Crystal structure and Hirshfeld surface analysis of (2E,2′E)-1,1′-[seleno­bis­(4,1-phenyl­ene)]bis­[3-(4-chloro­phen­yl)prop-2-en-1-one] (2024)

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Supporting information Key indicators checkCIF/PLATON results

Crystal structure and Hirshfeld surface analysis of (2E,2′E)-1,1′-[seleno­bis­(4,1-phenyl­ene)]bis­[3-(4-chloro­phen­yl)prop-2-en-1-one] (1)research communications

Issue contentsCrystal structure and Hirshfeld surface analysis of (2E,2′E)-1,1′-[seleno­bis­(4,1-phenyl­ene)]bis­[3-(4-chloro­phen­yl)prop-2-en-1-one] (7)

Crystal structure and Hirshfeld surface analysis of (2E,2′E)-1,1′-[seleno­bis­(4,1-phenyl­ene)]bis­[3-(4-chloro­phen­yl)prop-2-en-1-one] (9)

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Crystal structure and Hirshfeld surface analysis of (2E,2′E)-1,1′-[seleno­bis­(4,1-phenyl­ene)]bis­[3-(4-chloro­phen­yl)prop-2-en-1-one] (11)Download citation

Download PDF of articleCrystal structure and Hirshfeld surface analysis of (2E,2′E)-1,1′-[seleno­bis­(4,1-phenyl­ene)]bis­[3-(4-chloro­phen­yl)prop-2-en-1-one] (13)

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Introduction to Peircean Visual Semiotics

Acta Cryst. (2019). E75, 1724-1728
https://doi.org/10.1107/S2056989019014038

Download PDF of articleCrystal structure and Hirshfeld surface analysis of (2E,2′E)-1,1′-[seleno­bis­(4,1-phenyl­ene)]bis­[3-(4-chloro­phen­yl)prop-2-en-1-one] (15)

Crystal structure and Hirshfeld surface analysis of (2E,2′E)-1,1′-[seleno­bis­(4,1-phenyl­ene)]bis­[3-(4-chloro­phen­yl)prop-2-en-1-one] (17)Download citation

Crystal structure and Hirshfeld surface analysis of (2E,2′E)-1,1′-[seleno­bis­(4,1-phenyl­ene)]bis­[3-(4-chloro­phen­yl)prop-2-en-1-one] (19)

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Issue contentsCrystal structure and Hirshfeld surface analysis of (2E,2′E)-1,1′-[seleno­bis­(4,1-phenyl­ene)]bis­[3-(4-chloro­phen­yl)prop-2-en-1-one] (21)

Open Crystal structure and Hirshfeld surface analysis of (2E,2′E)-1,1′-[seleno­bis­(4,1-phenyl­ene)]bis­[3-(4-chloro­phen­yl)prop-2-en-1-one] (24) access

Crystal structure and Hirshfeld surface analysis of (2E,2′E)-1,1′-[seleno­bis­(4,1-phenyl­ene)]bis­[3-(4-chloro­phen­yl)prop-2-en-1-one] (26)

H. Bouraoui, Y. Mechehoud, S. Chetioui, R. Touzani, M. Medjani, A. Benmilat and A. Boudjada

In the title organoselenium com­pound, the C—Se—C angle is 99.0 (2)°, with the dihedral angle between the planes of the attached benzene rings being 79.1 (3)°.

Keywords: crystal structure; organoselenium; selenium; Hirshfeld surface analysis.

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Supporting information

Crystallographic Information File (CIF) https://doi.org/10.1107/S2056989019014038/su5517sup1.cif
Contains datablocks Global, I

CCDC reference: 1959404

Key indicators

  • Single-crystal X-ray study
  • T = 293 K
  • Mean Crystal structure and Hirshfeld surface analysis of (2E,2′E)-1,1′-[seleno­bis­(4,1-phenyl­ene)]bis­[3-(4-chloro­phen­yl)prop-2-en-1-one] (30)(C-C) = 0.009 Å
  • R factor = 0.038
  • wR factor = 0.074
  • Data-to-parameter ratio = 11.6

checkCIF/PLATON results

No syntax errors foundCrystal structure and Hirshfeld surface analysis of (2E,2′E)-1,1′-[seleno­bis­(4,1-phenyl­ene)]bis­[3-(4-chloro­phen­yl)prop-2-en-1-one] (31)Alert level ADIFF019_ALERT_1_A _diffrn_standards_number is missing Number of standards used in measurement.DIFF020_ALERT_1_A _diffrn_standards_interval_count and _diffrn_standards_interval_time are missing. Number of measurements between standards or time (min) between standards.DIFF022_ALERT_1_A _diffrn_standards_decay_% is missing Percentage decrease in standards intensity.Crystal structure and Hirshfeld surface analysis of (2E,2′E)-1,1′-[seleno­bis­(4,1-phenyl­ene)]bis­[3-(4-chloro­phen­yl)prop-2-en-1-one] (32)Alert level CPLAT241_ALERT_2_C High 'MainMol' Ueq as Compared to Neighbors of Se1 CheckPLAT341_ALERT_3_C Low Bond Precision on C-C Bonds ............... 0.00875 Ang.PLAT480_ALERT_4_C Long H...A H-Bond Reported H19 ..O2 . 2.63 Ang.PLAT790_ALERT_4_C Centre of Gravity not Within Unit Cell: Resd. # 1 Note C30 H20 Cl2 O2 SeCrystal structure and Hirshfeld surface analysis of (2E,2′E)-1,1′-[seleno­bis­(4,1-phenyl­ene)]bis­[3-(4-chloro­phen­yl)prop-2-en-1-one] (33)Alert level GPLAT199_ALERT_1_G Reported _cell_measurement_temperature ..... (K) 293 CheckPLAT200_ALERT_1_G Reported _diffrn_ambient_temperature ..... (K) 293 Check 3 ALERT level A = Most likely a serious problem - resolve or explain 0 ALERT level B = A potentially serious problem, consider carefully 4 ALERT level C = Check. Ensure it is not caused by an omission or oversight 2 ALERT level G = General information/check it is not something unexpected 5 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 1 ALERT type 2 Indicator that the structure model may be wrong or deficient 1 ALERT type 3 Indicator that the structure quality may be low 2 ALERT type 4 Improvement, methodology, query or suggestion 0 ALERT type 5 Informative message, check

Computing details top

Data collection: CrysAlis PRO (Agilent, 2013); cell refinement: CrysAlis PRO (Agilent, 2013); data reduction: CrysAlis PRO (Agilent, 2013); program(s) used to solve structure: SHELXS97 (Sheldrick, 2008); program(s) used to refine structure: SHELXL2018 (Sheldrick, 2015); molecular graphics: Mercury (Macrae et al., 2008); software used to prepare material for publication: SHELXL2018 (Sheldrick, 2015), PLATON (Spek, 2009) and publCIF(Westrip, 2010).

(2E,2'E)-1,1'-[Selenobis(4,1-phenylene)]bis[3-(4-chlorophenyl)prop-2-en-1-one] top

Crystal data

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C30H20Cl2O2SeZ = 1
Mr = 562.32F(000) = 284
Triclinic, P1Dx = 1.522 Mg m−3
a = 4.9468 (3) ÅMo Kα radiation, λ = 0.71073 Å
b = 5.8712 (6) ÅCell parameters from 1538 reflections
c = 21.3530 (18) Åθ = 3.9–28.9°
α = 85.019 (8)°µ = 1.77 mm−1
β = 84.094 (6)°T = 293 K
γ = 86.465 (7)°Prism, yellow
V = 613.68 (9) Å30.03 × 0.02 × 0.01 mm

Data collection

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Agilent Technologies Xcalibur Eos
diffractometer		Rint = 0.030
Graphite monochromatorθmax = 28.0°, θmin = 2.9°
ω scansh = −6→6
5341 measured reflectionsk = −7→5
3672 independent reflectionsl = −28→28
2465 reflections with I > 2σ(I)

Refinement

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Refinement on F2Secondary atom site location: difference Fourier map
Least-squares matrix: fullHydrogen site location: inferred from neighbouring sites
R[F2 > 2σ(F2)] = 0.038H-atom parameters constrained
wR(F2) = 0.074 w = 1/[σ2(Fo2) + (0.0181P)2]
where P = (Fo2 + 2Fc2)/3
S = 0.81(Δ/σ)max < 0.001
3672 reflectionsΔρmax = 0.41 e Å−3
317 parametersΔρmin = −0.32 e Å−3
3 restraintsAbsolute structure: Refined as an inversion twin
Primary atom site location: structure-invariant direct methodsAbsolute structure parameter: 0.002 (11)

Special details

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Geometry. All esds (except the esd in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell esds are taken into account individually in the estimation of esds in distances, angles and torsion angles; correlations between esds in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell esds is used for estimating esds involving l.s. planes.

Refinement. Refined as a 2-component inversion twin.

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

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xyzUiso*/Ueq
Se10.41094 (7)0.32993 (9)0.51703 (4)0.0688 (2)
Cl12.5172 (3)0.7697 (3)0.08312 (8)0.0590 (4)
Cl22.0618 (3)−0.0037 (3)0.97993 (8)0.0649 (5)
O11.4087 (9)−0.1409 (9)0.3126 (3)0.0780 (15)
O20.9496 (10)0.8409 (8)0.7498 (2)0.0823 (16)
C10.7186 (10)0.2486 (11)0.4597 (3)0.0479 (15)
C20.8352 (11)0.0295 (12)0.4605 (3)0.0615 (18)
H10.768523−0.0813840.4909390.074*
C31.0483 (12)−0.0293 (12)0.4171 (3)0.0593 (17)
H21.122475−0.1788500.4182210.071*
C41.1520 (10)0.1346 (11)0.3718 (3)0.0444 (14)
C51.0451 (11)0.3551 (11)0.3723 (3)0.0503 (16)
H31.1203880.4689320.3439790.060*
C60.8227 (12)0.4092 (12)0.4153 (3)0.0553 (18)
H40.7442400.5573700.4135260.066*
C71.3680 (11)0.0604 (11)0.3220 (3)0.0507 (15)
C81.5292 (10)0.2372 (11)0.2840 (3)0.0461 (15)
H51.5229980.3837710.2975880.055*
C91.6809 (10)0.1939 (11)0.2315 (3)0.0457 (15)
H61.6662130.0512070.2167210.055*
C101.8698 (9)0.3462 (10)0.1941 (3)0.0439 (14)
C112.0024 (10)0.2799 (11)0.1368 (3)0.0499 (15)
H71.9583060.1437560.1220560.060*
C122.1960 (11)0.4092 (11)0.1015 (3)0.0534 (16)
H82.2775200.3648130.0629000.064*
C132.2653 (10)0.6084 (11)0.1255 (3)0.0464 (15)
C142.1353 (11)0.6771 (12)0.1810 (3)0.0479 (15)
H92.1807940.8130020.1956440.057*
C151.9411 (10)0.5512 (11)0.2153 (3)0.0484 (15)
H101.8557300.6015510.2528600.058*
C160.5992 (10)0.4225 (11)0.5837 (3)0.0498 (16)
C170.7975 (12)0.2824 (11)0.6111 (3)0.0577 (18)
H110.8486150.1417570.5952850.069*
C180.9211 (12)0.3470 (11)0.6615 (3)0.0542 (16)
H121.0519620.2485470.6794060.065*
C190.8519 (11)0.5582 (11)0.6859 (3)0.0457 (14)
C200.6508 (12)0.6967 (12)0.6588 (3)0.0580 (17)
H130.5969470.8361790.6750610.070*
C210.5295 (10)0.6326 (11)0.6087 (3)0.0509 (15)
H140.3983110.7310000.5909200.061*
C220.9847 (12)0.6393 (11)0.7381 (3)0.0540 (16)
C231.1622 (12)0.4833 (11)0.7744 (3)0.0510 (16)
H151.1862380.3319340.7643540.061*
C241.2909 (10)0.5463 (11)0.8210 (3)0.0499 (15)
H161.2587450.6979690.8303600.060*
C251.4776 (10)0.4073 (10)0.8597 (3)0.0453 (14)
C261.5525 (11)0.4873 (11)0.9142 (3)0.0574 (17)
H171.4812610.6293890.9258720.069*
C271.7295 (11)0.3629 (12)0.9516 (3)0.0553 (16)
H181.7756000.4196910.9882240.066*
C281.8357 (10)0.1557 (11)0.9342 (3)0.0505 (16)
C291.7647 (11)0.0694 (11)0.8801 (3)0.0529 (17)
H191.836285−0.0732160.8688690.063*
C301.5893 (10)0.1942 (10)0.8431 (3)0.0522 (16)
H201.5441350.1363660.8066090.063*

Atomic displacement parameters (Å2)

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U11U22U33U12U13U23
Se10.0439 (3)0.1060 (6)0.0592 (4)−0.0158 (3)0.0067 (3)−0.0279 (4)
Cl10.0504 (8)0.0624 (11)0.0618 (11)−0.0106 (7)0.0025 (7)0.0047 (9)
Cl20.0606 (9)0.0696 (12)0.0622 (11)0.0083 (9)−0.0051 (8)−0.0008 (10)
O10.101 (4)0.052 (3)0.075 (4)−0.015 (3)0.031 (3)−0.013 (3)
O20.130 (4)0.054 (3)0.068 (3)0.025 (3)−0.035 (3)−0.024 (3)
C10.038 (3)0.067 (5)0.042 (4)−0.014 (3)−0.004 (2)−0.013 (3)
C20.061 (4)0.075 (5)0.047 (4)−0.024 (4)0.017 (3)−0.010 (4)
C30.066 (4)0.053 (4)0.057 (5)−0.020 (3)0.011 (3)−0.004 (4)
C40.040 (3)0.060 (4)0.036 (3)−0.012 (3)−0.003 (2)−0.014 (3)
C50.057 (4)0.059 (4)0.033 (4)−0.009 (3)0.004 (3)−0.002 (3)
C60.051 (4)0.061 (5)0.057 (5)−0.010 (3)−0.004 (3)−0.019 (4)
C70.056 (3)0.054 (4)0.043 (4)−0.016 (3)0.007 (3)−0.013 (3)
C80.046 (3)0.053 (4)0.039 (4)−0.007 (3)0.006 (3)−0.016 (3)
C90.041 (3)0.050 (4)0.046 (4)0.002 (3)−0.004 (3)−0.002 (3)
C100.039 (3)0.048 (4)0.045 (3)0.003 (3)0.000 (2)−0.010 (3)
C110.060 (4)0.046 (4)0.045 (4)−0.002 (3)0.002 (3)−0.017 (3)
C120.056 (4)0.063 (5)0.040 (4)−0.012 (3)0.012 (3)−0.011 (3)
C130.037 (3)0.056 (4)0.042 (3)0.007 (3)−0.003 (2)0.012 (3)
C140.053 (3)0.050 (4)0.040 (4)−0.003 (3)−0.001 (3)−0.004 (3)
C150.048 (3)0.059 (4)0.038 (3)0.002 (3)0.002 (3)−0.013 (3)
C160.036 (3)0.062 (4)0.050 (4)−0.019 (3)0.013 (3)−0.010 (3)
C170.061 (4)0.047 (4)0.065 (5)−0.003 (3)0.007 (3)−0.016 (4)
C180.064 (4)0.053 (4)0.045 (4)−0.008 (3)0.006 (3)−0.012 (3)
C190.049 (3)0.050 (4)0.036 (3)−0.003 (3)0.006 (3)−0.005 (3)
C200.064 (4)0.059 (4)0.049 (4)0.002 (3)0.009 (3)−0.014 (3)
C210.045 (3)0.060 (4)0.047 (4)0.000 (3)0.003 (3)−0.009 (3)
C220.066 (4)0.054 (4)0.037 (3)0.016 (3)0.004 (3)−0.003 (3)
C230.075 (4)0.038 (4)0.039 (4)−0.003 (3)0.004 (3)−0.002 (3)
C240.056 (3)0.049 (4)0.042 (3)0.002 (3)0.006 (3)−0.004 (3)
C250.045 (3)0.046 (4)0.044 (4)−0.005 (3)0.006 (3)−0.009 (3)
C260.059 (4)0.052 (4)0.061 (5)0.000 (3)0.006 (3)−0.015 (4)
C270.050 (3)0.069 (5)0.047 (4)0.008 (3)−0.002 (3)−0.019 (3)
C280.040 (3)0.059 (4)0.049 (4)−0.002 (3)0.006 (3)0.001 (3)
C290.060 (4)0.042 (4)0.057 (4)0.016 (3)−0.012 (3)−0.012 (3)
C300.056 (3)0.052 (4)0.050 (4)−0.004 (3)−0.002 (3)−0.020 (3)

Geometric parameters (Å, º)

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Se1—C11.916 (5)C14—C151.362 (8)
Se1—C161.913 (6)C14—H90.9300
Cl1—C131.741 (6)C15—H100.9300
Cl2—C281.737 (6)C16—C171.385 (8)
O1—C71.217 (7)C16—C211.396 (8)
O2—C221.229 (7)C17—C181.383 (9)
C1—C21.376 (8)C17—H110.9300
C1—C61.364 (8)C18—C191.396 (8)
C2—C31.377 (8)C18—H120.9300
C2—H10.9300C19—C201.387 (7)
C3—C41.386 (8)C19—C221.477 (8)
C3—H20.9300C20—C211.371 (8)
C4—C51.368 (8)C20—H130.9300
C4—C71.500 (7)C21—H140.9300
C5—C61.398 (8)C22—C231.459 (7)
C5—H30.9300C23—C241.325 (8)
C6—H40.9300C23—H150.9300
C7—C81.482 (8)C24—C251.466 (7)
C8—C91.317 (8)C24—H160.9300
C8—H50.9300C25—C261.383 (8)
C9—C101.462 (8)C25—C301.395 (7)
C9—H60.9300C26—C271.380 (8)
C10—C111.401 (7)C26—H170.9300
C10—C151.400 (8)C27—C281.361 (8)
C11—C121.380 (7)C27—H180.9300
C11—H70.9300C28—C291.387 (8)
C12—C131.392 (8)C29—C301.369 (7)
C12—H80.9300C29—H190.9300
C13—C141.369 (8)C30—H200.9300
C1—Se1—C1699.0 (2)C17—C16—C21117.4 (6)
C2—C1—C6118.2 (5)C17—C16—Se1122.2 (5)
C2—C1—Se1122.1 (5)C21—C16—Se1120.3 (5)
C6—C1—Se1119.7 (5)C18—C17—C16121.4 (6)
C1—C2—C3121.5 (6)C18—C17—H11119.3
C1—C2—H1119.2C16—C17—H11119.3
C3—C2—H1119.2C17—C18—C19120.8 (6)
C2—C3—C4120.0 (6)C17—C18—H12119.6
C2—C3—H2120.0C19—C18—H12119.6
C4—C3—H2120.0C20—C19—C18117.6 (6)
C5—C4—C3119.0 (5)C20—C19—C22119.4 (6)
C5—C4—C7122.4 (5)C18—C19—C22123.0 (6)
C3—C4—C7118.5 (6)C21—C20—C19121.5 (6)
C4—C5—C6120.0 (6)C21—C20—H13119.3
C4—C5—H3120.0C19—C20—H13119.3
C6—C5—H3120.0C20—C21—C16121.3 (6)
C1—C6—C5121.2 (6)C20—C21—H14119.4
C1—C6—H4119.4C16—C21—H14119.4
C5—C6—H4119.4O2—C22—C19119.4 (6)
O1—C7—C8120.5 (6)O2—C22—C23120.2 (6)
O1—C7—C4120.7 (6)C19—C22—C23120.4 (6)
C8—C7—C4118.7 (6)C24—C23—C22123.3 (6)
C9—C8—C7122.3 (6)C24—C23—H15118.3
C9—C8—H5118.9C22—C23—H15118.3
C7—C8—H5118.9C23—C24—C25128.2 (6)
C8—C9—C10127.0 (6)C23—C24—H16115.9
C8—C9—H6116.5C25—C24—H16115.9
C10—C9—H6116.5C26—C25—C30117.6 (5)
C11—C10—C15117.6 (6)C26—C25—C24120.2 (6)
C11—C10—C9119.8 (6)C30—C25—C24122.2 (6)
C15—C10—C9122.5 (6)C27—C26—C25122.1 (6)
C12—C11—C10122.4 (6)C27—C26—H17118.9
C12—C11—H7118.8C25—C26—H17118.9
C10—C11—H7118.8C28—C27—C26119.0 (6)
C13—C12—C11117.8 (6)C28—C27—H18120.5
C13—C12—H8121.1C26—C27—H18120.5
C11—C12—H8121.1C27—C28—C29120.6 (5)
C12—C13—C14120.5 (6)C27—C28—Cl2120.1 (5)
C12—C13—Cl1118.7 (5)C29—C28—Cl2119.3 (5)
C14—C13—Cl1120.8 (6)C30—C29—C28120.0 (6)
C15—C14—C13121.6 (7)C30—C29—H19120.0
C15—C14—H9119.2C28—C29—H19120.0
C13—C14—H9119.2C29—C30—C25120.7 (6)
C14—C15—C10120.1 (6)C29—C30—H20119.7
C14—C15—H10120.0C25—C30—H20119.7
C10—C15—H10120.0
C6—C1—C2—C3−1.1 (9)C21—C16—C17—C180.4 (9)
Se1—C1—C2—C3176.9 (5)Se1—C16—C17—C18−176.5 (5)
C1—C2—C3—C40.7 (10)C16—C17—C18—C19−0.9 (10)
C2—C3—C4—C52.0 (9)C17—C18—C19—C201.6 (9)
C2—C3—C4—C7−174.9 (6)C17—C18—C19—C22−177.7 (6)
C3—C4—C5—C6−4.2 (9)C18—C19—C20—C21−2.0 (9)
C7—C4—C5—C6172.5 (6)C22—C19—C20—C21177.4 (5)
C2—C1—C6—C5−1.3 (9)C19—C20—C21—C161.5 (9)
Se1—C1—C6—C5−179.3 (5)C17—C16—C21—C20−0.7 (8)
C4—C5—C6—C14.0 (10)Se1—C16—C21—C20176.2 (4)
C5—C4—C7—O1−160.6 (6)C20—C19—C22—O2−12.2 (9)
C3—C4—C7—O116.1 (9)C18—C19—C22—O2167.1 (6)
C5—C4—C7—C818.7 (8)C20—C19—C22—C23169.6 (6)
C3—C4—C7—C8−164.5 (5)C18—C19—C22—C23−11.1 (9)
O1—C7—C8—C913.7 (10)O2—C22—C23—C240.5 (10)
C4—C7—C8—C9−165.7 (5)C19—C22—C23—C24178.8 (5)
C7—C8—C9—C10−172.9 (5)C22—C23—C24—C25−178.6 (5)
C8—C9—C10—C11−175.5 (6)C23—C24—C25—C26−167.4 (6)
C8—C9—C10—C159.4 (8)C23—C24—C25—C3013.7 (9)
C15—C10—C11—C12−0.3 (8)C30—C25—C26—C27−0.5 (9)
C9—C10—C11—C12−175.6 (5)C24—C25—C26—C27−179.4 (5)
C10—C11—C12—C132.1 (8)C25—C26—C27—C280.6 (10)
C11—C12—C13—C14−2.9 (8)C26—C27—C28—C29−0.8 (9)
C11—C12—C13—Cl1177.9 (4)C26—C27—C28—Cl2179.3 (5)
C12—C13—C14—C151.9 (9)C27—C28—C29—C300.9 (9)
Cl1—C13—C14—C15−178.9 (4)Cl2—C28—C29—C30−179.2 (5)
C13—C14—C15—C100.0 (8)C28—C29—C30—C25−0.8 (9)
C11—C10—C15—C14−0.8 (8)C26—C25—C30—C290.6 (9)
C9—C10—C15—C14174.4 (5)C24—C25—C30—C29179.5 (5)

Hydrogen-bond geometry (Å, º)

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D—H···AD—HH···AD···AD—H···A
C29—H19···O2i0.932.633.218 (8)122

Symmetry code: (i) x+1, y−1, z.

Relative percentage contributions of the close contacts to the Hirshfeld surface of the title compound.

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ContactPercentage contribution
H···H36.0
C···H/H···C17.7
O···H/H···O11.5
Cl···H/H···Cl11.0
C···C10.5
C···Cl4.3
C···Se3.5
Se···H/H···Se2.8
Cl···Cl2.4
C···O0.3

Short contacts (Å) in the crystal of the title compound.

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Atom 1Atom 2Length (Å)Length-VdW (Å)
H3H10i2.4980.098
O2H19ii2.632-0.088
H12O2iii2.7590.039
O1H3iii2.7700.050
O2H20ii2.8180.098
H2C6iii2.9220.022
C3H4ii2.9430.043
H3C15i2.9640.064
O2C29ii3.217-0.003
O2C30ii3.3140.094
C5C8i3.4610.061
Se1C17i3.475-0.125
C20C23i3.4800.080
Cl2Cl1iv3.5490.049

Symmetry codes: (i) x-1, y, z; (ii) x - 1, y + 1, z; (iii) x, y - 1, z; (iv) x - 1, y - 1, z + 1.


Crystal structure and Hirshfeld surface analysis of (2E,2′E)-1,1′-[seleno­bis­(4,1-phenyl­ene)]bis­[3-(4-chloro­phen­yl)prop-2-en-1-one] (2024)
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