Literature DB >> 24860312

(2.2.2-Cryptand)potassium tetra-carbonyl-cobaltate(-I).

William W Brennessel1, John E Ellis1.   

Abstract

The title salt, [K(C18H36N2O6)][Co(CO)4], is an example of a classical carbonyl-metalate. The asymmetric unit contains one cation and one tetrahedral anion, both in general positions. Based on comparison of the four carbonyl C-O bond lengths and C-Co-C angles, the anion is unperturbed by the cation, which is normal for an alkali metal fully encased by a cryptand cage.

Entities:  

Year:  2014        PMID: 24860312      PMCID: PMC4011216          DOI: 10.1107/S1600536814006758

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


Related literature

For a survey of metal carbonyl anions, see: Ellis (2003 ▶). For the synthesis of the precursor bis­(anthracene)cobaltate, see: Brennessel et al. (2002 ▶). For an in-depth discussion of the perturbations of the title anion by cations in various solvents, as measured by IR spectroscopy, see: Edgell & Lyford (1971 ▶). For a description of the Cambridge Structural Database, see: Allen (2002 ▶).

Experimental

Crystal data

[K(C18H36N2O6)][Co(CO)4] M = 586.56 Monoclinic, a = 9.3611 (18) Å b = 12.022 (2) Å c = 25.358 (5) Å β = 91.536 (4)° V = 2852.8 (9) Å3 Z = 4 Mo Kα radiation μ = 0.80 mm−1 T = 173 K 0.30 × 0.19 × 0.14 mm

Data collection

Bruker SMART CCD platform diffractometer Absorption correction: multi-scan (SADABS; Sheldrick, 2012 ▶) T min = 0.521, T max = 0.745 14351 measured reflections 5046 independent reflections 3551 reflections with I > 2σ(I) R int = 0.058

Refinement

R[F 2 > 2σ(F 2)] = 0.040 wR(F 2) = 0.093 S = 0.92 5046 reflections 325 parameters H-atom parameters constrained Δρmax = 0.39 e Å−3 Δρmin = −0.23 e Å−3 Data collection: SMART (Bruker, 2003 ▶); cell refinement: SAINT (Bruker, 2003 ▶); data reduction: SAINT; program(s) used to solve structure: SIR97 (Altomare et al., 1999 ▶); program(s) used to refine structure: SHELXL2014 (Sheldrick, 2008 ▶); molecular graphics: SHELXTL (Sheldrick, 2008 ▶); software used to prepare material for publication: SHELXTL. Crystal structure: contains datablock(s) I, global. DOI: 10.1107/S1600536814006758/nk2222sup1.cif Structure factors: contains datablock(s) I. DOI: 10.1107/S1600536814006758/nk2222Isup2.hkl CCDC reference: 993915 Additional supporting information: crystallographic information; 3D view; checkCIF report
[K(C18H36N2O6)][Co(CO)4]F(000) = 1232
Mr = 586.56Dx = 1.366 Mg m3
Monoclinic, P21/cMo Kα radiation, λ = 0.71073 Å
a = 9.3611 (18) ÅCell parameters from 3996 reflections
b = 12.022 (2) Åθ = 2.3–24.6°
c = 25.358 (5) ŵ = 0.80 mm1
β = 91.536 (4)°T = 173 K
V = 2852.8 (9) Å3Block, colorless
Z = 40.30 × 0.19 × 0.14 mm
Bruker SMART CCD platform diffractometer3551 reflections with I > 2σ(I)
Radiation source: normal-focus sealed tubeRint = 0.058
ω scansθmax = 25.1°, θmin = 1.6°
Absorption correction: multi-scan (SADABS; Sheldrick, 2012)h = −11→11
Tmin = 0.521, Tmax = 0.745k = −11→14
14351 measured reflectionsl = −29→30
5046 independent 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)] = 0.040Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.093H-atom parameters constrained
S = 0.92w = 1/[σ2(Fo2) + (0.0428P)2] where P = (Fo2 + 2Fc2)/3
5046 reflections(Δ/σ)max < 0.001
325 parametersΔρmax = 0.39 e Å3
0 restraintsΔρmin = −0.23 e Å3
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.
xyzUiso*/Ueq
Co10.03175 (4)0.80932 (3)0.38562 (2)0.03777 (12)
C10.1014 (3)0.8470 (2)0.44858 (12)0.0452 (7)
O10.1456 (3)0.8706 (2)0.48980 (8)0.0653 (6)
C2−0.1456 (4)0.8597 (3)0.37998 (11)0.0489 (8)
O2−0.2606 (3)0.8925 (2)0.37675 (10)0.0736 (7)
C30.0336 (3)0.6631 (3)0.38061 (11)0.0462 (7)
O30.0358 (2)0.56731 (19)0.37816 (9)0.0651 (6)
C40.1381 (3)0.8663 (2)0.33608 (11)0.0436 (7)
O40.2078 (3)0.90302 (17)0.30383 (8)0.0627 (6)
K10.37979 (6)0.39030 (5)0.37685 (2)0.03466 (15)
N10.2667 (2)0.17944 (18)0.42354 (9)0.0408 (6)
C50.2462 (3)0.1981 (2)0.48042 (11)0.0488 (8)
H5A0.33990.19210.49920.059*
H5B0.18370.13870.49400.059*
C60.1812 (3)0.3093 (3)0.49271 (11)0.0520 (8)
H6A0.09280.32010.47100.062*
H6B0.15580.31200.53030.062*
O50.28056 (19)0.39546 (15)0.48182 (7)0.0399 (5)
C70.2248 (3)0.5016 (2)0.49582 (11)0.0482 (8)
H7A0.20080.50190.53360.058*
H7B0.13640.51700.47480.058*
C80.3322 (3)0.5887 (2)0.48574 (11)0.0504 (8)
H8A0.29520.66210.49650.060*
H8B0.42080.57330.50670.060*
O60.3626 (2)0.58999 (15)0.43112 (7)0.0438 (5)
C90.4473 (3)0.6823 (2)0.41678 (12)0.0512 (8)
H9A0.54690.67160.42990.061*
H9B0.40960.75110.43280.061*
C100.4439 (3)0.6927 (2)0.35785 (12)0.0535 (8)
H10A0.34370.70420.34560.064*
H10B0.49880.75970.34810.064*
C110.1280 (3)0.1528 (2)0.39757 (12)0.0481 (8)
H11A0.05320.20050.41260.058*
H11B0.10340.07450.40520.058*
C120.1278 (3)0.1691 (2)0.33879 (12)0.0492 (8)
H12A0.20910.12850.32370.059*
H12B0.03830.13920.32270.059*
O70.13939 (19)0.28435 (15)0.32733 (7)0.0396 (5)
C130.1274 (3)0.3049 (3)0.27216 (10)0.0480 (8)
H13A0.03400.27760.25820.058*
H13B0.20400.26500.25370.058*
C140.1397 (3)0.4268 (3)0.26271 (11)0.0461 (7)
H14A0.11790.44370.22510.055*
H14B0.07070.46740.28450.055*
O80.28281 (19)0.46132 (16)0.27640 (7)0.0458 (5)
C150.3056 (3)0.5738 (3)0.26203 (12)0.0610 (9)
H15A0.24310.62310.28250.073*
H15B0.28220.58430.22410.073*
C160.4602 (3)0.6026 (3)0.27332 (12)0.0619 (9)
H16A0.52120.55080.25350.074*
H16B0.47860.67870.26030.074*
C170.3671 (3)0.0864 (2)0.41663 (13)0.0509 (8)
H17A0.35460.05690.38040.061*
H17B0.34290.02610.44140.061*
C180.5219 (3)0.1185 (3)0.42583 (12)0.0507 (8)
H18A0.53500.15190.46130.061*
H18B0.58310.05150.42410.061*
O90.56202 (19)0.19592 (16)0.38686 (7)0.0466 (5)
C190.7118 (3)0.2156 (2)0.38849 (11)0.0473 (8)
H19A0.76350.14510.38230.057*
H19B0.74170.24420.42370.057*
C200.7477 (3)0.2982 (2)0.34723 (11)0.0471 (8)
H20A0.85270.30740.34610.056*
H20B0.71290.27160.31230.056*
O100.68266 (18)0.40194 (15)0.35896 (7)0.0404 (5)
C210.7229 (3)0.4842 (2)0.32179 (11)0.0504 (8)
H21A0.68870.46250.28600.060*
H21B0.82840.49050.32160.060*
C220.6590 (3)0.5936 (2)0.33652 (12)0.0472 (7)
H22A0.68550.61020.37380.057*
H22B0.70050.65260.31440.057*
N20.5018 (2)0.5968 (2)0.33005 (9)0.0432 (6)
U11U22U33U12U13U23
Co10.0357 (2)0.0434 (2)0.0341 (2)−0.00146 (18)0.00036 (16)0.00340 (17)
C10.0456 (19)0.0426 (17)0.0476 (18)−0.0042 (14)0.0054 (15)0.0106 (14)
O10.0779 (17)0.0789 (17)0.0382 (12)−0.0091 (13)−0.0153 (11)0.0002 (11)
C20.053 (2)0.0490 (18)0.0451 (17)−0.0006 (16)0.0038 (16)−0.0033 (14)
O20.0462 (15)0.0820 (19)0.0924 (18)0.0188 (13)−0.0037 (13)−0.0085 (14)
C30.0390 (18)0.061 (2)0.0384 (16)−0.0029 (15)−0.0038 (13)−0.0001 (15)
O30.0783 (17)0.0451 (14)0.0711 (15)−0.0066 (12)−0.0143 (13)−0.0077 (12)
C40.0494 (19)0.0424 (17)0.0386 (16)0.0051 (14)−0.0055 (14)0.0010 (14)
O40.0755 (16)0.0628 (15)0.0510 (13)−0.0019 (12)0.0223 (12)0.0182 (11)
K10.0300 (3)0.0400 (3)0.0340 (3)−0.0031 (3)0.0000 (2)−0.0008 (3)
N10.0344 (13)0.0383 (13)0.0495 (14)−0.0043 (11)0.0000 (11)0.0027 (11)
C50.0470 (19)0.054 (2)0.0457 (16)−0.0079 (15)0.0046 (14)0.0111 (15)
C60.049 (2)0.064 (2)0.0440 (17)−0.0022 (17)0.0151 (15)0.0043 (16)
O50.0345 (11)0.0454 (12)0.0400 (10)0.0021 (9)0.0076 (8)0.0007 (9)
C70.0464 (19)0.059 (2)0.0395 (16)0.0137 (16)0.0123 (14)−0.0012 (15)
C80.061 (2)0.0461 (18)0.0443 (17)0.0148 (16)0.0032 (15)−0.0119 (14)
O60.0429 (12)0.0415 (11)0.0472 (11)−0.0025 (9)0.0035 (9)−0.0040 (9)
C90.0429 (18)0.0385 (17)0.072 (2)−0.0015 (14)0.0036 (16)−0.0074 (16)
C100.0372 (18)0.0449 (18)0.078 (2)−0.0054 (15)0.0016 (16)0.0192 (17)
C110.0353 (18)0.0441 (17)0.065 (2)−0.0064 (14)−0.0034 (15)0.0063 (15)
C120.0429 (19)0.0422 (19)0.0618 (19)−0.0042 (14)−0.0080 (15)−0.0065 (15)
O70.0400 (11)0.0412 (11)0.0373 (10)−0.0036 (9)−0.0043 (8)−0.0040 (8)
C130.0459 (19)0.061 (2)0.0364 (15)−0.0009 (15)−0.0063 (13)−0.0111 (15)
C140.0403 (18)0.063 (2)0.0344 (15)−0.0039 (15)−0.0097 (13)−0.0002 (14)
O80.0368 (12)0.0596 (13)0.0406 (11)−0.0091 (9)−0.0085 (9)0.0089 (10)
C150.053 (2)0.074 (2)0.0551 (19)−0.0184 (18)−0.0204 (16)0.0281 (17)
C160.053 (2)0.079 (2)0.0531 (19)−0.0237 (18)−0.0061 (16)0.0281 (18)
C170.049 (2)0.0367 (17)0.067 (2)−0.0009 (14)−0.0008 (16)0.0014 (15)
C180.0392 (18)0.0495 (19)0.0630 (19)0.0065 (15)−0.0036 (15)0.0050 (16)
O90.0327 (12)0.0509 (12)0.0559 (12)0.0042 (9)−0.0032 (9)0.0025 (10)
C190.0298 (16)0.057 (2)0.0546 (18)0.0092 (14)−0.0013 (14)−0.0140 (15)
C200.0313 (16)0.061 (2)0.0489 (17)0.0050 (14)0.0073 (13)−0.0147 (15)
O100.0291 (10)0.0511 (12)0.0413 (10)0.0019 (9)0.0092 (8)−0.0063 (9)
C210.0365 (17)0.065 (2)0.0501 (18)−0.0096 (15)0.0127 (14)−0.0038 (16)
C220.0329 (17)0.057 (2)0.0522 (17)−0.0137 (14)0.0038 (14)0.0079 (15)
N20.0323 (13)0.0560 (16)0.0413 (13)−0.0086 (12)−0.0004 (11)0.0091 (12)
Co1—C41.762 (3)C11—H11A0.9900
Co1—C31.763 (4)C11—H11B0.9900
Co1—C11.767 (3)C12—O71.420 (3)
Co1—C21.770 (4)C12—H12A0.9900
C1—O11.149 (3)C12—H12B0.9900
C2—O21.147 (3)O7—C131.422 (3)
C3—O31.153 (4)C13—C141.490 (4)
C4—O41.148 (3)C13—H13A0.9900
K1—O62.7741 (19)C13—H13B0.9900
K1—O82.8137 (18)C14—O81.436 (3)
K1—O52.8433 (18)C14—H14A0.9900
K1—O72.8481 (19)C14—H14B0.9900
K1—O102.8866 (19)O8—C151.418 (3)
K1—O92.900 (2)C15—C161.508 (4)
K1—N22.991 (2)C15—H15A0.9900
K1—N13.003 (2)C15—H15B0.9900
N1—C171.474 (4)C16—N21.482 (4)
N1—C111.475 (3)C16—H16A0.9900
N1—C51.477 (3)C16—H16B0.9900
C5—C61.505 (4)C17—C181.512 (4)
C5—H5A0.9900C17—H17A0.9900
C5—H5B0.9900C17—H17B0.9900
C6—O51.424 (3)C18—O91.416 (3)
C6—H6A0.9900C18—H18A0.9900
C6—H6B0.9900C18—H18B0.9900
O5—C71.427 (3)O9—C191.421 (3)
C7—C81.478 (4)C19—C201.488 (4)
C7—H7A0.9900C19—H19A0.9900
C7—H7B0.9900C19—H19B0.9900
C8—O61.421 (3)C20—O101.423 (3)
C8—H8A0.9900C20—H20A0.9900
C8—H8B0.9900C20—H20B0.9900
O6—C91.417 (3)O10—C211.424 (3)
C9—C101.499 (4)C21—C221.497 (4)
C9—H9A0.9900C21—H21A0.9900
C9—H9B0.9900C21—H21B0.9900
C10—N21.464 (4)C22—N21.477 (3)
C10—H10A0.9900C22—H22A0.9900
C10—H10B0.9900C22—H22B0.9900
C11—C121.503 (4)
C4—Co1—C3109.24 (13)C12—C11—H11A109.0
C4—Co1—C1110.01 (13)N1—C11—H11B109.0
C3—Co1—C1108.48 (13)C12—C11—H11B109.0
C4—Co1—C2110.86 (13)H11A—C11—H11B107.8
C3—Co1—C2110.27 (14)O7—C12—C11109.4 (2)
C1—Co1—C2107.94 (13)O7—C12—H12A109.8
O1—C1—Co1179.1 (3)C11—C12—H12A109.8
O2—C2—Co1179.4 (3)O7—C12—H12B109.8
O3—C3—Co1178.9 (3)C11—C12—H12B109.8
O4—C4—Co1179.7 (3)H12A—C12—H12B108.2
O6—K1—O899.49 (6)C12—O7—C13111.5 (2)
O6—K1—O559.46 (5)C12—O7—K1114.18 (15)
O8—K1—O5137.33 (6)C13—O7—K1113.37 (15)
O6—K1—O7123.37 (6)O7—C13—C14109.0 (2)
O8—K1—O760.31 (5)O7—C13—H13A109.9
O5—K1—O798.53 (5)C14—C13—H13A109.9
O6—K1—O1096.11 (5)O7—C13—H13B109.9
O8—K1—O1097.90 (5)C14—C13—H13B109.9
O5—K1—O10119.53 (5)H13A—C13—H13B108.3
O7—K1—O10136.07 (5)O8—C14—C13108.8 (2)
O6—K1—O9134.08 (6)O8—C14—H14A109.9
O8—K1—O9119.90 (6)C13—C14—H14A109.9
O5—K1—O998.15 (5)O8—C14—H14B109.9
O7—K1—O997.71 (6)C13—C14—H14B109.9
O10—K1—O958.33 (5)H14A—C14—H14B108.3
O6—K1—N260.43 (6)C15—O8—C14111.1 (2)
O8—K1—N260.42 (6)C15—O8—K1118.35 (16)
O5—K1—N2119.41 (6)C14—O8—K1114.04 (14)
O7—K1—N2120.12 (6)O8—C15—C16108.7 (3)
O10—K1—N260.68 (6)O8—C15—H15A110.0
O9—K1—N2118.26 (6)C16—C15—H15A110.0
O6—K1—N1120.61 (6)O8—C15—H15B110.0
O8—K1—N1120.30 (6)C16—C15—H15B110.0
O5—K1—N161.43 (6)H15A—C15—H15B108.3
O7—K1—N160.89 (6)N2—C16—C15113.5 (2)
O10—K1—N1117.46 (6)N2—C16—H16A108.9
O9—K1—N159.87 (6)C15—C16—H16A108.9
N2—K1—N1178.13 (7)N2—C16—H16B108.9
C17—N1—C11109.8 (2)C15—C16—H16B108.9
C17—N1—C5109.3 (2)H16A—C16—H16B107.7
C11—N1—C5109.4 (2)N1—C17—C18113.5 (2)
C17—N1—K1111.16 (16)N1—C17—H17A108.9
C11—N1—K1108.83 (16)C18—C17—H17A108.9
C5—N1—K1108.26 (16)N1—C17—H17B108.9
N1—C5—C6113.6 (2)C18—C17—H17B108.9
N1—C5—H5A108.8H17A—C17—H17B107.7
C6—C5—H5A108.8O9—C18—C17109.3 (2)
N1—C5—H5B108.8O9—C18—H18A109.8
C6—C5—H5B108.8C17—C18—H18A109.8
H5A—C5—H5B107.7O9—C18—H18B109.8
O5—C6—C5109.7 (2)C17—C18—H18B109.8
O5—C6—H6A109.7H18A—C18—H18B108.3
C5—C6—H6A109.7C18—O9—C19111.7 (2)
O5—C6—H6B109.7C18—O9—K1115.11 (15)
C5—C6—H6B109.7C19—O9—K1116.48 (16)
H6A—C6—H6B108.2O9—C19—C20109.4 (2)
C6—O5—C7110.9 (2)O9—C19—H19A109.8
C6—O5—K1113.40 (15)C20—C19—H19A109.8
C7—O5—K1112.52 (14)O9—C19—H19B109.8
O5—C7—C8109.6 (2)C20—C19—H19B109.8
O5—C7—H7A109.8H19A—C19—H19B108.2
C8—C7—H7A109.8O10—C20—C19109.4 (2)
O5—C7—H7B109.8O10—C20—H20A109.8
C8—C7—H7B109.8C19—C20—H20A109.8
H7A—C7—H7B108.2O10—C20—H20B109.8
O6—C8—C7109.3 (2)C19—C20—H20B109.8
O6—C8—H8A109.8H20A—C20—H20B108.2
C7—C8—H8A109.8C20—O10—C21110.4 (2)
O6—C8—H8B109.8C20—O10—K1114.71 (15)
C7—C8—H8B109.8C21—O10—K1114.61 (15)
H8A—C8—H8B108.3O10—C21—C22109.3 (2)
C9—O6—C8112.7 (2)O10—C21—H21A109.8
C9—O6—K1120.67 (15)C22—C21—H21A109.8
C8—O6—K1119.31 (16)O10—C21—H21B109.8
O6—C9—C10108.9 (2)C22—C21—H21B109.8
O6—C9—H9A109.9H21A—C21—H21B108.3
C10—C9—H9A109.9N2—C22—C21113.5 (2)
O6—C9—H9B109.9N2—C22—H22A108.9
C10—C9—H9B109.9C21—C22—H22A108.9
H9A—C9—H9B108.3N2—C22—H22B108.9
N2—C10—C9114.6 (2)C21—C22—H22B108.9
N2—C10—H10A108.6H22A—C22—H22B107.7
C9—C10—H10A108.6C10—N2—C22110.3 (2)
N2—C10—H10B108.6C10—N2—C16109.9 (2)
C9—C10—H10B108.6C22—N2—C16110.1 (2)
H10A—C10—H10B107.6C10—N2—K1108.21 (15)
N1—C11—C12113.0 (2)C22—N2—K1108.94 (16)
N1—C11—H11A109.0C16—N2—K1109.33 (17)
C17—N1—C5—C6163.4 (2)K1—O8—C15—C1649.7 (3)
C11—N1—C5—C6−76.4 (3)O8—C15—C16—N2−63.7 (4)
K1—N1—C5—C642.1 (3)C11—N1—C17—C18161.4 (2)
N1—C5—C6—O5−68.5 (3)C5—N1—C17—C18−78.5 (3)
C5—C6—O5—C7−176.8 (2)K1—N1—C17—C1841.0 (3)
C5—C6—O5—K155.4 (3)N1—C17—C18—O9−65.0 (3)
C6—O5—C7—C8178.1 (2)C17—C18—O9—C19−170.7 (2)
K1—O5—C7—C8−53.7 (3)C17—C18—O9—K153.5 (3)
O5—C7—C8—O661.3 (3)C18—O9—C19—C20−179.4 (2)
C7—C8—O6—C9170.6 (2)K1—O9—C19—C20−44.3 (3)
C7—C8—O6—K1−38.9 (3)O9—C19—C20—O1064.3 (3)
C8—O6—C9—C10−166.3 (2)C19—C20—O10—C21176.4 (2)
K1—O6—C9—C1043.8 (3)C19—C20—O10—K1−52.4 (3)
O6—C9—C10—N2−61.4 (3)C20—O10—C21—C22−177.2 (2)
C17—N1—C11—C12−78.8 (3)K1—O10—C21—C2251.4 (3)
C5—N1—C11—C12161.2 (2)O10—C21—C22—N2−68.2 (3)
K1—N1—C11—C1243.0 (3)C9—C10—N2—C22−72.8 (3)
N1—C11—C12—O7−68.3 (3)C9—C10—N2—C16165.6 (2)
C11—C12—O7—C13−175.0 (2)C9—C10—N2—K146.3 (3)
C11—C12—O7—K154.9 (3)C21—C22—N2—C10164.9 (2)
C12—O7—C13—C14179.8 (2)C21—C22—N2—C16−73.7 (3)
K1—O7—C13—C14−49.7 (3)C21—C22—N2—K146.2 (3)
O7—C13—C14—O867.6 (3)C15—C16—N2—C10−74.6 (3)
C13—C14—O8—C15172.7 (2)C15—C16—N2—C22163.7 (3)
C13—C14—O8—K1−50.5 (2)C15—C16—N2—K144.1 (3)
C14—O8—C15—C16−175.5 (2)
Table 1

Selected bond lengths (Å)

Co1—C41.762 (3)
Co1—C31.763 (4)
Co1—C11.767 (3)
Co1—C21.770 (4)
  3 in total

1.  The Cambridge Structural Database: a quarter of a million crystal structures and rising.

Authors:  Frank H Allen
Journal:  Acta Crystallogr B       Date:  2002-05-29

2.  Bis(1,2,3,4-eta4-anthracene)cobaltate(1-).

Authors:  William W Brennessel; Victor G Young; John E Ellis
Journal:  Angew Chem Int Ed Engl       Date:  2002-04-02       Impact factor: 15.336

3.  A short history of SHELX.

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

  3 in total

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