—O1389.71 (11)N3—C18—H18C109.5
C1—O1—Co1122.2 (2)H18A—C18—H18C109.5
C1—O2—Co2149.4 (2)H18B—C18—H18C109.5
C8—O3—Co1iii84.64 (19)N3—C19—H19A109.5
C8—O4—Co1iii92.8 (2)N3—C19—H19B109.5
C9—O7—Co2141.6 (2)H19A—C19—H19B109.5
C9—O7—Co184.1 (2)N3—C19—H19C109.5
Co2—O7—Co1104.97 (11)H19A—C19—H19C109.5
C9—O8—Co198.6 (2)H19B—C19—H19C109.5
C16—O9—Co2iv136.0 (2)O14—C20—N4126.0 (4)
C16—O10—Co1iv132.0 (2)O14—C20—H20117.0
C17—O13—Co2128.5 (3)N4—C20—H20117.0
C20—O14—Co2126.0 (3)N4—C21—H21A109.5
C23—O15—Co2123.1 (2)N4—C21—H21B109.5
O6—N1—O5123.1 (4)H21A—C21—H21B109.5
O6—N1—C6118.2 (3)N4—C21—H21C109.5
O5—N1—C6118.7 (3)H21A—C21—H21C109.5
O11—N2—O12122.3 (4)H21B—C21—H21C109.5
O11—N2—C14119.6 (4)N4—C22—H22A109.5
O12—N2—C14118.1 (4)N4—C22—H22B109.5
C17—N3—C18119.7 (4)H22A—C22—H22B109.5
C17—N3—C19123.1 (4)N4—C22—H22C109.5
C18—N3—C19117.2 (4)H22A—C22—H22C109.5
C20—N4—C21119.5 (4)H22B—C22—H22C109.5
C20—N4—C22123.7 (4)O15—C23—N5124.7 (4)
C21—N4—C22116.8 (5)O15—C23—H23117.6
C23—N5—C25121.9 (3)N5—C23—H23117.6
C23—N5—C24120.6 (3)N5—C24—H24A109.5
C25—N5—C24117.5 (3)N5—C24—H24B109.5
C26—N6—C27120.0 (9)H24A—C24—H24B109.5
C26—N6—C28128.5 (9)N5—C24—H24C109.5
C27—N6—C28111.6 (9)H24A—C24—H24C109.5
O2—C1—O1126.9 (3)H24B—C24—H24C109.5
O2—C1—C2116.1 (3)N5—C25—H25A109.5
O1—C1—C2116.9 (3)N5—C25—H25B109.5
C7—C2—C3119.8 (3)H25A—C25—H25B109.5
C7—C2—C1121.0 (3)N5—C25—H25C109.5
C3—C2—C1119.2 (3)H25A—C25—H25C109.5
C4—C3—C2120.5 (3)H25B—C25—H25C109.5
C4—C3—H3119.7N6—C26—O16105.3 (9)
C2—C3—H3119.7N6—C26—H26127.4
C5—C4—C3120.2 (3)O16—C26—H26127.4
C5—C4—C8121.5 (3)N6—C27—H27A109.5
C3—C4—C8118.3 (3)N6—C27—H27B109.5
C4—C5—C6118.5 (3)H27A—C27—H27B109.5
C4—C5—H5120.7N6—C27—H27C109.5
C6—C5—H5120.7H27A—C27—H27C109.5
C7—C6—C5122.4 (3)H27B—C27—H27C109.5
C7—C6—N1118.3 (3)N6—C28—H28A109.5
C5—C6—N1119.3 (3)N6—C28—H28B109.5
C2—C7—C6118.5 (3)H28A—C28—H28B109.5
C2—C7—H7120.7N6—C28—H28C109.5
C6—C7—H7120.7H28A—C28—H28C109.5
O3—C8—O4121.7 (3)H28B—C28—H28C109.5
O10ii—Co1—O1—C1−72.3 (3)C4—C5—C6—C72.9 (5)
O4i—Co1—O1—C1−173.5 (3)C4—C5—C6—N1−177.5 (3)
O8—Co1—O1—C182.4 (3)O6—N1—C6—C7−4.0 (5)
O3i—Co1—O1—C1−171.9 (3)O5—N1—C6—C7175.0 (4)
O7—Co1—O1—C123.4 (3)O6—N1—C6—C5176.3 (4)
C8i—Co1—O1—C1−172.8 (2)O5—N1—C6—C5−4.7 (5)
O9ii—Co2—O2—C153.7 (5)C3—C2—C7—C60.7 (5)
O7—Co2—O2—C1−35.7 (5)C1—C2—C7—C6−179.5 (3)
O14—Co2—O2—C1140.7 (5)C5—C6—C7—C2−2.8 (5)
O13—Co2—O2—C1−129.4 (5)N1—C6—C7—C2177.5 (3)
O2—Co2—O7—C9−59.1 (5)Co1iii—O3—C8—O4−0.7 (3)
O15—Co2—O7—C9114.8 (5)Co1iii—O3—C8—C4177.4 (3)
O9ii—Co2—O7—C9−157.0 (5)Co1iii—O4—C8—O30.7 (4)
O13—Co2—O7—C928.1 (5)Co1iii—O4—C8—C4−177.4 (3)
O2—Co2—O7—Co140.41 (11)C5—C4—C8—O3−176.8 (3)
O15—Co2—O7—Co1−145.60 (11)C3—C4—C8—O32.4 (5)
O9ii—Co2—O7—Co1−57.44 (10)C5—C4—C8—O41.4 (5)
O13—Co2—O7—Co1127.70 (10)C3—C4—C8—O4−179.5 (3)
O1—Co1—O7—C996.0 (2)Co1—O8—C9—O73.2 (4)
O10ii—Co1—O7—C9−166.0 (2)Co1—O8—C9—C10−174.3 (3)
O4i—Co1—O7—C9−44.6 (3)Co2—O7—C9—O8103.9 (5)
O8—Co1—O7—C91.7 (2)Co1—O7—C9—O8−2.8 (3)
O3i—Co1—O7—C9−78.2 (2)Co2—O7—C9—C10−78.5 (5)
C8i—Co1—O7—C9−68.2 (2)Co1—O7—C9—C10174.8 (3)
O1—Co1—O7—Co2−46.01 (12)O8—C9—C10—C15−171.4 (3)
O10ii—Co1—O7—Co252.01 (12)O7—C9—C10—C1511.1 (5)
O4i—Co1—O7—Co2173.32 (15)O8—C9—C10—C118.6 (5)
O8—Co1—O7—Co2−140.32 (15)O7—C9—C10—C11−168.9 (3)
O3i—Co1—O7—Co2139.75 (11)C15—C10—C11—C121.5 (5)
C8i—Co1—O7—Co2149.80 (11)C9—C10—C11—C12−178.5 (3)
O1—Co1—O8—C9−101.7 (2)C10—C11—C12—C130.3 (5)
O10ii—Co1—O8—C922.7 (4)C10—C11—C12—C16177.3 (3)
O4i—Co1—O8—C9158.5 (2)C11—C12—C13—C14−1.5 (5)
O3i—Co1—O8—C999.7 (2)C16—C12—C13—C14−178.5 (3)
O7—Co1—O8—C9−1.7 (2)C12—C13—C14—C150.9 (6)
C8i—Co1—O8—C9128.4 (2)C12—C13—C14—N2179.7 (3)
O2—Co2—O13—C17−7.4 (3)O11—N2—C14—C133.7 (7)
O15—Co2—O13—C17172.2 (3)O12—N2—C14—C13−179.4 (5)
O7—Co2—O13—C17−98.5 (3)O11—N2—C14—C15−177.5 (4)
O14—Co2—O13—C1779.4 (3)O12—N2—C14—C15−0.6 (7)
O2—Co2—O14—C2095.1 (3)C11—C10—C15—C14−2.0 (5)
O15—Co2—O14—C20−78.8 (3)C9—C10—C15—C14178.0 (3)
O9ii—Co2—O14—C20−166.9 (3)C13—C14—C15—C100.8 (6)
O13—Co2—O14—C207.9 (3)N2—C14—C15—C10−177.9 (4)
O9ii—Co2—O15—C2338.7 (2)Co2iv—O9—C16—O102.3 (6)
O7—Co2—O15—C23128.0 (2)Co2iv—O9—C16—C12−177.6 (2)
O14—Co2—O15—C23−48.7 (2)C13—C12—C16—O9−160.5 (3)
O13—Co2—O15—C23−138.2 (2)C11—C12—C16—O922.5 (5)
Co2—O2—C1—O18.8 (8)C13—C12—C16—O1019.6 (5)
Co2—O2—C1—C2−171.4 (4)C11—C12—C16—O10−157.4 (3)
Co1—O1—C1—O2−1.7 (5)Co2—O13—C17—N3−153.3 (3)
Co1—O1—C1—C2178.5 (2)C18—N3—C17—O130.2 (4)
O2—C1—C2—C7171.4 (3)C19—N3—C17—O13178.7 (3)
O1—C1—C2—C7−8.7 (5)Co2—O14—C20—N4−149.3 (3)
O2—C1—C2—C3−8.8 (5)C21—N4—C20—O140.2 (3)
O1—C1—C2—C3171.1 (3)C22—N4—C20—O14179.4 (3)
C7—C2—C3—C41.3 (5)Co2—O15—C23—N5−161.2 (2)
C1—C2—C3—C4−178.5 (3)C25—N5—C23—O15179.4 (3)
C2—C3—C4—C5−1.3 (5)C24—N5—C23—O150.2 (3)
C2—C3—C4—C8179.6 (3)C27—N6—C26—O16−0.3 (3)
C3—C4—C5—C6−0.7 (5)C28—N6—C26—O16179.0 (3)
C8—C4—C5—C6178.4 (3)
Table 1

Selected bond lengths (Å)

Co1—O12.001 (2)
Co1—O3i2.247 (2)
Co1—O4i2.058 (2)
Co1—O72.383 (3)
Co1—O82.082 (3)
Co1—O10ii2.008 (2)
Co2—O22.042 (2)
Co2—O72.091 (2)
Co2—O9ii2.082 (2)
Co2—O132.139 (3)
Co2—O142.100 (2)
Co2—O152.063 (2)

Symmetry codes: (i) ; (ii) .

  4 in total

1.  A novel bilayer cobalt(II)-organic framework with nanoscale channels accommodating large organic molecules.

Authors:  Junhua Luo; Maochun Hong; Ruihu Wang; Rong Cao; Lei Han; Daqiang Yuan; Zhenzhong Lin; Youfu Zhou
Journal:  Inorg Chem       Date:  2003-07-28       Impact factor: 5.165

2.  A short history of SHELX.

Authors:  George M Sheldrick
Journal:  Acta Crystallogr A       Date:  2007-12-21       Impact factor: 2.290

3.  catena-Poly[[aqua-(2,2'-bipyridyl)cobalt(II)]-μ-5-nitro-isophthalato].

Authors:  Ying Liu; Qingpeng He; Xianxi Zhang; Zechun Xue; Chunyan Lv
Journal:  Acta Crystallogr Sect E Struct Rep Online       Date:  2008-11-22

4.  Poly[di-μ(2)-acetato-diaquabis(2,2'-bi-pyridine)bis(μ(3)-5-nitroisophthalato)tricobalt(II)].

Authors:  Hai-Dong Wang; Min-Min Li; Hong-Yin He
Journal:  Acta Crystallogr Sect E Struct Rep Online       Date:  2009-04-10
  4 in total

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