Home Crystal structure of catena-poly[di(μ2-cyanido-κ2C:N)-dicyanido-tetrakis(dimethyl sulfoxide-κO)-manganese(II)-platinum(II)], C12H24MnN4O4PtS4
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Crystal structure of catena-poly[di(μ2-cyanido-κ2C:N)-dicyanido-tetrakis(dimethyl sulfoxide-κO)-manganese(II)-platinum(II)], C12H24MnN4O4PtS4

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Published/Copyright: February 25, 2021

Abstract

C12H24MnN4O4PtS4, triclinic, P1 (no. 2), a = 7.5234(2) Å, b = 9.2143(2) Å, c = 9.4188(2) Å, α = 68.9266(7)°, β = 76.5614(8)°, γ = 85.8639(8)°, V = 592.54(2) Å3, Z = 1, Rgt(F) = 0.0175, wRref(F2) = 0.0409, T = 223 K.

CCDC no.: 2061739

A part of the polymeric title crystal structure is shown in Figure. Table 1 contains crystallographic data and Table 2 contains the list of the atoms including atomic coordinates and displacement parameters.

Table 1:

Data collection and handling.

Crystal:Colorless block
Size:0.27 × 0.22 × 0.10 mm
Wavelength:Mo Kα radiation (0.71073 Å)
μ:6.80 mm−1
Diffractometer, scan mode:PHOTON 100 CMOS, φ and ω
θmax, completeness:28.3°, 94%
N(hkl)measured, N(hkl)unique, Rint:16,474, 2794, 0.064
Criterion for Iobs, N(hkl)gt:Iobs > 2σ(Iobs), 2793
N(param)refined:125
Programs:BRUKER [1], SHELX [2], ORTEP-3 [3], PLATON [4]
Table 2:

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Å2).

AtomxyzUiso*/Ueq
Pt10.50000.00000.50000.01992 (5)
Mn10.50000.50000.00000.01939 (9)
S10.16671 (7)0.24650 (6)0.08218 (7)0.02969 (11)
S20.40896 (8)0.63399 (8)0.28672 (7)0.03753 (13)
O10.2583 (2)0.4018 (2)−0.02187 (19)0.0332 (3)
O20.3319 (2)0.5695 (2)0.1872 (2)0.0338 (3)
N10.1455 (4)0.1482 (3)0.6396 (3)0.0547 (6)
N20.5449 (3)0.2803 (2)0.1848 (2)0.0327 (4)
C10.2745 (3)0.0953 (3)0.5877 (3)0.0325 (5)
C20.5301 (3)0.1783 (2)0.2991 (2)0.0256 (4)
C3−0.0059 (4)0.2262 (4)−0.0098 (3)0.0425 (6)
H3A0.05020.2072−0.10510.064*
H3B−0.07640.3208−0.03450.064*
H3C−0.08590.13940.05990.064*
C40.0243 (4)0.2815 (4)0.2456 (3)0.0469 (7)
H4A−0.05200.37060.20950.070*
H4B0.09960.30220.30700.070*
H4C−0.05250.19070.30930.070*
C50.2392 (5)0.5929 (6)0.4631 (4)0.0677 (10)
H5A0.12540.64110.43990.102*
H5B0.27890.63390.53230.102*
H5C0.22090.48130.51310.102*
C60.3754 (8)0.8379 (4)0.2065 (6)0.0814 (13)
H6A0.41310.88840.26920.122*
H6B0.24720.85790.20600.122*
H6C0.44770.87860.10050.122*

Source of material

The suspension of [MnCl2(terpy)] (terpy = 2,2′:6′,2′′-terpyridine; 0.3582 g; 1.001 mmol) and K2Pt(CN)4 (0.3744 g, 1.000 mmol) in H2O (50 mL) was refluxed for 3 h. After cooling, the formed precipitate was separated by filtration, washed with H2O and acetone, and dried at 50 °C, to give an ivory colored powder (0.5614 g). Crystals suitable for X-ray diffraction analysis were obtained by slow evaporation from a dimethyl sulfoxide (DMSO) solution at 90 °C.

Experimental details

Hydrogen atoms were positioned geometrically and allowed to ride on their parent atoms with d(C—H) = 0.97 Å and Uiso(H) = 1.5Ueq(C) with the help of the SHELXL program (AFIX 137 options) [2].

Comment

The crystal structures of the related heterometallic cyanido-bridged Mn–Pt-complexes [{Mn(salen)}2Pt(CN)4]n (salen = N,N′-bis(salicylidene)ethylenediiminato) [5], [, 6], [Mn(L)Pt(CN)4]n (L = 2,13-dimethyl-3,12-diaza-6,9-dioxa-1(2,6)-pyridinacyclotridecaphane-2,12-diene) [7] and [Mn(phen)Pt(CN)4]n (phen = 1,10-phenanthroline) [8] have been determined previously.

The title complex exhibits one-dimensional cyanido-bridged chain structure along the [011] direction [4], in which two trans-cyanido ligands of the unit [Pt(CN)4]2− are connected to two Mn(II) units [Mn(DMSO)4]2+ (DMSO = dimethyl sulfoxide). In the complex, the Pt(II) ion is four-coordinated in a slightly distorted square-planar environment by four C atoms of four CN ligands, whereas the Mn(II) ion is six-coordinated in a slightly distorted octahedral environment by two N atoms from two bridging [Pt(CN)4]2− units and four O atoms from the four DMSO solvent molecules, and the two metal ions are located on an inversion center, respectively; the asymmetric unit of the polymer contains one half of the repeat unit [Mn(DMSO)4Pt(CN)4]. The Pt–C and C≡N bond lengths are almost equal with d(Pt–C) = 1.987(2) and 1.997(2) Å and d(C≡N) = 1.140(4) and 1.135(3) Å, respectively. The Mn–O bonds [Mn1–O1/O2 = 2.1713(15) and 2.1862(16) Å] are slightly shorter than the Mn–N bonds [Mn1–N2 = 2.2097(19) Å]. In the crystal structure, the complexes display very weak intermolecular C–H⋯N and C–H⋯O hydrogen bonds with distances of 3.5432(1) and 3.3658(1) Å between the donor and acceptor atoms, respectively, to stabilize the three-dimensional packing [4].


Corresponding author: Kwang Ha, Research Institute of Catalysis, School of Chemical Engineering, Chonnam National University, Gwangju61186, Republic of Korea, E-mail:

Funding source: Ministry of Education

Award Identifier / Grant number: 2018R1D1A1B07050550

Acknowledgments

The author thanks the KBSI, Seoul Center, for the X-ray data collection.

  1. Author contributions: All the authors have accepted responsibility for the entire content of this submitted manuscript and approved submission.

  2. Research funding: This research was supported by Basic Science Research Program through the National Research Foundation of Korea (NRF) funded by the Ministry of Education (grant number: 2018R1D1A1B07050550).

  3. Conflict of interest statement: The authors declare no conflicts of interest regarding this article.

References

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Received: 2021-01-17
Accepted: 2021-02-08
Published Online: 2021-02-25
Published in Print: 2021-05-26

© 2021 Kwang Ha, published by De Gruyter, Berlin/Boston

This work is licensed under the Creative Commons Attribution 4.0 International License.

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