Literature DB >> 21588853

catena-Poly[bis(μ(3)-3-aminobenzoato-κN:O:O,O')bis(μ(2)-3-aminobenzoato-κO,O':O)dilead(II)].

Fwu Ming Shen, Shie Fu Lush.   

Abstract

The Pb(II )atom in the title compound, {[Pb(2)(C(7)H(6)NO(2))(4)]}(n), is chelated by two 3-aminobenzoato ligands in a distorted pentagonal-bipyramidal coordination geometry with five oxygen donors in the equatorial positions, one nitro-gen donor and one oxygen donor in the axial positions. Two mol-ecules are linked through a centre of inversion, forming a dinuclear entity. These entities are linked in a μ(3)-bridging mode through the amino N atom and two carboxyl-ate O atoms into a chain along the b axis. Classical inter-molecular N-H⋯O hydrogen bonding is observed in the structure. The supra-molecular structure is consolidated by π-π stacking inter-actions with centroid-centroid distances between benzene rings of 3.837 (8) Å.

Entities:  

Year:  2010        PMID： 21588853      PMCID： PMC3009093          DOI： 10.1107/S1600536810041322

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


Related literature

For related structures, see: Tan et al. (2006 ▶); Wang et al. (2004 ▶, 2006 ▶); Wei et al. (2006 ▶).

Experimental

Crystal data

[Pb2(C7H6NO2)4] M = 958.92 Triclinic, a = 6.8610 (3) Å b = 7.8943 (3) Å c = 13.9022 (8) Å α = 76.030 (2)° β = 88.103 (2)° γ = 70.154 (2)° V = 686.33 (6) Å3 Z = 1 Mo Kα radiation μ = 12.31 mm−1 T = 295 K 0.18 × 0.16 × 0.02 mm

Data collection

Nonius KappaCCD diffractometer Absorption correction: multi-scan (SCALEPACK; Otwinowski & Minor, 1997 ▶) T min = 0.215, T max = 0.791 5451 measured reflections 2470 independent reflections 2218 reflections with I > 2σ(I) R int = 0.103

Refinement

R[F 2 > 2σ(F 2)] = 0.065 wR(F 2) = 0.169 S = 1.05 2470 reflections 190 parameters 12 restraints H-atom parameters constrained Δρmax = 3.23 e Å−3 Δρmin = −5.12 e Å−3 Data collection: COLLECT (Nonius, 2000 ▶); cell refinement: SCALEPACK (Otwinowski & Minor, 1997 ▶); data reduction: DENZO (Otwinowski & Minor, 1997 ▶) and SCALEPACK; program(s) used to solve structure: SHELXS97 (Sheldrick, 2008 ▶); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008 ▶); molecular graphics: PLATON (Spek, 2009 ▶); software used to prepare material for publication: PLATON. Crystal structure: contains datablocks global, I. DOI: 10.1107/S1600536810041322/rk2229sup1.cif Structure factors: contains datablocks I. DOI: 10.1107/S1600536810041322/rk2229Isup2.hkl Additional supplementary materials: crystallographic information; 3D view; checkCIF report
[Pb2(C7H6NO2)4]Z = 1
Mr = 958.92F(000) = 448
Triclinic, P1Dx = 2.320 Mg m−3
Hall symbol: -P 1Mo Kα radiation, λ = 0.71073 Å
a = 6.8610 (3) ÅCell parameters from 12232 reflections
b = 7.8943 (3) Åθ = 2.0–25.4°
c = 13.9022 (8) ŵ = 12.31 mm−1
α = 76.030 (2)°T = 295 K
β = 88.103 (2)°Prism, pink
γ = 70.154 (2)°0.18 × 0.16 × 0.02 mm
V = 686.33 (6) Å3
Nonius KappaCCD diffractometer2470 independent reflections
Radiation source: fine–focus sealed tube2218 reflections with I > 2σ(I)
graphiteRint = 0.103
Detector resolution: 9 pixels mm-1θmax = 25.3°, θmin = 2.8°
CCD rotation images, thick slices scansh = −7→8
Absorption correction: multi-scan (SCALEPACK; Otwinowski & Minor, 1997)k = −7→9
Tmin = 0.215, Tmax = 0.791l = −16→16
5451 measured reflections
Refinement on F2Primary atom site location: structure-invariant direct methods
Least-squares matrix: fullSecondary atom site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.065Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.169H-atom parameters constrained
S = 1.05w = 1/[σ2(Fo2) + (0.1239P)2 + 1.1995P] where P = (Fo2 + 2Fc2)/3
2470 reflections(Δ/σ)max = 0.001
190 parametersΔρmax = 3.23 e Å−3
12 restraintsΔρmin = −5.12 e Å−3
Geometry. All s.u.'s (except the s.u. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell s.u.'s are taken into account individually in the estimation of s.u.'s in distances, angles and torsion angles; correlations between s.u.'s in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell s.u.'s is used for estimating s.u.'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. The residual peaks show two relatively high peaks of 3.19 eÅ-3 at 0.405, 0.645, 0.123 and 3.13 eÅ-3 at 0.566, 0.080, 0.038, and the distances to the nearest Pb atoms are 1.26Å and 1.50Å, respectively.
xyzUiso*/Ueq
Pb10.57722 (5)0.23064 (4)−0.04961 (3)0.0375 (1)
O10.7342 (13)0.0825 (10)0.1159 (6)0.051 (3)
O20.6749 (13)0.3823 (11)0.0817 (6)0.051 (3)
O30.6695 (17)0.0912 (11)−0.2133 (6)0.058 (3)
O40.7229 (12)−0.0859 (9)−0.0620 (5)0.040 (2)
N10.655 (3)0.555 (2)0.4054 (11)0.092 (6)
N20.9270 (14)−0.7459 (12)−0.0976 (7)0.038 (3)
C10.7141 (15)0.2286 (15)0.1435 (8)0.037 (3)
C20.7253 (16)0.2209 (16)0.2521 (9)0.043 (3)
C30.6951 (19)0.3817 (19)0.2811 (9)0.054 (4)
C40.696 (2)0.383 (2)0.3805 (10)0.065 (4)
C50.733 (2)0.212 (3)0.4500 (10)0.076 (5)
C60.768 (3)0.050 (3)0.4203 (11)0.079 (5)
C70.766 (2)0.056 (2)0.3199 (10)0.057 (4)
C80.7220 (17)−0.0662 (14)−0.1556 (8)0.039 (3)
C90.7796 (14)−0.2349 (13)−0.1927 (8)0.035 (3)
C100.8350 (14)−0.4092 (14)−0.1314 (8)0.035 (3)
C110.8749 (15)−0.5654 (13)−0.1674 (7)0.029 (3)
C120.8668 (17)−0.5505 (15)−0.2690 (8)0.037 (3)
C130.8113 (19)−0.3757 (16)−0.3344 (8)0.043 (3)
C140.7646 (16)−0.2166 (14)−0.2971 (8)0.040 (3)
H1A0.631100.654900.359200.1100*
H1B0.655000.558600.466600.1100*
H2A0.93270−0.75440−0.034900.0460*
H2B0.95220−0.84430−0.119100.0460*
H30.673700.492000.233100.0660*
H50.732700.208600.517400.0920*
H60.79390−0.062000.467300.0940*
H70.79250−0.053000.299100.0690*
H100.84610−0.42310−0.063200.0420*
H120.89830−0.65640−0.293100.0450*
H130.80500−0.36400−0.402500.0510*
H140.72400−0.09940−0.340500.0480*
U11U22U33U12U13U23
Pb10.0414 (2)0.0231 (2)0.0487 (3)−0.0120 (2)0.0023 (2)−0.0088 (2)
O10.056 (5)0.034 (4)0.065 (5)−0.015 (4)0.007 (4)−0.019 (4)
O20.061 (5)0.035 (4)0.059 (5)−0.020 (4)−0.004 (4)−0.010 (4)
O30.094 (6)0.034 (4)0.051 (5)−0.028 (4)0.010 (4)−0.013 (4)
O40.058 (5)0.023 (3)0.043 (4)−0.013 (3)0.007 (3)−0.015 (3)
N10.113 (11)0.118 (11)0.067 (7)−0.049 (10)0.027 (7)−0.054 (8)
N20.046 (5)0.026 (4)0.048 (5)−0.016 (4)0.005 (4)−0.014 (4)
C10.027 (4)0.038 (5)0.046 (5)−0.009 (4)0.010 (4)−0.014 (4)
C20.029 (5)0.046 (6)0.051 (6)−0.009 (4)0.004 (4)−0.015 (4)
C30.050 (6)0.063 (7)0.055 (6)−0.022 (6)−0.003 (5)−0.019 (6)
C40.044 (7)0.091 (8)0.066 (7)−0.015 (7)0.012 (6)−0.041 (6)
C50.065 (8)0.123 (11)0.044 (6)−0.032 (9)0.013 (6)−0.027 (6)
C60.081 (10)0.080 (9)0.053 (7)−0.010 (9)0.003 (7)−0.001 (7)
C70.048 (7)0.053 (7)0.059 (7)−0.008 (6)0.008 (6)−0.006 (6)
C80.046 (5)0.023 (5)0.053 (6)−0.018 (4)0.006 (5)−0.012 (4)
C90.025 (4)0.022 (4)0.056 (6)−0.011 (4)0.007 (4)0.000 (4)
C100.021 (4)0.030 (5)0.049 (5)0.003 (4)−0.002 (4)−0.018 (4)
C110.027 (4)0.024 (4)0.042 (5)−0.013 (4)0.007 (4)−0.013 (4)
C120.048 (6)0.036 (5)0.041 (5)−0.024 (4)0.012 (4)−0.021 (4)
C130.058 (6)0.040 (6)0.038 (5)−0.024 (5)0.005 (5)−0.014 (4)
C140.044 (5)0.029 (5)0.050 (6)−0.016 (4)0.003 (5)−0.010 (4)
Pb1—O12.415 (8)C3—C41.385 (18)
Pb1—O22.626 (8)C4—C51.41 (2)
Pb1—O32.726 (8)C5—C61.38 (3)
Pb1—O42.403 (7)C6—C71.39 (2)
Pb1—N2i2.525 (10)C8—C91.469 (15)
Pb1—O4ii2.913 (8)C9—C101.365 (15)
Pb1—O2iii2.887 (8)C9—C141.427 (15)
O1—C11.264 (14)C10—C111.380 (15)
O2—C11.254 (14)C11—C121.390 (14)
O3—C81.246 (14)C12—C131.392 (16)
O4—C81.273 (13)C13—C141.407 (16)
N1—C41.42 (2)C3—H30.9300
N2—C111.452 (13)C5—H50.9300
N1—H1B0.8600C6—H60.9300
N1—H1A0.8600C7—H70.9300
N2—H2B0.8600C10—H100.9300
N2—H2A0.8600C12—H120.9300
C1—C21.500 (16)C13—H130.9300
C2—C71.356 (19)C14—H140.9300
C2—C31.371 (19)
Pb1···C3iii3.870 (13)C3···C13ii3.542 (19)
Pb1···C10ii3.854 (11)C3···C14vi3.482 (18)
Pb1···H3iii3.0500C4···C13vi3.40 (2)
Pb1···H10ii3.3300C4···C13ii3.58 (2)
O1···O22.193 (11)C7···C14ii3.422 (19)
O1···O43.092 (11)C8···Pb1ii3.698 (11)
O1···C22.394 (15)C9···C1ii3.419 (15)
O1···N2iv2.936 (12)C9···C1vi3.582 (15)
O1···C8ii3.200 (15)C9···C2vi3.501 (16)
O1···O4ii3.238 (13)C9···C2ii3.547 (16)
O2···N2i3.158 (13)C10···O2v3.369 (14)
O2···C22.378 (15)C10···Pb1ii3.854 (11)
O2···O12.193 (11)C10···C1ii3.540 (15)
O2···O2iii3.109 (12)C13···C3ii3.542 (19)
O2···C10i3.369 (14)C13···C3vi3.473 (19)
O3···C92.370 (13)C13···C4vi3.40 (2)
O3···O42.190 (11)C13···C4ii3.58 (2)
O3···N2i3.177 (14)C14···C3vi3.482 (18)
O4···O13.092 (11)C14···C2vi3.563 (17)
O4···C92.348 (12)C14···C2ii3.409 (17)
O4···O1ii3.238 (13)C14···C7ii3.422 (19)
O4···N2iv3.037 (12)C1···H2Ai2.8500
O4···O32.190 (11)C5···H1Bvii3.0400
O1···H72.5000C8···H2Bi2.8600
O1···H2Biv2.3200H1A···H32.3700
O1···H2Ai2.7600H1A···O3iii2.8100
O2···H10i2.7200H1B···H52.5500
O2···H2Ai2.5100H1B···H13viii2.4100
O2···H32.4600H1B···C5vii3.0400
O3···H2Bi2.6300H2A···H102.4100
O3···H1Aiii2.8100H2A···O4iv2.5200
O3···H142.5300H2B···H122.4800
O4···H102.5100H2B···O1iv2.3200
O4···H2Bi2.8200H3···O22.4600
O4···H2Aiv2.5200H3···H1A2.3700
N2···O2v3.158 (13)H3···Pb1iii3.0500
N2···O3v3.177 (14)H5···H1B2.5500
N2···O1iv2.936 (12)H7···O12.5000
N2···O4iv3.037 (12)H7···H12iv2.5600
C1···C10ii3.540 (15)H10···O2v2.7200
C1···C9ii3.419 (15)H10···O42.5100
C1···C9vi3.582 (15)H10···H2A2.4100
C2···C14vi3.563 (17)H10···Pb1ii3.3300
C2···C9ii3.547 (16)H10···H10iv2.5500
C2···C9vi3.501 (16)H12···H2B2.4800
C2···C14ii3.409 (17)H12···H7iv2.5600
C3···C13vi3.473 (19)H13···H1Bix2.4100
C3···Pb1iii3.870 (13)H14···O32.5300
O1—Pb1—O251.4 (3)H2A—N2—H2B120.00
O1—Pb1—O3126.6 (3)Pb1v—N2—H2B88.00
O1—Pb1—O479.9 (2)Pb1—C1—O156.6 (6)
O1—Pb1—C125.9 (3)O1—C1—O2121.1 (10)
O1—Pb1—C8103.8 (3)Pb1—C1—O266.2 (6)
O1—Pb1—N2i86.3 (3)Pb1—C1—C2163.1 (8)
O1—Pb1—O4ii74.2 (3)O1—C1—C2119.7 (10)
O1—Pb1—O2iii115.3 (2)O2—C1—C2119.1 (10)
O2—Pb1—O3149.9 (3)C3—C2—C7121.1 (12)
O2—Pb1—O4128.1 (3)C1—C2—C3119.1 (11)
O2—Pb1—C125.9 (3)C1—C2—C7119.8 (11)
O2—Pb1—C8145.9 (3)C2—C3—C4121.3 (13)
O2—Pb1—N2i75.6 (3)N1—C4—C5124.5 (14)
O2—Pb1—O4ii98.7 (2)C3—C4—C5117.1 (14)
O2—Pb1—O2iii68.5 (3)N1—C4—C3118.4 (13)
O3—Pb1—O450.1 (2)C4—C5—C6121.4 (13)
O3—Pb1—C1147.2 (3)C5—C6—C7119.4 (16)
O3—Pb1—C825.0 (3)C2—C7—C6119.8 (15)
O3—Pb1—N2i74.3 (3)Pb1—C8—O367.9 (6)
O3—Pb1—O4ii109.5 (3)Pb1—C8—O453.2 (5)
O2iii—Pb1—O3117.1 (2)Pb1—C8—C9169.2 (8)
O4—Pb1—C1105.3 (3)O3—C8—O4120.9 (10)
O4—Pb1—C825.1 (3)O3—C8—C9121.5 (10)
O4—Pb1—N2i85.9 (3)O4—C8—C9117.7 (9)
O4—Pb1—O4ii81.3 (2)C8—C9—C10122.9 (10)
O2iii—Pb1—O4163.4 (2)C8—C9—C14118.9 (9)
C1—Pb1—C8128.2 (3)C10—C9—C14118.1 (9)
N2i—Pb1—C183.5 (3)C9—C10—C11122.1 (10)
O4ii—Pb1—C183.0 (3)N2—C11—C12120.4 (9)
O2iii—Pb1—C190.5 (3)C10—C11—C12120.5 (10)
N2i—Pb1—C880.2 (3)N2—C11—C10119.0 (9)
O4ii—Pb1—C894.8 (3)C11—C12—C13119.4 (10)
O2iii—Pb1—C8140.9 (3)C12—C13—C14119.8 (10)
O4ii—Pb1—N2i158.2 (3)C9—C14—C13120.1 (10)
O2iii—Pb1—N2i101.2 (3)C2—C3—H3119.00
O2iii—Pb1—O4ii96.0 (2)C4—C3—H3119.00
Pb1—O1—C197.5 (7)C4—C5—H5119.00
Pb1—O2—C187.9 (7)C6—C5—H5120.00
Pb1—O2—Pb1iii111.5 (3)C5—C6—H6120.00
Pb1iii—O2—C1142.0 (7)C7—C6—H6120.00
Pb1—O3—C887.1 (6)C2—C7—H7120.00
Pb1—O4—C8101.8 (6)C6—C7—H7120.00
Pb1—O4—Pb1ii98.7 (3)C9—C10—H10119.00
Pb1ii—O4—C8118.8 (7)C11—C10—H10119.00
Pb1v—N2—C11103.4 (7)C11—C12—H12120.00
H1A—N1—H1B120.00C13—C12—H12120.00
C4—N1—H1A120.00C12—C13—H13120.00
C4—N1—H1B120.00C14—C13—H13120.00
Pb1v—N2—H2A78.00C9—C14—H14120.00
C11—N2—H2A120.00C13—C14—H14120.00
C11—N2—H2B120.00
O2—Pb1—O1—C18.3 (6)O2—Pb1—N2i—C11i−90.7 (6)
O3—Pb1—O1—C1150.1 (7)O3—Pb1—N2i—C11i88.7 (6)
O4—Pb1—O1—C1169.3 (7)O4—Pb1—N2i—C11i138.3 (6)
C8—Pb1—O1—C1161.8 (7)C1—Pb1—N2i—C11i−115.8 (6)
N2i—Pb1—O1—C182.8 (7)C8—Pb1—N2i—C11i113.6 (6)
O4ii—Pb1—O1—C1−107.0 (7)O1—Pb1—O4ii—Pb1ii−81.9 (3)
O2iii—Pb1—O1—C1−17.8 (8)O1—Pb1—O4ii—C8ii26.8 (7)
O1—Pb1—O2—C1−8.3 (6)O2—Pb1—O4ii—Pb1ii−127.4 (3)
O1—Pb1—O2—Pb1iii−154.7 (5)O2—Pb1—O4ii—C8ii−18.8 (8)
O3—Pb1—O2—C1−106.4 (8)O3—Pb1—O4ii—Pb1ii42.0 (3)
O3—Pb1—O2—Pb1iii107.2 (5)O3—Pb1—O4ii—C8ii150.6 (7)
O4—Pb1—O2—C1−32.3 (8)O4—Pb1—O4ii—Pb1ii0.0 (2)
O4—Pb1—O2—Pb1iii−178.7 (3)O4—Pb1—O4ii—C8ii108.6 (7)
C1—Pb1—O2—Pb1iii−146.4 (8)C1—Pb1—O4ii—Pb1ii−106.8 (3)
C8—Pb1—O2—C1−58.8 (9)C1—Pb1—O4ii—C8ii1.9 (7)
C8—Pb1—O2—Pb1iii154.7 (4)C8—Pb1—O4ii—Pb1ii21.2 (3)
N2i—Pb1—O2—C1−105.1 (7)C8—Pb1—O4ii—C8ii129.8 (7)
N2i—Pb1—O2—Pb1iii108.5 (4)O1—Pb1—O2iii—Pb1iii21.7 (4)
O4ii—Pb1—O2—C153.4 (7)O1—Pb1—O2iii—C1iii137.8 (12)
O4ii—Pb1—O2—Pb1iii−93.1 (3)O2—Pb1—O2iii—Pb1iii0.0 (3)
O2iii—Pb1—O2—C1146.4 (7)O2—Pb1—O2iii—C1iii116.1 (13)
O2iii—Pb1—O2—Pb1iii0.0 (3)O3—Pb1—O2iii—Pb1iii−147.5 (3)
O1—Pb1—O3—C827.6 (9)O3—Pb1—O2iii—C1iii−31.4 (13)
O2—Pb1—O3—C8101.9 (9)C1—Pb1—O2iii—Pb1iii14.0 (4)
O4—Pb1—O3—C82.7 (7)C1—Pb1—O2iii—C1iii130.1 (12)
C1—Pb1—O3—C851.3 (11)C8—Pb1—O2iii—Pb1iii−157.7 (4)
N2i—Pb1—O3—C8100.6 (8)C8—Pb1—O2iii—C1iii−41.6 (14)
O4ii—Pb1—O3—C8−56.9 (8)Pb1—O1—C1—O2−16.0 (12)
O2iii—Pb1—O3—C8−164.6 (7)Pb1—O1—C1—C2160.6 (9)
O1—Pb1—O4—C8−162.6 (8)Pb1—O2—C1—O114.5 (11)
O1—Pb1—O4—Pb1ii75.4 (3)Pb1—O2—C1—C2−162.0 (9)
O2—Pb1—O4—C8−143.8 (7)Pb1iii—O2—C1—Pb1123.3 (11)
O2—Pb1—O4—Pb1ii94.2 (3)Pb1iii—O2—C1—O1137.8 (10)
O3—Pb1—O4—C8−2.7 (7)Pb1iii—O2—C1—C2−38.8 (18)
O3—Pb1—O4—Pb1ii−124.7 (5)Pb1—O3—C8—O4−4.6 (12)
C1—Pb1—O4—C8−157.8 (7)Pb1—O3—C8—C9173.8 (11)
C1—Pb1—O4—Pb1ii80.2 (3)Pb1—O4—C8—O35.3 (14)
C8—Pb1—O4—Pb1ii−122.0 (8)Pb1—O4—C8—C9−173.1 (8)
N2i—Pb1—O4—C8−75.7 (7)Pb1ii—O4—C8—Pb1106.9 (6)
N2i—Pb1—O4—Pb1ii162.3 (3)Pb1ii—O4—C8—O3112.2 (12)
O4ii—Pb1—O4—C8122.0 (7)Pb1ii—O4—C8—C9−66.2 (12)
O4ii—Pb1—O4—Pb1ii0.0 (2)Pb1v—N2—C11—C12−96.2 (10)
O1—Pb1—C1—O2165.1 (11)Pb1v—N2—C11—C1084.2 (10)
O2—Pb1—C1—O1−165.1 (11)O1—C1—C2—C72.9 (17)
O3—Pb1—C1—O1−47.5 (10)O1—C1—C2—C3−177.5 (12)
O3—Pb1—C1—O2117.6 (7)O2—C1—C2—C7179.5 (12)
O4—Pb1—C1—O1−11.0 (7)O2—C1—C2—C3−0.9 (17)
O4—Pb1—C1—O2154.1 (6)C7—C2—C3—C4−3(2)
C8—Pb1—C1—O1−22.7 (8)C1—C2—C3—C4177.5 (12)
C8—Pb1—C1—O2142.4 (6)C1—C2—C7—C6−177.4 (15)
N2i—Pb1—C1—O1−94.8 (7)C3—C2—C7—C63(2)
N2i—Pb1—C1—O270.3 (7)C2—C3—C4—N1−177.3 (15)
O4ii—Pb1—C1—O168.0 (7)C2—C3—C4—C51(2)
O4ii—Pb1—C1—O2−126.9 (7)N1—C4—C5—C6178.7 (18)
O2iii—Pb1—C1—O1163.9 (7)C3—C4—C5—C60(2)
O2iii—Pb1—C1—O2−31.0 (7)C4—C5—C6—C70(3)
O1—Pb1—C8—O3−157.5 (8)C5—C6—C7—C2−2(3)
O1—Pb1—C8—O417.6 (8)O4—C8—C9—C10−0.6 (17)
O2—Pb1—C8—O3−119.1 (8)O3—C8—C9—C10−179.1 (12)
O2—Pb1—C8—O456.0 (10)O3—C8—C9—C14−3.2 (17)
O3—Pb1—C8—O4175.1 (13)O4—C8—C9—C14175.2 (10)
O4—Pb1—C8—O3−175.1 (13)C14—C9—C10—C11−0.4 (16)
C1—Pb1—C8—O3−147.5 (8)C8—C9—C14—C13−177.6 (11)
C1—Pb1—C8—O427.6 (9)C8—C9—C10—C11175.5 (10)
N2i—Pb1—C8—O3−73.8 (8)C10—C9—C14—C13−1.6 (16)
N2i—Pb1—C8—O4101.3 (7)C9—C10—C11—C122.3 (17)
O4ii—Pb1—C8—O3127.6 (8)C9—C10—C11—N2−178.2 (10)
O4ii—Pb1—C8—O4−57.3 (7)N2—C11—C12—C13178.4 (11)
O2iii—Pb1—C8—O322.0 (10)C10—C11—C12—C13−2.1 (18)
O2iii—Pb1—C8—O4−162.9 (6)C11—C12—C13—C140.1 (19)
O1—Pb1—N2i—C11i−141.7 (6)C12—C13—C14—C91.7 (18)
D—H···AD—HH···AD···AD—H···A
N2—H2A···O4iv0.862.523.037 (12)119
N2—H2B···O1iv0.862.322.936 (12)129
Table 1

Hydrogen-bond geometry (Å, °)

D—H⋯AD—HH⋯AD⋯AD—H⋯A
N2—H2A⋯O4i0.862.523.037 (12)119
N2—H2B⋯O1i0.862.322.936 (12)129

Symmetry code: (i) .

  2 in total

1.  A short history of SHELX.

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

2.  Structure validation in chemical crystallography.

Authors:  Anthony L Spek
Journal:  Acta Crystallogr D Biol Crystallogr       Date:  2009-01-20
  2 in total
  1 in total

1.  Crystal structure of trans-bis-(di-ethano-lamine-κ(3) O,N,O')manganese(II) bis-(3-amino-benzoate).

Authors:  Aziz B Ibragimov; Bakhtiyar S Zakirov; Jamshid M Ashurov
Journal:  Acta Crystallogr E Crystallogr Commun       Date:  2016-03-15
  1 in total

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