trans-Carbonyl-chloridobis[dicyclo-hex-yl(4-isopropyl-phen-yl)phosphane]rhodium(I) acetone monosolvate.

The title rhodium Vaska-type complex, trans-[RhCl{P(C(6)H(11))(2)(C(6)H(4)-4-C(3)H(7))(2)}(2)(CO)], crystallizes with an accompanying acetone solvent mol-ecule. The metal atom shows a distorted square-planar coordination environment with selected important geometrical parameters of Rh-P = 2.3237 (6) and 2.3253 (6) Å, Rh-Cl = 2.3724 (6) Å, Rh-C = 1.802 (2) Å, P-Rh-P = 173.42 (2)° and Cl-Rh-C = 179.13 (7)°. Effective cone angles for the two P atoms are 165 and 161°, respectively. Both isopropyl groups and the acetone mol-ecule are disordered with occupancy values of 0.523 (5):0.477 (5), 0.554 (8):0.446 (8) and 0.735 (4):0.265 (4), respectively. The crystal packing is stabilized by weak C-H⋯O and C-H⋯Cl contacts.

Related literature

For examples of the packing disorder observed in Vaska-type complexes of Rh, Ir, Pd and Pt, see: Chen et al. (1991 ▶), Kuwabara & Bau (1994 ▶), Otto et al. (2000 ▶) and Otto (2001 ▶), respectively. For background to our investigation of the steric and electronic effects of group 15 ligands, see: Roodt et al. (2003 ▶); Muller et al. (2006 ▶, 2008 ▶). For the related synthesis of the trans-[IrCl(CO)(PPh3)2] complex, see: Collman et al. (1990 ▶). For background to cone angles, see Tolman (1977 ▶); Otto et al. (2000 ▶); Otto (2001 ▶). For background to the Cambridge Structural Database, see: Allen (2002 ▶).

Experimental

Crystal data

[RhCl(C21H33P)2(CO)]·C3H6O

M = 857.34

Tetragonal,

a = 16.0130 (15) Å

c = 35.557 (3) Å

V = 9117.4 (15) Å3

Z = 8

Mo Kα radiation

μ = 0.54 mm−1

T = 100 K

0.34 × 0.24 × 0.14 mm

Data collection

Bruker APEX DUO 4K CCD diffractometer

Absorption correction: multi-scan (SADABS; Bruker, 2008 ▶) T min = 0.838, T max = 0.929

245346 measured reflections

11404 independent reflections

10089 reflections with I > 2σ(I)

R int = 0.105

Refinement

R[F 2 > 2σ(F 2)] = 0.030

wR(F 2) = 0.059

S = 1.04

11404 reflections

544 parameters

31 restraints

H-atom parameters constrained

Δρmax = 0.58 e Å−3

Δρmin = −0.36 e Å−3

Absolute structure: Flack (1983 ▶), 4954 Friedel pairs

Flack parameter: −0.029 (17)

Data collection: APEX2 (Bruker, 2011 ▶); cell refinement: SAINT (Bruker, 2008 ▶); data reduction: SAINT and XPREP (Bruker, 2008 ▶); program(s) used to solve structure: SIR97 (Altomare et al., 1999 ▶); program(s) used to refine structure: SHELXL97 (Sheldrick, 2008 ▶); molecular graphics: DIAMOND (Brandenburg & Putz, 2005 ▶); software used to prepare material for publication: WinGX (Farrugia, 1999 ▶).

Crystal structure: contains datablock(s) global, I. DOI: 10.1107/S1600536811033447/zl2392sup1.cif

Structure factors: contains datablock(s) I. DOI: 10.1107/S1600536811033447/zl2392Isup2.hkl

Additional supplementary materials: crystallographic information; 3D view; checkCIF report

[RhCl(C21H33P)2(CO)]·C3H6O	Dx = 1.249 Mg m−3
Mr = 857.34	Mo Kα radiation, λ = 0.71073 Å
Tetragonal, P43212	Cell parameters from 9890 reflections
Hall symbol: P 4nw 2abw	θ = 2.3–27.4°
a = 16.0130 (15) Å	µ = 0.54 mm−1
c = 35.557 (3) Å	T = 100 K
V = 9117.4 (15) Å3	Block, yellow
Z = 8	0.34 × 0.24 × 0.14 mm
F(000) = 3648

Bruker APEX DUO 4K CCD diffractometer	11404 independent reflections
graphite	10089 reflections with I > 2σ(I)
Detector resolution: 8.4 pixels mm-1	Rint = 0.105
φ and ω scans	θmax = 28.4°, θmin = 1.7°
Absorption correction: multi-scan (SADABS; Bruker, 2008)	h = −21→21
Tmin = 0.838, Tmax = 0.929	k = −21→18
245346 measured reflections	l = −47→46

Refinement on F2	Secondary atom site location: difference Fourier map
Least-squares matrix: full	Hydrogen site location: inferred from neighbouring sites
R[F2 > 2σ(F2)] = 0.030	H-atom parameters constrained
wR(F2) = 0.059	w = 1/[σ2(Fo2) + (0.0171P)2 + 5.251P] where P = (Fo2 + 2Fc2)/3
S = 1.04	(Δ/σ)max = 0.014
11404 reflections	Δρmax = 0.58 e Å−3
544 parameters	Δρmin = −0.36 e Å−3
31 restraints	Absolute structure: Flack (1983), 4954 Friedel pairs
Primary atom site location: structure-invariant direct methods	Flack parameter: −0.029 (17)

Experimental. The intensity data was collected on a Bruker Apex DUO 4 K CCD diffractometer using an exposure time of 15 s/frame. A total of 3328 frames were collected with a frame width of 0.5° covering up to θ = 28.38° with 99.7% completeness accomplished.

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.

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.

	x	y	z	Uiso*/Ueq	Occ. (<1)
Rh1	0.296490 (11)	0.118541 (11)	0.226611 (5)	0.01316 (4)
Cl	0.32709 (4)	0.14074 (4)	0.162099 (15)	0.02160 (12)
C01	0.27320 (13)	0.10337 (14)	0.27571 (7)	0.0185 (4)
O1	0.25881 (11)	0.09525 (11)	0.30693 (5)	0.0270 (4)
P1	0.19418 (3)	0.22135 (3)	0.224492 (15)	0.01422 (11)
P2	0.40800 (3)	0.02650 (4)	0.232680 (15)	0.01409 (12)
C1A	−0.1068 (6)	0.1425 (10)	0.3267 (3)	0.0219 (12)	0.523 (5)
H1A	−0.1169	0.081	0.3246	0.026*	0.523 (5)
C2A	−0.0880 (4)	0.1633 (5)	0.36763 (16)	0.0478 (13)	0.523 (5)
H2A1	−0.0387	0.1321	0.3759	0.072*	0.523 (5)
H2A2	−0.136	0.1479	0.3833	0.072*	0.523 (5)
H2A3	−0.0774	0.2233	0.3701	0.072*	0.523 (5)
C3A	−0.1871 (4)	0.1884 (6)	0.3156 (2)	0.063 (3)	0.523 (5)
H3A1	−0.1769	0.2488	0.3155	0.094*	0.523 (5)
H3A2	−0.2313	0.1753	0.3337	0.094*	0.523 (5)
H3A3	−0.2045	0.1705	0.2904	0.094*	0.523 (5)
C4A	0.3139 (5)	−0.2813 (5)	0.3295 (2)	0.0332 (16)	0.554 (8)
H4A	0.2528	−0.2766	0.3351	0.04*	0.554 (8)
C5A	0.337 (2)	−0.3567 (14)	0.3058 (5)	0.052 (2)	0.554 (8)
H5A1	0.3975	−0.3598	0.3032	0.078*	0.554 (8)
H5A2	0.3111	−0.3514	0.2809	0.078*	0.554 (8)
H5A3	0.3162	−0.4075	0.3181	0.078*	0.554 (8)
C6A	0.3706 (7)	−0.2919 (5)	0.3661 (2)	0.081 (3)	0.554 (8)
H6A1	0.376	−0.2378	0.3788	0.122*	0.554 (8)
H6A2	0.426	−0.312	0.3587	0.122*	0.554 (8)
H6A3	0.3446	−0.3322	0.3832	0.122*	0.554 (8)
C1B	−0.1148 (6)	0.1476 (11)	0.3223 (3)	0.0219 (12)	0.477 (5)
H1B	−0.1062	0.094	0.3362	0.026*	0.477 (5)
C2B	−0.1380 (5)	0.2143 (5)	0.35103 (18)	0.0478 (13)	0.477 (5)
H2B1	−0.0907	0.2241	0.3679	0.072*	0.477 (5)
H2B2	−0.1863	0.1954	0.3657	0.072*	0.477 (5)
H2B3	−0.1521	0.2663	0.3379	0.072*	0.477 (5)
C3B	−0.1887 (3)	0.1353 (4)	0.29552 (17)	0.0281 (14)	0.477 (5)
H3B1	−0.1974	0.1864	0.2809	0.042*	0.477 (5)
H3B2	−0.2391	0.1229	0.3101	0.042*	0.477 (5)
H3B3	−0.1768	0.0887	0.2784	0.042*	0.477 (5)
C4B	0.3469 (6)	−0.2804 (7)	0.3325 (3)	0.0332 (16)	0.446 (8)
H4B	0.405	−0.2868	0.3424	0.04*	0.446 (8)
C5B	0.331 (3)	−0.3593 (17)	0.3116 (7)	0.052 (2)	0.446 (8)
H5B1	0.3759	−0.3686	0.2934	0.078*	0.446 (8)
H5B2	0.2775	−0.3553	0.2984	0.078*	0.446 (8)
H5B3	0.3291	−0.4061	0.3294	0.078*	0.446 (8)
C6B	0.2968 (7)	−0.2656 (5)	0.3655 (2)	0.062 (3)	0.446 (8)
H6B1	0.2928	−0.3171	0.3802	0.093*	0.446 (8)
H6B2	0.2407	−0.2478	0.3578	0.093*	0.446 (8)
H6B3	0.3227	−0.2218	0.3807	0.093*	0.446 (8)
C111	0.10397 (13)	0.20137 (14)	0.25449 (6)	0.0155 (4)
C112	0.07887 (14)	0.11957 (15)	0.26091 (6)	0.0174 (5)
H112	0.1091	0.0749	0.2498	0.021*
C113	0.01013 (15)	0.10227 (15)	0.28339 (6)	0.0198 (5)
H113	−0.006	0.0458	0.2873	0.024*
C114	−0.03569 (15)	0.16564 (15)	0.30036 (6)	0.0199 (5)
C115	−0.01049 (16)	0.24773 (16)	0.29398 (7)	0.0234 (5)
H115	−0.0403	0.2922	0.3055	0.028*
C116	0.05759 (14)	0.26562 (14)	0.27102 (7)	0.0200 (5)
H116	0.0727	0.3221	0.2665	0.024*
C121	0.23735 (14)	0.32196 (14)	0.24048 (6)	0.0187 (5)
H121	0.1926	0.3653	0.2386	0.022*
C122	0.26715 (17)	0.31755 (16)	0.28140 (7)	0.0261 (5)
H12A	0.3082	0.2717	0.2841	0.031*
H12B	0.2191	0.3052	0.298	0.031*
C123	0.30747 (18)	0.40018 (16)	0.29338 (8)	0.0336 (7)
H12C	0.2652	0.4452	0.2924	0.04*
H12D	0.3274	0.3954	0.3196	0.04*
C124	0.38058 (17)	0.42277 (16)	0.26785 (9)	0.0376 (7)
H12E	0.4044	0.4771	0.2758	0.045*
H12F	0.4248	0.3799	0.2702	0.045*
C125	0.35206 (17)	0.42832 (16)	0.22722 (9)	0.0355 (7)
H12G	0.4008	0.4398	0.2109	0.043*
H12H	0.3123	0.4753	0.2245	0.043*
C126	0.30983 (16)	0.34720 (16)	0.21440 (7)	0.0267 (6)
H12I	0.3517	0.3018	0.2139	0.032*
H12J	0.2883	0.3546	0.1885	0.032*
C131	0.14855 (15)	0.24185 (14)	0.17773 (6)	0.0181 (5)
H131	0.1961	0.2528	0.1602	0.022*
C132	0.10437 (15)	0.16316 (15)	0.16354 (7)	0.0229 (5)
H13A	0.1436	0.1154	0.1644	0.027*
H13B	0.0566	0.1501	0.1802	0.027*
C133	0.07292 (18)	0.17503 (18)	0.12330 (7)	0.0302 (6)
H13C	0.1211	0.183	0.1062	0.036*
H13D	0.0426	0.1242	0.1152	0.036*
C134	0.01529 (18)	0.24991 (19)	0.12055 (8)	0.0333 (7)
H13E	−0.036	0.2389	0.1353	0.04*
H13F	−0.0012	0.2582	0.094	0.04*
C135	0.05677 (17)	0.32905 (18)	0.13510 (7)	0.0309 (6)
H13G	0.0158	0.3753	0.1348	0.037*
H13H	0.1035	0.3444	0.1182	0.037*
C136	0.09008 (16)	0.31768 (16)	0.17526 (7)	0.0245 (5)
H13I	0.0426	0.3099	0.1928	0.029*
H13J	0.1207	0.3686	0.183	0.029*
C211	0.38831 (16)	−0.06260 (14)	0.26335 (6)	0.0184 (5)
C212	0.30787 (17)	−0.09523 (15)	0.26457 (7)	0.0251 (5)
H212	0.2647	−0.0697	0.2503	0.03*
C213	0.2901 (2)	−0.16503 (17)	0.28653 (8)	0.0369 (7)
H213	0.2348	−0.1864	0.2869	0.044*
C214	0.3509 (2)	−0.20404 (17)	0.30784 (7)	0.0388 (8)
C215	0.4306 (2)	−0.17083 (17)	0.30673 (7)	0.0347 (7)
H215	0.4734	−0.196	0.3214	0.042*
C216	0.44988 (17)	−0.10151 (16)	0.28472 (7)	0.0266 (6)
H216	0.5054	−0.0806	0.2843	0.032*
C221	0.44359 (15)	−0.02103 (15)	0.18819 (6)	0.0178 (5)
H221	0.4465	0.0253	0.1694	0.021*
C222	0.37912 (17)	−0.08287 (17)	0.17341 (7)	0.0269 (5)
H22A	0.3234	−0.0562	0.1729	0.032*
H22B	0.3763	−0.1319	0.1903	0.032*
C223	0.40333 (18)	−0.1112 (2)	0.13367 (7)	0.0361 (7)
H22C	0.3623	−0.1528	0.1246	0.043*
H22D	0.4014	−0.0626	0.1165	0.043*
C224	0.48995 (19)	−0.14917 (18)	0.13265 (8)	0.0337 (7)
H22E	0.5053	−0.1616	0.1063	0.04*
H22F	0.4897	−0.2025	0.1468	0.04*
C225	0.55463 (18)	−0.09071 (18)	0.14967 (7)	0.0315 (6)
H22G	0.5617	−0.0416	0.1331	0.038*
H22H	0.609	−0.12	0.1511	0.038*
C226	0.52968 (15)	−0.06103 (16)	0.18898 (7)	0.0231 (5)
H22I	0.5294	−0.1091	0.2065	0.028*
H22J	0.5711	−0.02	0.1982	0.028*
C231	0.50106 (14)	0.07875 (15)	0.25216 (6)	0.0177 (4)
H231	0.5474	0.037	0.2532	0.021*
C232	0.52855 (15)	0.15070 (15)	0.22626 (8)	0.0233 (5)
H23A	0.5418	0.1282	0.201	0.028*
H23B	0.4821	0.191	0.2235	0.028*
C233	0.60515 (16)	0.19557 (18)	0.24207 (7)	0.0302 (6)
H23C	0.6534	0.157	0.2419	0.036*
H23D	0.619	0.2438	0.2258	0.036*
C234	0.59008 (17)	0.22631 (17)	0.28217 (8)	0.0320 (6)
H23E	0.6418	0.2519	0.2921	0.038*
H23F	0.5459	0.2695	0.282	0.038*
C235	0.56370 (17)	0.15413 (18)	0.30758 (7)	0.0292 (6)
H23G	0.6097	0.113	0.3093	0.035*
H23H	0.5523	0.1755	0.3332	0.035*
C236	0.48589 (15)	0.11165 (17)	0.29219 (6)	0.0236 (5)
H23I	0.439	0.152	0.2919	0.028*
H23J	0.4702	0.0646	0.3088	0.028*
O2A	0.1421 (3)	0.9423 (2)	0.19253 (10)	0.0673 (12)	0.735 (4)
C7A	0.1229 (3)	0.9277 (3)	0.16044 (16)	0.0412 (12)	0.735 (4)
C8A	0.1729 (5)	0.9554 (5)	0.12697 (17)	0.0396 (14)	0.735 (4)
H8A1	0.2117	0.9996	0.1346	0.059*	0.735 (4)
H8A2	0.1352	0.9768	0.1075	0.059*	0.735 (4)
H8A3	0.2045	0.9079	0.117	0.059*	0.735 (4)
C9A	0.0460 (4)	0.8777 (4)	0.15197 (15)	0.0715 (19)	0.735 (4)
H9A1	0.0163	0.8655	0.1754	0.107*	0.735 (4)
H9A2	0.062	0.8252	0.1398	0.107*	0.735 (4)
H9A3	0.0095	0.9096	0.1352	0.107*	0.735 (4)
O2B	0.0178 (7)	0.9608 (7)	0.1191 (4)	0.079 (4)	0.265 (4)
C7B	0.0849 (11)	0.9422 (9)	0.1305 (4)	0.055 (4)	0.265 (4)
C8B	0.1651 (14)	0.9696 (15)	0.1112 (6)	0.052 (5)	0.265 (4)
H8B1	0.152	1.011	0.0918	0.079*	0.265 (4)
H8B2	0.192	0.921	0.0996	0.079*	0.265 (4)
H8B3	0.2029	0.9943	0.1298	0.079*	0.265 (4)
C9B	0.0960 (14)	0.8978 (12)	0.1642 (5)	0.0673 (12)	0.265 (4)
H9B1	0.0461	0.8643	0.1693	0.101*	0.265 (4)
H9B2	0.1052	0.9372	0.1849	0.101*	0.265 (4)
H9B3	0.1446	0.8609	0.1618	0.101*	0.265 (4)

	U11	U22	U33	U12	U13	U23
Rh1	0.01277 (8)	0.01424 (8)	0.01245 (7)	0.00271 (7)	0.00052 (7)	0.00092 (7)
Cl	0.0220 (3)	0.0260 (3)	0.0169 (2)	0.0078 (2)	0.0037 (2)	0.0048 (2)
C01	0.0141 (10)	0.0176 (11)	0.0238 (11)	0.0057 (8)	0.0006 (9)	−0.0003 (10)
O1	0.0280 (10)	0.0342 (11)	0.0187 (8)	0.0082 (8)	−0.0009 (7)	0.0006 (8)
P1	0.0132 (3)	0.0138 (3)	0.0156 (2)	0.0022 (2)	0.0013 (2)	0.0018 (2)
P2	0.0141 (3)	0.0144 (3)	0.0137 (3)	0.0033 (2)	−0.0001 (2)	0.0007 (2)
C1A	0.0190 (18)	0.0212 (19)	0.026 (2)	−0.0022 (17)	0.0063 (16)	0.000 (2)
C2A	0.053 (3)	0.063 (4)	0.028 (2)	−0.029 (2)	0.022 (2)	−0.015 (2)
C3A	0.025 (3)	0.087 (6)	0.076 (5)	0.007 (4)	0.020 (3)	0.040 (5)
C4A	0.036 (5)	0.0222 (16)	0.041 (2)	−0.002 (4)	0.006 (4)	0.0106 (15)
C5A	0.062 (4)	0.023 (2)	0.070 (5)	−0.011 (2)	0.035 (6)	0.006 (3)
C6A	0.120 (5)	0.068 (4)	0.055 (4)	−0.028 (4)	−0.008 (4)	0.019 (3)
C1B	0.0190 (18)	0.0212 (19)	0.026 (2)	−0.0022 (17)	0.0063 (16)	0.000 (2)
C2B	0.053 (3)	0.063 (4)	0.028 (2)	−0.029 (2)	0.022 (2)	−0.015 (2)
C3B	0.013 (3)	0.035 (4)	0.036 (3)	−0.002 (2)	0.005 (2)	0.009 (3)
C4B	0.036 (5)	0.0222 (16)	0.041 (2)	−0.002 (4)	0.006 (4)	0.0106 (15)
C5B	0.062 (4)	0.023 (2)	0.070 (5)	−0.011 (2)	0.035 (6)	0.006 (3)
C6B	0.098 (5)	0.039 (4)	0.049 (4)	−0.022 (4)	0.030 (4)	0.009 (3)
C111	0.0139 (11)	0.0161 (10)	0.0166 (10)	0.0029 (9)	0.0000 (8)	0.0005 (9)
C112	0.0165 (11)	0.0163 (11)	0.0195 (11)	0.0004 (10)	−0.0016 (8)	−0.0016 (9)
C113	0.0205 (12)	0.0178 (12)	0.0209 (12)	−0.0030 (9)	−0.0013 (9)	−0.0003 (9)
C114	0.0178 (12)	0.0238 (13)	0.0181 (11)	−0.0036 (10)	0.0007 (9)	−0.0021 (10)
C115	0.0210 (13)	0.0206 (13)	0.0285 (14)	0.0021 (10)	0.0080 (11)	−0.0033 (10)
C116	0.0194 (11)	0.0141 (10)	0.0264 (13)	0.0010 (9)	0.0048 (10)	0.0020 (10)
C121	0.0171 (11)	0.0159 (11)	0.0232 (12)	0.0012 (9)	−0.0003 (9)	0.0010 (9)
C122	0.0281 (13)	0.0241 (14)	0.0260 (13)	−0.0015 (10)	−0.0024 (11)	−0.0043 (10)
C123	0.0318 (16)	0.0271 (15)	0.0418 (16)	−0.0017 (12)	−0.0069 (13)	−0.0126 (12)
C124	0.0234 (13)	0.0213 (13)	0.068 (2)	−0.0011 (11)	−0.0087 (15)	−0.0120 (13)
C125	0.0264 (14)	0.0218 (13)	0.0583 (19)	−0.0069 (11)	0.0057 (14)	0.0012 (14)
C126	0.0235 (13)	0.0226 (12)	0.0341 (14)	−0.0026 (11)	0.0064 (11)	0.0018 (11)
C131	0.0185 (11)	0.0190 (11)	0.0167 (11)	0.0043 (9)	−0.0008 (9)	0.0028 (9)
C132	0.0218 (13)	0.0259 (13)	0.0210 (12)	0.0001 (10)	−0.0047 (10)	0.0035 (10)
C133	0.0333 (15)	0.0368 (16)	0.0204 (13)	−0.0020 (12)	−0.0076 (11)	0.0022 (11)
C134	0.0254 (14)	0.0481 (18)	0.0264 (14)	−0.0014 (13)	−0.0078 (11)	0.0140 (13)
C135	0.0285 (14)	0.0363 (16)	0.0279 (14)	0.0082 (12)	−0.0014 (11)	0.0150 (12)
C136	0.0241 (13)	0.0234 (14)	0.0259 (12)	0.0075 (10)	0.0006 (10)	0.0058 (10)
C211	0.0259 (12)	0.0149 (10)	0.0143 (10)	0.0046 (10)	0.0021 (9)	−0.0009 (8)
C212	0.0321 (14)	0.0191 (12)	0.0243 (12)	−0.0009 (10)	0.0011 (11)	−0.0009 (9)
C213	0.0509 (18)	0.0256 (14)	0.0340 (15)	−0.0116 (14)	0.0071 (14)	0.0009 (12)
C214	0.077 (2)	0.0163 (12)	0.0235 (13)	0.0031 (15)	0.0115 (13)	0.0024 (11)
C215	0.056 (2)	0.0269 (15)	0.0211 (13)	0.0166 (14)	0.0005 (13)	0.0053 (11)
C216	0.0320 (14)	0.0267 (14)	0.0211 (12)	0.0085 (11)	0.0013 (10)	0.0015 (10)
C221	0.0194 (12)	0.0201 (12)	0.0140 (10)	0.0052 (9)	0.0001 (9)	0.0015 (9)
C222	0.0273 (13)	0.0334 (14)	0.0199 (12)	−0.0005 (12)	−0.0009 (11)	−0.0090 (10)
C223	0.0378 (16)	0.0497 (18)	0.0208 (13)	0.0098 (15)	−0.0035 (11)	−0.0149 (13)
C224	0.0454 (18)	0.0352 (16)	0.0205 (13)	0.0134 (13)	0.0011 (12)	−0.0077 (12)
C225	0.0325 (15)	0.0374 (16)	0.0246 (14)	0.0137 (12)	0.0034 (11)	−0.0052 (12)
C226	0.0192 (12)	0.0284 (14)	0.0217 (12)	0.0102 (10)	0.0003 (10)	−0.0027 (10)
C231	0.0131 (11)	0.0222 (13)	0.0177 (10)	0.0017 (8)	−0.0026 (9)	−0.0017 (9)
C232	0.0214 (12)	0.0223 (12)	0.0264 (12)	0.0009 (10)	0.0015 (11)	0.0020 (11)
C233	0.0208 (13)	0.0290 (14)	0.0406 (14)	−0.0049 (11)	0.0043 (11)	0.0000 (12)
C234	0.0230 (13)	0.0268 (14)	0.0462 (17)	−0.0044 (10)	−0.0034 (12)	−0.0097 (12)
C235	0.0245 (14)	0.0349 (16)	0.0283 (13)	−0.0004 (11)	−0.0063 (11)	−0.0098 (12)
C236	0.0212 (12)	0.0289 (13)	0.0207 (11)	−0.0014 (11)	−0.0007 (9)	−0.0065 (11)
O2A	0.093 (3)	0.058 (2)	0.050 (2)	−0.015 (2)	−0.015 (2)	0.0039 (17)
C7A	0.038 (3)	0.021 (2)	0.065 (3)	−0.0081 (18)	−0.003 (2)	−0.006 (2)
C8A	0.032 (3)	0.035 (3)	0.052 (4)	−0.003 (2)	−0.006 (3)	−0.007 (3)
C9A	0.069 (4)	0.086 (5)	0.060 (3)	−0.048 (3)	0.026 (3)	−0.032 (3)
O2B	0.047 (6)	0.060 (7)	0.129 (11)	−0.014 (5)	0.010 (7)	−0.008 (7)
C7B	0.072 (11)	0.040 (8)	0.054 (9)	0.010 (7)	0.010 (8)	0.000 (6)
C8B	0.040 (9)	0.053 (11)	0.064 (14)	0.001 (8)	−0.001 (11)	0.010 (10)
C9B	0.093 (3)	0.058 (2)	0.050 (2)	−0.015 (2)	−0.015 (2)	0.0039 (17)

Rh1—C01	1.802 (2)	C131—C136	1.536 (3)
Rh1—P1	2.3237 (6)	C131—H131	1
Rh1—P2	2.3253 (6)	C132—C133	1.529 (3)
Rh1—Cl	2.3724 (6)	C132—H13A	0.99
C01—O1	1.141 (3)	C132—H13B	0.99
P1—C111	1.824 (2)	C133—C134	1.516 (4)
P1—C121	1.843 (2)	C133—H13C	0.99
P1—C131	1.846 (2)	C133—H13D	0.99
P2—C211	1.823 (2)	C134—C135	1.521 (4)
P2—C231	1.844 (2)	C134—H13E	0.99
P2—C221	1.846 (2)	C134—H13F	0.99
C1A—C114	1.519 (10)	C135—C136	1.535 (3)
C1A—C2A	1.524 (10)	C135—H13G	0.99
C1A—C3A	1.534 (11)	C135—H13H	0.99
C1A—H1A	1	C136—H13I	0.99
C2A—H2A1	0.98	C136—H13J	0.99
C2A—H2A2	0.98	C211—C212	1.391 (3)
C2A—H2A3	0.98	C211—C216	1.392 (3)
C3A—H3A1	0.98	C212—C213	1.393 (3)
C3A—H3A2	0.98	C212—H212	0.95
C3A—H3A3	0.98	C213—C214	1.383 (4)
C4A—C5A	1.517 (12)	C213—H213	0.95
C4A—C214	1.575 (8)	C214—C215	1.383 (4)
C4A—C6A	1.594 (10)	C215—C216	1.393 (4)
C4A—H4A	1	C215—H215	0.95
C5A—H5A1	0.98	C216—H216	0.95
C5A—H5A2	0.98	C221—C226	1.520 (3)
C5A—H5A3	0.98	C221—C222	1.524 (3)
C6A—H6A1	0.98	C221—H221	1
C6A—H6A2	0.98	C222—C223	1.534 (3)
C6A—H6A3	0.98	C222—H22A	0.99
C1B—C114	1.515 (11)	C222—H22B	0.99
C1B—C2B	1.524 (12)	C223—C224	1.515 (4)
C1B—C3B	1.532 (11)	C223—H22C	0.99
C1B—H1B	1	C223—H22D	0.99
C2B—H2B1	0.98	C224—C225	1.522 (4)
C2B—H2B2	0.98	C224—H22E	0.99
C2B—H2B3	0.98	C224—H22F	0.99
C3B—H3B1	0.98	C225—C226	1.529 (3)
C3B—H3B2	0.98	C225—H22G	0.99
C3B—H3B3	0.98	C225—H22H	0.99
C4B—C6B	1.440 (11)	C226—H22I	0.99
C4B—C5B	1.486 (14)	C226—H22J	0.99
C4B—C214	1.506 (10)	C231—C236	1.537 (3)
C4B—H4B	1	C231—C232	1.539 (3)
C5B—H5B1	0.98	C231—H231	1
C5B—H5B2	0.98	C232—C233	1.529 (3)
C5B—H5B3	0.98	C232—H23A	0.99
C6B—H6B1	0.98	C232—H23B	0.99
C6B—H6B2	0.98	C233—C234	1.528 (4)
C6B—H6B3	0.98	C233—H23C	0.99
C111—C112	1.389 (3)	C233—H23D	0.99
C111—C116	1.398 (3)	C234—C235	1.527 (4)
C112—C113	1.388 (3)	C234—H23E	0.99
C112—H112	0.95	C234—H23F	0.99
C113—C114	1.390 (3)	C235—C236	1.521 (3)
C113—H113	0.95	C235—H23G	0.99
C114—C115	1.394 (3)	C235—H23H	0.99
C115—C116	1.392 (3)	C236—H23I	0.99
C115—H115	0.95	C236—H23J	0.99
C116—H116	0.95	O2A—C7A	1.205 (6)
C121—C122	1.533 (3)	C7A—C9A	1.499 (6)
C121—C126	1.540 (3)	C7A—C8A	1.502 (8)
C121—H121	1	C8A—H8A1	0.98
C122—C123	1.533 (3)	C8A—H8A2	0.98
C122—H12A	0.99	C8A—H8A3	0.98
C122—H12B	0.99	C9A—H9A1	0.98
C123—C124	1.525 (4)	C9A—H9A2	0.98
C123—H12C	0.99	C9A—H9A3	0.98
C123—H12D	0.99	O2B—C7B	1.186 (18)
C124—C125	1.518 (4)	C7B—C9B	1.40 (2)
C124—H12E	0.99	C7B—C8B	1.52 (3)
C124—H12F	0.99	C8B—H8B1	0.98
C125—C126	1.534 (3)	C8B—H8B2	0.98
C125—H12G	0.99	C8B—H8B3	0.98
C125—H12H	0.99	C9B—H9B1	0.98
C126—H12I	0.99	C9B—H9B2	0.98
C126—H12J	0.99	C9B—H9B3	0.98
C131—C132	1.531 (3)
C01—Rh1—P1	88.91 (7)	C134—C133—C132	111.1 (2)
C01—Rh1—P2	89.06 (7)	C134—C133—H13C	109.4
P1—Rh1—P2	173.42 (2)	C132—C133—H13C	109.4
C01—Rh1—Cl	179.13 (7)	C134—C133—H13D	109.4
P1—Rh1—Cl	90.47 (2)	C132—C133—H13D	109.4
P2—Rh1—Cl	91.49 (2)	H13C—C133—H13D	108
O1—C01—Rh1	178.8 (2)	C133—C134—C135	111.8 (2)
C111—P1—C121	105.66 (11)	C133—C134—H13E	109.3
C111—P1—C131	104.15 (10)	C135—C134—H13E	109.3
C121—P1—C131	105.72 (10)	C133—C134—H13F	109.3
C111—P1—Rh1	114.53 (7)	C135—C134—H13F	109.3
C121—P1—Rh1	110.17 (8)	H13E—C134—H13F	107.9
C131—P1—Rh1	115.75 (8)	C134—C135—C136	111.7 (2)
C211—P2—C231	105.67 (11)	C134—C135—H13G	109.3
C211—P2—C221	104.08 (10)	C136—C135—H13G	109.3
C231—P2—C221	105.04 (11)	C134—C135—H13H	109.3
C211—P2—Rh1	114.75 (8)	C136—C135—H13H	109.3
C231—P2—Rh1	111.58 (8)	H13G—C135—H13H	107.9
C221—P2—Rh1	114.77 (7)	C135—C136—C131	111.0 (2)
C114—C1A—C2A	112.8 (7)	C135—C136—H13I	109.4
C114—C1A—C3A	110.7 (9)	C131—C136—H13I	109.4
C2A—C1A—C3A	107.8 (8)	C135—C136—H13J	109.4
C114—C1A—H1A	108.5	C131—C136—H13J	109.4
C2A—C1A—H1A	108.5	H13I—C136—H13J	108
C3A—C1A—H1A	108.5	C212—C211—C216	118.1 (2)
C5A—C4A—C214	105.2 (14)	C212—C211—P2	118.22 (18)
C5A—C4A—C6A	103.4 (12)	C216—C211—P2	123.7 (2)
C214—C4A—C6A	105.6 (5)	C211—C212—C213	120.5 (3)
C5A—C4A—H4A	113.9	C211—C212—H212	119.7
C214—C4A—H4A	113.9	C213—C212—H212	119.7
C6A—C4A—H4A	113.9	C214—C213—C212	121.7 (3)
C114—C1B—C2B	114.6 (10)	C214—C213—H213	119.1
C114—C1B—C3B	110.5 (8)	C212—C213—H213	119.1
C2B—C1B—C3B	108.5 (9)	C213—C214—C215	117.4 (3)
C114—C1B—H1B	107.7	C213—C214—C4B	131.0 (5)
C2B—C1B—H1B	107.7	C215—C214—C4B	111.6 (5)
C3B—C1B—H1B	107.7	C213—C214—C4A	111.0 (4)
C1B—C2B—H2B1	109.5	C215—C214—C4A	131.6 (4)
C1B—C2B—H2B2	109.5	C214—C215—C216	121.8 (3)
H2B1—C2B—H2B2	109.5	C214—C215—H215	119.1
C1B—C2B—H2B3	109.5	C216—C215—H215	119.1
H2B1—C2B—H2B3	109.5	C211—C216—C215	120.4 (3)
H2B2—C2B—H2B3	109.5	C211—C216—H216	119.8
C1B—C3B—H3B1	109.5	C215—C216—H216	119.8
C1B—C3B—H3B2	109.5	C226—C221—C222	110.3 (2)
H3B1—C3B—H3B2	109.5	C226—C221—P2	115.98 (16)
C1B—C3B—H3B3	109.5	C222—C221—P2	110.75 (17)
H3B1—C3B—H3B3	109.5	C226—C221—H221	106.4
H3B2—C3B—H3B3	109.5	C222—C221—H221	106.4
C6B—C4B—C5B	116.8 (16)	P2—C221—H221	106.4
C6B—C4B—C214	111.3 (8)	C221—C222—C223	109.8 (2)
C5B—C4B—C214	114.0 (17)	C221—C222—H22A	109.7
C6B—C4B—H4B	104.4	C223—C222—H22A	109.7
C5B—C4B—H4B	104.4	C221—C222—H22B	109.7
C214—C4B—H4B	104.4	C223—C222—H22B	109.7
C4B—C5B—H5B1	109.5	H22A—C222—H22B	108.2
C4B—C5B—H5B2	109.5	C224—C223—C222	111.8 (2)
H5B1—C5B—H5B2	109.5	C224—C223—H22C	109.2
C4B—C5B—H5B3	109.5	C222—C223—H22C	109.2
H5B1—C5B—H5B3	109.5	C224—C223—H22D	109.2
H5B2—C5B—H5B3	109.5	C222—C223—H22D	109.2
C4B—C6B—H6B1	109.5	H22C—C223—H22D	107.9
C4B—C6B—H6B2	109.5	C223—C224—C225	111.5 (2)
H6B1—C6B—H6B2	109.5	C223—C224—H22E	109.3
C4B—C6B—H6B3	109.5	C225—C224—H22E	109.3
H6B1—C6B—H6B3	109.5	C223—C224—H22F	109.3
H6B2—C6B—H6B3	109.5	C225—C224—H22F	109.3
C112—C111—C116	118.1 (2)	H22E—C224—H22F	108
C112—C111—P1	119.38 (17)	C224—C225—C226	112.1 (2)
C116—C111—P1	122.51 (18)	C224—C225—H22G	109.2
C113—C112—C111	120.8 (2)	C226—C225—H22G	109.2
C113—C112—H112	119.6	C224—C225—H22H	109.2
C111—C112—H112	119.6	C226—C225—H22H	109.2
C112—C113—C114	121.5 (2)	H22G—C225—H22H	107.9
C112—C113—H113	119.2	C221—C226—C225	110.6 (2)
C114—C113—H113	119.2	C221—C226—H22I	109.5
C113—C114—C115	117.7 (2)	C225—C226—H22I	109.5
C113—C114—C1B	121.7 (7)	C221—C226—H22J	109.5
C115—C114—C1B	120.4 (7)	C225—C226—H22J	109.5
C113—C114—C1A	119.0 (6)	H22I—C226—H22J	108.1
C115—C114—C1A	123.2 (6)	C236—C231—C232	110.0 (2)
C116—C115—C114	121.1 (2)	C236—C231—P2	112.07 (16)
C116—C115—H115	119.5	C232—C231—P2	110.24 (15)
C114—C115—H115	119.5	C236—C231—H231	108.1
C115—C116—C111	120.7 (2)	C232—C231—H231	108.1
C115—C116—H116	119.6	P2—C231—H231	108.1
C111—C116—H116	119.6	C233—C232—C231	111.2 (2)
C122—C121—C126	110.4 (2)	C233—C232—H23A	109.4
C122—C121—P1	111.67 (16)	C231—C232—H23A	109.4
C126—C121—P1	109.05 (16)	C233—C232—H23B	109.4
C122—C121—H121	108.5	C231—C232—H23B	109.4
C126—C121—H121	108.5	H23A—C232—H23B	108
P1—C121—H121	108.5	C234—C233—C232	111.6 (2)
C121—C122—C123	110.8 (2)	C234—C233—H23C	109.3
C121—C122—H12A	109.5	C232—C233—H23C	109.3
C123—C122—H12A	109.5	C234—C233—H23D	109.3
C121—C122—H12B	109.5	C232—C233—H23D	109.3
C123—C122—H12B	109.5	H23C—C233—H23D	108
H12A—C122—H12B	108.1	C235—C234—C233	110.6 (2)
C124—C123—C122	111.3 (2)	C235—C234—H23E	109.5
C124—C123—H12C	109.4	C233—C234—H23E	109.5
C122—C123—H12C	109.4	C235—C234—H23F	109.5
C124—C123—H12D	109.4	C233—C234—H23F	109.5
C122—C123—H12D	109.4	H23E—C234—H23F	108.1
H12C—C123—H12D	108	C236—C235—C234	110.6 (2)
C125—C124—C123	110.5 (2)	C236—C235—H23G	109.5
C125—C124—H12E	109.6	C234—C235—H23G	109.5
C123—C124—H12E	109.6	C236—C235—H23H	109.5
C125—C124—H12F	109.6	C234—C235—H23H	109.5
C123—C124—H12F	109.6	H23G—C235—H23H	108.1
H12E—C124—H12F	108.1	C235—C236—C231	110.9 (2)
C124—C125—C126	111.5 (2)	C235—C236—H23I	109.5
C124—C125—H12G	109.3	C231—C236—H23I	109.5
C126—C125—H12G	109.3	C235—C236—H23J	109.5
C124—C125—H12H	109.3	C231—C236—H23J	109.5
C126—C125—H12H	109.3	H23I—C236—H23J	108
H12G—C125—H12H	108	O2A—C7A—C9A	120.3 (5)
C125—C126—C121	112.1 (2)	O2A—C7A—C8A	123.8 (5)
C125—C126—H12I	109.2	C9A—C7A—C8A	115.9 (5)
C121—C126—H12I	109.2	O2B—C7B—C9B	122.3 (17)
C125—C126—H12J	109.2	O2B—C7B—C8B	122.4 (14)
C121—C126—H12J	109.2	C9B—C7B—C8B	115.1 (17)
H12I—C126—H12J	107.9	C7B—C8B—H8B1	109.5
C132—C131—C136	110.5 (2)	C7B—C8B—H8B2	109.5
C132—C131—P1	109.49 (15)	H8B1—C8B—H8B2	109.5
C136—C131—P1	115.69 (17)	C7B—C8B—H8B3	109.5
C132—C131—H131	106.9	H8B1—C8B—H8B3	109.5
C136—C131—H131	106.9	H8B2—C8B—H8B3	109.5
P1—C131—H131	106.9	C7B—C9B—H9B1	109.5
C133—C132—C131	111.0 (2)	C7B—C9B—H9B2	109.5
C133—C132—H13A	109.4	H9B1—C9B—H9B2	109.5
C131—C132—H13A	109.4	C7B—C9B—H9B3	109.5
C133—C132—H13B	109.4	H9B1—C9B—H9B3	109.5
C131—C132—H13B	109.4	H9B2—C9B—H9B3	109.5
H13A—C132—H13B	108
C01—Rh1—P1—C111	−34.86 (11)	C131—C132—C133—C134	−56.8 (3)
Cl—Rh1—P1—C111	145.75 (8)	C132—C133—C134—C135	55.4 (3)
C01—Rh1—P1—C121	84.08 (11)	C133—C134—C135—C136	−54.4 (3)
Cl—Rh1—P1—C121	−95.32 (8)	C134—C135—C136—C131	54.4 (3)
C01—Rh1—P1—C131	−156.08 (11)	C132—C131—C136—C135	−55.5 (3)
Cl—Rh1—P1—C131	24.52 (9)	P1—C131—C136—C135	179.40 (18)
C01—Rh1—P2—C211	38.16 (11)	C231—P2—C211—C212	156.74 (18)
Cl—Rh1—P2—C211	−142.51 (8)	C221—P2—C211—C212	−92.88 (19)
C01—Rh1—P2—C231	−81.99 (10)	Rh1—P2—C211—C212	33.4 (2)
Cl—Rh1—P2—C231	97.34 (8)	C231—P2—C211—C216	−25.4 (2)
C01—Rh1—P2—C221	158.68 (11)	C221—P2—C211—C216	85.0 (2)
Cl—Rh1—P2—C221	−21.99 (9)	Rh1—P2—C211—C216	−148.73 (17)
C121—P1—C111—C112	−153.34 (18)	C216—C211—C212—C213	−0.2 (3)
C131—P1—C111—C112	95.51 (18)	P2—C211—C212—C213	177.77 (19)
Rh1—P1—C111—C112	−31.89 (19)	C211—C212—C213—C214	0.3 (4)
C121—P1—C111—C116	27.7 (2)	C212—C213—C214—C215	0.3 (4)
C131—P1—C111—C116	−83.4 (2)	C212—C213—C214—C4B	−178.1 (6)
Rh1—P1—C111—C116	149.18 (17)	C212—C213—C214—C4A	−179.6 (4)
C116—C111—C112—C113	−0.6 (3)	C6B—C4B—C214—C213	−68.4 (12)
P1—C111—C112—C113	−179.56 (17)	C5B—C4B—C214—C213	66 (2)
C111—C112—C113—C114	−0.3 (3)	C6B—C4B—C214—C215	113.1 (8)
C112—C113—C114—C115	0.2 (4)	C5B—C4B—C214—C215	−112 (2)
C112—C113—C114—C1B	175.0 (6)	C6B—C4B—C214—C4A	−64.4 (19)
C112—C113—C114—C1A	−176.1 (5)	C5B—C4B—C214—C4A	70 (3)
C2B—C1B—C114—C113	157.2 (7)	C5A—C4A—C214—C213	98.3 (13)
C3B—C1B—C114—C113	−79.9 (12)	C6A—C4A—C214—C213	−152.7 (6)
C2B—C1B—C114—C115	−28.2 (12)	C5A—C4A—C214—C215	−81.5 (14)
C3B—C1B—C114—C115	94.7 (10)	C6A—C4A—C214—C215	27.5 (10)
C2B—C1B—C114—C1A	84 (7)	C5A—C4A—C214—C4B	−78 (3)
C3B—C1B—C114—C1A	−153 (9)	C6A—C4A—C214—C4B	30.5 (19)
C2A—C1A—C114—C113	110.5 (9)	C213—C214—C215—C216	−0.8 (4)
C3A—C1A—C114—C113	−128.6 (8)	C4B—C214—C215—C216	177.9 (5)
C2A—C1A—C114—C115	−65.5 (11)	C4A—C214—C215—C216	179.0 (5)
C3A—C1A—C114—C115	55.4 (9)	C212—C211—C216—C215	−0.3 (3)
C2A—C1A—C114—C1B	−138 (9)	P2—C211—C216—C215	−178.19 (19)
C3A—C1A—C114—C1B	−17 (7)	C214—C215—C216—C211	0.8 (4)
C113—C114—C115—C116	0.8 (4)	C211—P2—C221—C226	−70.5 (2)
C1B—C114—C115—C116	−174.1 (6)	C231—P2—C221—C226	40.3 (2)
C1A—C114—C115—C116	176.9 (5)	Rh1—P2—C221—C226	163.22 (16)
C114—C115—C116—C111	−1.7 (4)	C211—P2—C221—C222	56.12 (19)
C112—C111—C116—C115	1.5 (3)	C231—P2—C221—C222	166.96 (17)
P1—C111—C116—C115	−179.52 (19)	Rh1—P2—C221—C222	−70.12 (18)
C111—P1—C121—C122	62.27 (18)	C226—C221—C222—C223	−59.0 (3)
C131—P1—C121—C122	172.31 (17)	P2—C221—C222—C223	171.20 (18)
Rh1—P1—C121—C122	−61.95 (17)	C221—C222—C223—C224	56.9 (3)
C111—P1—C121—C126	−175.40 (16)	C222—C223—C224—C225	−53.6 (3)
C131—P1—C121—C126	−65.36 (18)	C223—C224—C225—C226	52.6 (3)
Rh1—P1—C121—C126	60.38 (17)	C222—C221—C226—C225	58.3 (3)
C126—C121—C122—C123	55.1 (3)	P2—C221—C226—C225	−174.83 (19)
P1—C121—C122—C123	176.66 (18)	C224—C225—C226—C221	−55.0 (3)
C121—C122—C123—C124	−57.7 (3)	C211—P2—C231—C236	−62.33 (19)
C122—C123—C124—C125	57.6 (3)	C221—P2—C231—C236	−172.02 (17)
C123—C124—C125—C126	−55.8 (3)	Rh1—P2—C231—C236	63.03 (18)
C124—C125—C126—C121	54.6 (3)	C211—P2—C231—C232	174.74 (16)
C122—C121—C126—C125	−53.9 (3)	C221—P2—C231—C232	65.04 (18)
P1—C121—C126—C125	−176.98 (18)	Rh1—P2—C231—C232	−59.91 (17)
C111—P1—C131—C132	−64.11 (18)	C236—C231—C232—C233	55.3 (3)
C121—P1—C131—C132	−175.22 (16)	P2—C231—C232—C233	179.41 (17)
Rh1—P1—C131—C132	62.54 (17)	C231—C232—C233—C234	−55.1 (3)
C111—P1—C131—C136	61.5 (2)	C232—C233—C234—C235	55.7 (3)
C121—P1—C131—C136	−49.6 (2)	C233—C234—C235—C236	−57.2 (3)
Rh1—P1—C131—C136	−171.83 (16)	C234—C235—C236—C231	58.4 (3)
C136—C131—C132—C133	56.8 (3)	C232—C231—C236—C235	−57.2 (3)
P1—C131—C132—C133	−174.60 (17)	P2—C231—C236—C235	179.80 (18)

D—H···A	D—H	H···A	D···A	D—H···A
C131—H131···Cl	1.00	2.76	3.332 (2)	117.
C221—H221···Cl	1.00	2.67	3.324 (2)	123.
C224—H22E···O1i	0.99	2.70	3.359 (3)	124.

Table 1

Hydrogen-bond geometry (Å, °)

D—H⋯A	D—H	H⋯A	D⋯A	D—H⋯A
C131—H131⋯Cl	1.00	2.76	3.332 (2)	117
C221—H221⋯Cl	1.00	2.67	3.324 (2)	123
C224—H22E⋯O1i	0.99	2.70	3.359 (3)	124

Symmetry code: (i) .