Solvent media as the driving force in the formation of one-dimensional silver(I) coordination polymers with 2-methyl­idene-1,3-bis­(nicotino­yloxy)propane

Two kinds of silver(I) coordination polymers consisting of the same chemical composition, [Ag(CF₃SO₃)(L)] [L is 2-methyl­idene-1,3-bis­(nicotino­yloxy)­propane], were synthesized and characterized by infrared (IR) and photoluminescence (PL) spectroscopy, elemental and thermal analyses, and single-crystal X-ray diffractometry; these are catena-poly[[(tri­fluoro­methane­sulfonato-κO)silver(I)]-μ-2-methyl­ene­propane-1,3-diyl dinicotinate-κ²N:N′], [Ag(CF₃SO₃)(C₁₆H₁₄N₂O₄)]_n, and its chloro­form monosolvate, {[Ag(CF₃SO₃)(C₁₆H₁₄N₂O₄)]·CHCl₃}_n. The X-ray crystallographic measurements revealed that the silver(I) compounds exhibit one-dimensional sinusoidal or helical mol­ecular structures depending on the solvent used for crystallization. Self-assembly in a methanol/chloro­form mixture produces the sinusoidal mol­ecular strand, whereas recrystallization from aceto­nitrile medium affords a racemic mixture of the helical strands. These compounds display a fluorescence emission arising from both the ligand-centred transition and the ligand-to-metal charge transfer (LMCT) in the solid state under ambient conditions.

Computing details

For both structures, data collection: APEX2 (Bruker, 2014); cell refinement: SAINT (Bruker, 2014); data reduction: SAINT (Bruker, 2013), SADABS (Bruker, 2014) and XPREP (Bruker, 2014); program(s) used to solve structure: SHELXS97 (Sheldrick, 2008); program(s) used to refine structure: SHELXL2018 (Sheldrick, 2015); molecular graphics: SHELXTL (Sheldrick, 2008); software used to prepare material for publication: SHELXTL (Sheldrick, 2008).

catena-Poly[[(trifluoromethanesulfonato-κO)silver(I)]-µ-2-methylenepropane-1,3-diyl dinicotinate-κ²N:N'] chloroform monosolvate (2150012)

Crystal data

[Ag(CF3O3S)(C16H14N2O4)]·CHCl3	F(000) = 1336
Mr = 674.60	Dx = 1.754 Mg m^−3
Monoclinic, P21/n	Mo Kα radiation, λ = 0.71073 Å
a = 14.987 (3) Å	Cell parameters from 9177 reflections
b = 10.835 (2) Å	θ = 2.3–28.2°
c = 15.997 (3) Å	µ = 1.25 mm^−1
β = 100.49 (3)°	T = 193 K
V = 2554.2 (9) Å^3	Plate, colourless
Z = 4	0.25 × 0.25 × 0.09 mm

Data collection

Bruker APEXII CCD diffractometer	4473 reflections with I > 2σ(I)
ω scans	Rint = 0.028
Absorption correction: multi-scan (SADABS; Bruker, 2014)	θmax = 26.0°, θmin = 1.7°
Tmin = 0.648, Tmax = 0.746	h = −18→18
42404 measured reflections	k = −13→13
5026 independent reflections	l = −19→19

Refinement

Refinement on F^2	18 restraints
Least-squares matrix: full	Hydrogen site location: inferred from neighbouring sites
R[F^2 > 2σ(F^2)] = 0.043	H-atom parameters constrained
wR(F^2) = 0.124	w = 1/[σ^2(Fo^2) + (0.0667P)^2 + 6.8093P] where P = (Fo^2 + 2Fc^2)/3
S = 1.03	(Δ/σ)max = 0.001
5026 reflections	Δρmax = 1.34 e Å^−3
316 parameters	Δρmin = −1.38 e Å^−3

Special details

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.

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

	x	y	z	Uiso*/Ueq
Ag1	0.59207 (2)	0.55906 (3)	0.55553 (2)	0.03397 (12)
Cl1	0.71472 (17)	0.1759 (2)	0.84703 (18)	0.1327 (10)
Cl2	0.7791 (3)	−0.0263 (5)	0.76484 (17)	0.245 (3)
Cl3	0.6256 (4)	−0.0449 (5)	0.8359 (4)	0.317 (4)
S1	0.47247 (6)	0.29738 (8)	0.65254 (5)	0.0273 (2)
F1	0.3818 (2)	0.3860 (3)	0.7637 (2)	0.0665 (8)
F2	0.5243 (2)	0.3792 (4)	0.80679 (19)	0.0861 (12)
F3	0.4461 (3)	0.2142 (3)	0.7988 (2)	0.0884 (12)
O1	0.3300 (2)	0.8783 (3)	0.7765 (2)	0.0520 (8)
O2	0.36998 (19)	0.6786 (2)	0.77957 (18)	0.0367 (6)
O3	0.1960 (2)	0.4460 (3)	1.0558 (2)	0.0503 (8)
O4	0.2993 (2)	0.4640 (3)	0.97158 (19)	0.0404 (7)
O5	0.4827 (2)	0.4211 (3)	0.6235 (2)	0.0419 (7)
O6	0.3901 (2)	0.2388 (3)	0.6120 (2)	0.0498 (8)
O7	0.5523 (2)	0.2224 (3)	0.66130 (19)	0.0432 (7)
N1	0.5298 (2)	0.7195 (3)	0.60340 (19)	0.0289 (6)
N2	0.1773 (2)	0.0685 (3)	1.0004 (2)	0.0305 (7)
C1	0.4748 (2)	0.7084 (3)	0.6601 (2)	0.0273 (7)
H1A	0.463164	0.630091	0.679348	0.041*
C2	0.4344 (2)	0.8096 (3)	0.6912 (2)	0.0268 (7)
C3	0.4517 (3)	0.9265 (3)	0.6628 (2)	0.0321 (8)
H3A	0.424727	0.995609	0.682137	0.048*
C4	0.5096 (3)	0.9387 (3)	0.6056 (3)	0.0356 (9)
H4A	0.523439	1.016153	0.586483	0.053*
C5	0.5467 (3)	0.8337 (3)	0.5773 (2)	0.0343 (8)
H5A	0.585332	0.842237	0.538311	0.051*
C6	0.3723 (3)	0.7953 (3)	0.7538 (2)	0.0311 (8)
C7	0.3113 (3)	0.6497 (4)	0.8390 (2)	0.0360 (8)
H7A	0.284042	0.569303	0.825292	0.054*
H7B	0.262778	0.710087	0.833310	0.054*
C8	0.3612 (3)	0.6490 (4)	0.9288 (3)	0.0438 (10)
C9	0.4435 (5)	0.6885 (8)	0.9524 (4)	0.095 (3)
H9A	0.475339	0.719844	0.912330	0.143*
H9B	0.470830	0.685527	1.009450	0.143*
C10	0.3067 (3)	0.5957 (4)	0.9900 (3)	0.0442 (10)
H10A	0.337090	0.609591	1.048194	0.066*
H10B	0.247058	0.633372	0.982097	0.066*
C11	0.2416 (3)	0.4013 (4)	1.0094 (2)	0.0315 (8)
C12	0.2400 (2)	0.2681 (3)	0.9854 (2)	0.0283 (7)
C13	0.1847 (2)	0.1884 (3)	1.0211 (2)	0.0281 (7)
H13A	0.151898	0.219158	1.060562	0.042*
C14	0.2250 (3)	0.0254 (4)	0.9440 (3)	0.0358 (8)
H14A	0.219555	−0.057651	0.929325	0.054*
C15	0.2820 (3)	0.0980 (4)	0.9066 (3)	0.0416 (9)
H15A	0.314399	0.064432	0.867664	0.062*
C16	0.2905 (3)	0.2222 (4)	0.9278 (3)	0.0371 (9)
H16A	0.328982	0.273288	0.903951	0.056*
C17	0.4561 (3)	0.3205 (4)	0.7615 (3)	0.0458 (10)
C18	0.6925 (7)	0.0559 (7)	0.7777 (7)	0.139 (5)
H18	0.656929	0.082440	0.723101	0.209*

Atomic displacement parameters (Ų)

	U^11	U^22	U^33	U^12	U^13	U^23
Ag1	0.0384 (2)	0.02922 (18)	0.03796 (19)	0.00581 (11)	0.01672 (13)	−0.00404 (11)
Cl1	0.1194 (17)	0.1026 (16)	0.150 (2)	0.0520 (14)	−0.0438 (15)	−0.0319 (15)
Cl2	0.303 (5)	0.320 (5)	0.0800 (15)	0.224 (4)	−0.049 (2)	−0.057 (2)
Cl3	0.256 (5)	0.276 (5)	0.319 (6)	−0.133 (4)	−0.213 (5)	0.155 (5)
S1	0.0343 (5)	0.0209 (4)	0.0302 (4)	0.0008 (3)	0.0148 (4)	0.0003 (3)
F1	0.073 (2)	0.072 (2)	0.0660 (18)	0.0245 (16)	0.0415 (16)	−0.0081 (16)
F2	0.077 (2)	0.136 (3)	0.0435 (16)	−0.003 (2)	0.0051 (15)	−0.032 (2)
F3	0.138 (3)	0.077 (2)	0.069 (2)	0.028 (2)	0.067 (2)	0.0361 (18)
O1	0.070 (2)	0.0279 (15)	0.071 (2)	0.0081 (14)	0.0464 (18)	−0.0020 (14)
O2	0.0473 (16)	0.0277 (13)	0.0428 (15)	0.0018 (12)	0.0285 (13)	0.0039 (11)
O3	0.066 (2)	0.0340 (16)	0.063 (2)	−0.0058 (14)	0.0436 (18)	−0.0067 (14)
O4	0.0523 (17)	0.0302 (14)	0.0458 (16)	−0.0083 (12)	0.0277 (14)	−0.0009 (12)
O5	0.0542 (18)	0.0264 (13)	0.0486 (17)	0.0007 (12)	0.0186 (14)	0.0086 (12)
O6	0.0447 (17)	0.0503 (18)	0.0571 (19)	−0.0127 (14)	0.0161 (14)	−0.0168 (15)
O7	0.0494 (17)	0.0366 (15)	0.0496 (17)	0.0146 (13)	0.0246 (14)	0.0055 (13)
N1	0.0357 (16)	0.0228 (14)	0.0312 (15)	0.0002 (12)	0.0137 (13)	−0.0021 (12)
N2	0.0336 (17)	0.0300 (16)	0.0296 (15)	−0.0038 (12)	0.0105 (13)	0.0012 (12)
C1	0.0330 (18)	0.0204 (16)	0.0303 (17)	−0.0012 (13)	0.0109 (14)	−0.0010 (13)
C2	0.0313 (18)	0.0222 (16)	0.0285 (17)	−0.0004 (14)	0.0096 (14)	−0.0021 (13)
C3	0.044 (2)	0.0214 (17)	0.0334 (19)	0.0011 (15)	0.0131 (16)	−0.0025 (14)
C4	0.052 (2)	0.0216 (18)	0.036 (2)	−0.0036 (16)	0.0162 (18)	0.0019 (14)
C5	0.047 (2)	0.0267 (18)	0.0331 (19)	−0.0031 (16)	0.0188 (16)	0.0001 (15)
C6	0.039 (2)	0.0245 (17)	0.0325 (18)	0.0007 (15)	0.0147 (16)	−0.0023 (14)
C7	0.040 (2)	0.034 (2)	0.040 (2)	−0.0046 (16)	0.0217 (17)	0.0010 (16)
C8	0.059 (3)	0.036 (2)	0.040 (2)	−0.014 (2)	0.017 (2)	0.0009 (17)
C9	0.081 (4)	0.142 (7)	0.057 (3)	−0.066 (5)	−0.003 (3)	0.025 (4)
C10	0.067 (3)	0.0278 (19)	0.043 (2)	−0.0104 (19)	0.023 (2)	−0.0020 (17)
C11	0.037 (2)	0.0314 (18)	0.0285 (17)	−0.0052 (16)	0.0125 (15)	0.0014 (15)
C12	0.0310 (18)	0.0290 (18)	0.0268 (17)	−0.0003 (14)	0.0100 (14)	0.0020 (14)
C13	0.0284 (17)	0.0310 (18)	0.0268 (17)	−0.0001 (14)	0.0104 (14)	0.0017 (14)
C14	0.043 (2)	0.0280 (18)	0.040 (2)	−0.0027 (16)	0.0168 (17)	−0.0048 (16)
C15	0.050 (2)	0.039 (2)	0.043 (2)	−0.0003 (19)	0.0276 (19)	−0.0076 (18)
C16	0.038 (2)	0.035 (2)	0.044 (2)	−0.0057 (16)	0.0224 (17)	−0.0009 (17)
C17	0.055 (3)	0.049 (3)	0.038 (2)	0.008 (2)	0.021 (2)	0.0014 (19)
C18	0.153 (9)	0.076 (5)	0.142 (8)	0.030 (5)	−0.101 (7)	−0.007 (5)

Geometric parameters (Å, º)

Ag1—N2^i	2.175 (3)	C2—C3	1.386 (5)
Ag1—N1	2.177 (3)	C2—C6	1.494 (5)
Ag1—O5	2.598 (3)	C3—C4	1.377 (6)
Ag1—Ag1^ii	3.2596 (11)	C3—H3A	0.9300
Cl1—C18	1.702 (9)	C4—C5	1.378 (5)
Cl2—C18	1.618 (11)	C4—H4A	0.9300
Cl3—C18	1.845 (13)	C5—H5A	0.9300
S1—O7	1.431 (3)	C7—C8	1.494 (6)
S1—O6	1.433 (3)	C7—H7A	0.9700
S1—O5	1.436 (3)	C7—H7B	0.9700
S1—C17	1.821 (4)	C8—C9	1.296 (7)
F1—C17	1.326 (5)	C8—C10	1.500 (6)
F2—C17	1.305 (6)	C9—H9A	0.9300
F3—C17	1.319 (6)	C9—H9B	0.9300
O1—C6	1.195 (5)	C10—H10A	0.9700
O2—C6	1.333 (4)	C10—H10B	0.9700
O2—C7	1.442 (4)	C11—C12	1.493 (5)
O3—C11	1.198 (5)	C12—C16	1.387 (5)
O4—C11	1.330 (4)	C12—C13	1.389 (5)
O4—C10	1.458 (5)	C13—H13A	0.9300
N1—C1	1.338 (5)	C14—C15	1.377 (6)
N1—C5	1.344 (5)	C14—H14A	0.9300
N2—C14	1.332 (5)	C15—C16	1.387 (6)
N2—C13	1.341 (5)	C15—H15A	0.9300
C1—C2	1.387 (5)	C16—H16A	0.9300
C1—H1A	0.9300	C18—H18	0.9800
N2^i—Ag1—N1	166.17 (12)	H7A—C7—H7B	107.9
N2^i—Ag1—O5	105.44 (11)	C9—C8—C7	124.2 (4)
N1—Ag1—O5	88.22 (10)	C9—C8—C10	122.6 (5)
N2^i—Ag1—Ag1^ii	91.78 (9)	C7—C8—C10	113.2 (4)
N1—Ag1—Ag1^ii	97.52 (8)	C8—C9—H9A	120.0
O5—Ag1—Ag1^ii	57.73 (7)	C8—C9—H9B	120.0
O7—S1—O6	115.3 (2)	H9A—C9—H9B	120.0
O7—S1—O5	115.16 (18)	O4—C10—C8	105.9 (3)
O6—S1—O5	113.6 (2)	O4—C10—H10A	110.5
O7—S1—C17	103.9 (2)	C8—C10—H10A	110.5
O6—S1—C17	103.8 (2)	O4—C10—H10B	110.5
O5—S1—C17	102.8 (2)	C8—C10—H10B	110.5
C6—O2—C7	117.6 (3)	H10A—C10—H10B	108.7
C11—O4—C10	116.1 (3)	O3—C11—O4	124.5 (4)
S1—O5—Ag1	141.72 (18)	O3—C11—C12	124.5 (3)
C1—N1—C5	117.9 (3)	O4—C11—C12	111.0 (3)
C1—N1—Ag1	121.5 (2)	C16—C12—C13	119.3 (3)
C5—N1—Ag1	120.6 (2)	C16—C12—C11	122.2 (3)
C14—N2—C13	118.4 (3)	C13—C12—C11	118.5 (3)
C14—N2—Ag1^iii	118.6 (3)	N2—C13—C12	122.0 (3)
C13—N2—Ag1^iii	122.9 (2)	N2—C13—H13A	119.0
N1—C1—C2	122.3 (3)	C12—C13—H13A	119.0
N1—C1—H1A	118.8	N2—C14—C15	123.1 (4)
C2—C1—H1A	118.8	N2—C14—H14A	118.4
C3—C2—C1	119.0 (3)	C15—C14—H14A	118.4
C3—C2—C6	119.4 (3)	C14—C15—C16	119.0 (4)
C1—C2—C6	121.6 (3)	C14—C15—H15A	120.5
C4—C3—C2	118.9 (3)	C16—C15—H15A	120.5
C4—C3—H3A	120.6	C12—C16—C15	118.3 (4)
C2—C3—H3A	120.6	C12—C16—H16A	120.9
C3—C4—C5	118.7 (3)	C15—C16—H16A	120.9
C3—C4—H4A	120.7	F2—C17—F3	108.4 (4)
C5—C4—H4A	120.7	F2—C17—F1	107.5 (4)
N1—C5—C4	123.2 (3)	F3—C17—F1	106.9 (4)
N1—C5—H5A	118.4	F2—C17—S1	111.7 (3)
C4—C5—H5A	118.4	F3—C17—S1	111.0 (3)
O1—C6—O2	125.1 (3)	F1—C17—S1	111.1 (3)
O1—C6—C2	123.8 (3)	Cl2—C18—Cl1	115.9 (5)
O2—C6—C2	111.1 (3)	Cl2—C18—Cl3	105.2 (5)
O2—C7—C8	112.1 (3)	Cl1—C18—Cl3	100.6 (7)
O2—C7—H7A	109.2	Cl2—C18—H18	111.5
C8—C7—H7A	109.2	Cl1—C18—H18	111.5
O2—C7—H7B	109.2	Cl3—C18—H18	111.5
C8—C7—H7B	109.2

Symmetry codes: (i) x+1/2, −y+1/2, z−1/2; (ii) −x+1, −y+1, −z+1; (iii) x−1/2, −y+1/2, z+1/2.

catena-Poly[[(trifluoromethanesulfonato-κO)silver(I)]-µ-2-methylenepropane-1,3-diyl dinicotinate-κ²N:N'] (2150013)

Crystal data

[Ag(CF3O3S)(C16H14N2O4)]	F(000) = 1104
Mr = 555.23	Dx = 1.906 Mg m^−3
Monoclinic, P21/c	Mo Kα radiation, λ = 0.71073 Å
a = 8.4347 (3) Å	Cell parameters from 9899 reflections
b = 15.5581 (6) Å	θ = 2.9–28.3°
c = 14.9879 (6) Å	µ = 1.22 mm^−1
β = 100.310 (1)°	T = 173 K
V = 1935.07 (13) Å^3	Block, colourless
Z = 4	0.32 × 0.29 × 0.12 mm

Data collection

Bruker APEXII CCD diffractometer	3651 reflections with I > 2σ(I)
φ and ω scans	Rint = 0.057
Absorption correction: multi-scan (SADABS; Bruker, 2014)	θmax = 26.5°, θmin = 2.9°
Tmin = 0.687, Tmax = 0.862	h = −10→10
26962 measured reflections	k = −19→19
3932 independent reflections	l = −18→18

Refinement

Refinement on F^2	0 restraints
Least-squares matrix: full	Hydrogen site location: inferred from neighbouring sites
R[F^2 > 2σ(F^2)] = 0.030	H-atom parameters constrained
wR(F^2) = 0.080	w = 1/[σ^2(Fo^2) + (0.0386P)^2 + 1.9099P] where P = (Fo^2 + 2Fc^2)/3
S = 1.05	(Δ/σ)max = 0.001
3932 reflections	Δρmax = 0.73 e Å^−3
280 parameters	Δρmin = −0.66 e Å^−3

Special details

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.

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

	x	y	z	Uiso*/Ueq
Ag1	0.26139 (2)	−0.29867 (2)	0.52433 (2)	0.02797 (9)
S1	0.32136 (7)	−0.34982 (4)	0.78301 (4)	0.02345 (13)
F1	0.01607 (19)	−0.39303 (12)	0.74855 (13)	0.0511 (5)
F2	0.1636 (3)	−0.47510 (14)	0.84386 (15)	0.0717 (6)
F3	0.1759 (2)	−0.48319 (13)	0.70330 (15)	0.0643 (6)
O1	0.8844 (2)	−0.57429 (11)	0.61819 (12)	0.0305 (4)
O2	0.72136 (19)	−0.52539 (10)	0.71049 (11)	0.0250 (3)
O3	0.2245 (2)	−0.69125 (13)	0.78447 (12)	0.0386 (5)
O4	0.42793 (19)	−0.63438 (11)	0.88390 (11)	0.0272 (3)
O5	0.2868 (3)	−0.30263 (14)	0.69947 (15)	0.0522 (6)
O6	0.4644 (2)	−0.40117 (14)	0.79402 (15)	0.0468 (5)
O7	0.2986 (2)	−0.30103 (12)	0.86091 (14)	0.0400 (5)
N1	0.4939 (2)	−0.35753 (12)	0.51893 (13)	0.0225 (4)
N2	−0.0180 (2)	−0.74669 (12)	0.99735 (13)	0.0236 (4)
C1	0.5691 (3)	−0.41301 (14)	0.58131 (14)	0.0208 (4)
H1A	0.528655	−0.420822	0.635993	0.031*
C2	0.7044 (2)	−0.45943 (14)	0.56819 (14)	0.0200 (4)
C3	0.7668 (3)	−0.44601 (16)	0.48951 (16)	0.0244 (4)
H3A	0.859242	−0.476738	0.479275	0.037*
C4	0.6924 (3)	−0.38728 (15)	0.42640 (15)	0.0246 (5)
H4A	0.733793	−0.376028	0.372642	0.037*
C5	0.5565 (3)	−0.34532 (14)	0.44326 (15)	0.0244 (4)
H5A	0.504418	−0.305812	0.399219	0.037*
C6	0.7816 (2)	−0.52569 (14)	0.63415 (15)	0.0213 (4)
C7	0.7900 (3)	−0.58936 (16)	0.77812 (16)	0.0275 (5)
H7A	0.900790	−0.572670	0.806628	0.041*
H7B	0.794365	−0.646313	0.749194	0.041*
C8	0.6832 (3)	−0.59301 (14)	0.84819 (15)	0.0238 (4)
C9	0.7399 (3)	−0.57737 (17)	0.93505 (18)	0.0344 (6)
H9A	0.670981	−0.582355	0.978478	0.052*
H9B	0.849351	−0.561172	0.953831	0.052*
C10	0.5142 (3)	−0.61882 (16)	0.81060 (15)	0.0249 (5)
H10A	0.460090	−0.572639	0.770965	0.037*
H10B	0.514287	−0.671569	0.773663	0.037*
C11	0.2834 (3)	−0.67086 (15)	0.86061 (15)	0.0242 (4)
C12	0.2043 (3)	−0.68434 (14)	0.94089 (15)	0.0218 (4)
C13	0.0598 (3)	−0.72936 (14)	0.92883 (15)	0.0227 (4)
H13A	0.014230	−0.748647	0.869648	0.034*
C14	0.0494 (3)	−0.72008 (16)	1.08087 (16)	0.0260 (5)
H14A	−0.002519	−0.734134	1.130226	0.039*
C15	0.1905 (3)	−0.67327 (17)	1.09822 (16)	0.0291 (5)
H15A	0.232579	−0.654110	1.157944	0.044*
C16	0.2698 (3)	−0.65467 (17)	1.02738 (15)	0.0258 (5)
H16A	0.366949	−0.622343	1.037464	0.039*
C17	0.1606 (3)	−0.42917 (17)	0.76915 (19)	0.0349 (6)

Atomic displacement parameters (Ų)

	U^11	U^22	U^33	U^12	U^13	U^23
Ag1	0.01903 (12)	0.03391 (13)	0.03116 (13)	0.00813 (6)	0.00504 (8)	0.00096 (7)
S1	0.0208 (3)	0.0268 (3)	0.0225 (3)	−0.0031 (2)	0.0032 (2)	−0.0045 (2)
F1	0.0215 (8)	0.0608 (11)	0.0691 (12)	−0.0053 (7)	0.0026 (8)	−0.0239 (9)
F2	0.0816 (15)	0.0576 (12)	0.0730 (14)	−0.0359 (11)	0.0057 (12)	0.0189 (10)
F3	0.0472 (11)	0.0593 (12)	0.0837 (14)	−0.0084 (9)	0.0043 (10)	−0.0498 (11)
O1	0.0256 (8)	0.0341 (9)	0.0318 (9)	0.0105 (7)	0.0053 (7)	0.0039 (7)
O2	0.0208 (8)	0.0287 (8)	0.0259 (8)	0.0049 (6)	0.0057 (6)	0.0102 (6)
O3	0.0335 (10)	0.0605 (13)	0.0214 (9)	−0.0179 (9)	0.0040 (7)	−0.0031 (8)
O4	0.0219 (8)	0.0371 (9)	0.0236 (8)	−0.0073 (7)	0.0062 (6)	0.0006 (7)
O5	0.0649 (16)	0.0552 (14)	0.0347 (11)	−0.0110 (11)	0.0043 (11)	0.0121 (9)
O6	0.0230 (9)	0.0510 (12)	0.0631 (13)	0.0062 (8)	−0.0009 (9)	−0.0129 (10)
O7	0.0363 (11)	0.0456 (11)	0.0402 (11)	−0.0146 (8)	0.0129 (9)	−0.0229 (8)
N1	0.0184 (9)	0.0246 (9)	0.0247 (9)	0.0035 (7)	0.0040 (7)	0.0007 (7)
N2	0.0182 (9)	0.0273 (9)	0.0256 (9)	−0.0023 (7)	0.0043 (7)	0.0011 (8)
C1	0.0174 (10)	0.0242 (10)	0.0209 (10)	0.0000 (8)	0.0038 (8)	0.0009 (8)
C2	0.0151 (9)	0.0221 (10)	0.0218 (10)	−0.0007 (8)	0.0009 (8)	0.0008 (8)
C3	0.0185 (10)	0.0295 (12)	0.0253 (11)	0.0029 (9)	0.0043 (8)	−0.0008 (9)
C4	0.0243 (11)	0.0301 (11)	0.0199 (10)	−0.0009 (9)	0.0052 (8)	0.0020 (9)
C5	0.0233 (11)	0.0255 (11)	0.0230 (10)	0.0019 (9)	0.0008 (8)	0.0028 (8)
C6	0.0143 (9)	0.0242 (10)	0.0244 (10)	−0.0018 (8)	0.0005 (8)	0.0014 (8)
C7	0.0196 (10)	0.0308 (12)	0.0316 (12)	0.0018 (9)	0.0034 (9)	0.0133 (10)
C8	0.0196 (10)	0.0241 (10)	0.0272 (11)	0.0006 (8)	0.0027 (9)	0.0077 (9)
C9	0.0286 (12)	0.0415 (14)	0.0310 (13)	−0.0018 (11)	−0.0002 (10)	0.0048 (11)
C10	0.0207 (11)	0.0331 (12)	0.0215 (10)	−0.0017 (9)	0.0053 (8)	0.0043 (9)
C11	0.0215 (11)	0.0267 (11)	0.0240 (11)	−0.0018 (9)	0.0031 (9)	0.0036 (9)
C12	0.0198 (10)	0.0239 (10)	0.0216 (10)	0.0003 (8)	0.0033 (8)	0.0023 (8)
C13	0.0199 (10)	0.0261 (11)	0.0214 (10)	−0.0007 (9)	0.0019 (8)	0.0012 (8)
C14	0.0206 (11)	0.0351 (12)	0.0229 (11)	0.0012 (9)	0.0058 (9)	−0.0003 (9)
C15	0.0235 (11)	0.0405 (13)	0.0237 (11)	−0.0036 (10)	0.0049 (9)	−0.0060 (10)
C16	0.0181 (11)	0.0321 (12)	0.0263 (12)	−0.0043 (9)	0.0020 (9)	−0.0032 (9)
C17	0.0299 (13)	0.0310 (12)	0.0431 (14)	−0.0058 (10)	0.0046 (11)	−0.0121 (11)

Geometric parameters (Å, º)

Ag1—N2^i	2.1757 (19)	C3—C4	1.382 (3)
Ag1—N1	2.1791 (18)	C3—H3A	0.9500
Ag1—O5	2.596 (2)	C4—C5	1.381 (3)
S1—O6	1.432 (2)	C4—H4A	0.9500
S1—O7	1.4339 (19)	C5—H5A	0.9500
S1—O5	1.436 (2)	C7—C8	1.502 (3)
S1—C17	1.818 (3)	C7—H7A	0.9900
F1—C17	1.328 (3)	C7—H7B	0.9900
F2—C17	1.325 (4)	C8—C9	1.327 (4)
F3—C17	1.320 (3)	C8—C10	1.491 (3)
O1—C6	1.206 (3)	C9—H9A	0.9500
O2—C6	1.332 (3)	C9—H9B	0.9500
O2—C7	1.464 (3)	C10—H10A	0.9900
O3—C11	1.203 (3)	C10—H10B	0.9900
O4—C11	1.333 (3)	C11—C12	1.491 (3)
O4—C10	1.442 (3)	C12—C13	1.389 (3)
N1—C1	1.345 (3)	C12—C16	1.394 (3)
N1—C5	1.347 (3)	C13—H13A	0.9500
N2—C13	1.342 (3)	C14—C15	1.380 (3)
N2—C14	1.344 (3)	C14—H14A	0.9500
C1—C2	1.394 (3)	C15—C16	1.383 (3)
C1—H1A	0.9500	C15—H15A	0.9500
C2—C3	1.390 (3)	C16—H16A	0.9500
C2—C6	1.494 (3)
N2^i—Ag1—N1	169.10 (7)	O2—C7—H7B	110.3
N2^i—Ag1—O5	93.71 (8)	C8—C7—H7B	110.3
N1—Ag1—O5	96.64 (8)	H7A—C7—H7B	108.5
O6—S1—O7	115.74 (13)	C9—C8—C10	124.9 (2)
O6—S1—O5	114.92 (15)	C9—C8—C7	121.5 (2)
O7—S1—O5	113.80 (14)	C10—C8—C7	113.5 (2)
O6—S1—C17	103.30 (13)	C8—C9—H9A	120.0
O7—S1—C17	104.29 (12)	C8—C9—H9B	120.0
O5—S1—C17	102.51 (14)	H9A—C9—H9B	120.0
C6—O2—C7	115.34 (17)	O4—C10—C8	109.61 (18)
C11—O4—C10	115.73 (17)	O4—C10—H10A	109.7
S1—O5—Ag1	149.45 (14)	C8—C10—H10A	109.7
C1—N1—C5	117.97 (18)	O4—C10—H10B	109.7
C1—N1—Ag1	124.00 (14)	C8—C10—H10B	109.7
C5—N1—Ag1	117.56 (14)	H10A—C10—H10B	108.2
C13—N2—C14	117.87 (19)	O3—C11—O4	124.3 (2)
C13—N2—Ag1^ii	122.57 (15)	O3—C11—C12	124.1 (2)
C14—N2—Ag1^ii	118.95 (15)	O4—C11—C12	111.64 (19)
N1—C1—C2	122.02 (19)	C13—C12—C16	118.7 (2)
N1—C1—H1A	119.0	C13—C12—C11	118.3 (2)
C2—C1—H1A	119.0	C16—C12—C11	122.9 (2)
C3—C2—C1	119.1 (2)	N2—C13—C12	122.7 (2)
C3—C2—C6	118.59 (19)	N2—C13—H13A	118.7
C1—C2—C6	122.31 (19)	C12—C13—H13A	118.7
C4—C3—C2	119.0 (2)	N2—C14—C15	123.0 (2)
C4—C3—H3A	120.5	N2—C14—H14A	118.5
C2—C3—H3A	120.5	C15—C14—H14A	118.5
C5—C4—C3	118.5 (2)	C14—C15—C16	119.0 (2)
C5—C4—H4A	120.7	C14—C15—H15A	120.5
C3—C4—H4A	120.7	C16—C15—H15A	120.5
N1—C5—C4	123.4 (2)	C15—C16—C12	118.6 (2)
N1—C5—H5A	118.3	C15—C16—H16A	120.7
C4—C5—H5A	118.3	C12—C16—H16A	120.7
O1—C6—O2	124.8 (2)	F3—C17—F2	107.4 (2)
O1—C6—C2	123.0 (2)	F3—C17—F1	107.7 (2)
O2—C6—C2	112.21 (18)	F2—C17—F1	107.6 (2)
O2—C7—C8	107.29 (18)	F3—C17—S1	110.3 (2)
O2—C7—H7A	110.3	F2—C17—S1	111.64 (19)
C8—C7—H7A	110.3	F1—C17—S1	111.96 (18)

Symmetry codes: (i) −x, y+1/2, −z+3/2; (ii) −x, y−1/2, −z+3/2.