##############################################################################
###                                                                        ###
###        Electronic paper (Acta Crystallographica Section E)             ###
###                                                                        ###
##############################################################################
#                                                                            #
# This CIF contains the data in a paper accepted for publication in Acta     #
# Crystallographica Section E. It conforms to the requirements of Notes      #
# for Authors for Section E, and has been peer reviewed under the auspices   #
# of the IUCr Commission on Journals.                                        #
#                                                                            #
# Full details of the Crystallographic Information File format               #
# are given in the paper "The Crystallographic Information File (CIF):       #
# a New Standard Archive File for Crystallography" by S. R. Hall, F. H.      #
# Allen and I. D. Brown [Acta Cryst. (1991), A47, 655-685].                  #
#                                                                            #
# The current version of the core CIF dictionary is obtainable from          #
# ftp://ftp.iucr.org/pub/cif_core.dic. The current version number is 2.1.    #
#                                                                            #
# Software is freely available for graphical display of the structure(s) in  #
# this CIF.  For information consult the CIF home page http://www.iucr.org/  #
# cif/home.html                                                              #
#                                                                            #
#            Copyright International Union of Crystallography                #
#                                                                            #
##############################################################################
                                             
data_I
_audit_creation_method     SHELXL-97
_chemical_name_systematic
;
 (Tetraphenyldiphosphinmonosulfide-P)pentacarbonylchromium(0)
;
_chemical_name_common     ?
_chemical_formula_moiety     'C29 H20 Cr O5 P2 S'
_chemical_formula_sum     'C29 H20 Cr O5 P2 S'
_chemical_formula_iupac     '[Cr (C24 H20 P2 S) (C O)5]'
_chemical_formula_weight     594.45
_chemical_melting_point     ?
_symmetry_cell_setting     triclinic
_symmetry_space_group_name_H-M     'P -1'
loop_
    _symmetry_equiv_pos_as_xyz
    'x, y, z'
    '-x, -y, -z'
_cell_length_a     9.840(3)
_cell_length_b     10.089(5)
_cell_length_c     14.967(6)
_cell_angle_alpha     77.90(3)
_cell_angle_beta     84.43(3)
_cell_angle_gamma     68.02(3)
_cell_volume     1347.0(10)
_cell_formula_units_Z     2
_cell_measurement_reflns_used     50
_cell_measurement_theta_min     10
_cell_measurement_theta_max     11.5
_cell_measurement_temperature     178(2)
_exptl_crystal_description     tablet
_exptl_crystal_colour     yellow
_exptl_crystal_size_max     0.5
_exptl_crystal_size_mid     0.5
_exptl_crystal_size_min     0.2
_exptl_crystal_density_diffrn     1.466
_exptl_crystal_density_meas     'not measured'
_exptl_crystal_density_method     'not measured'
_exptl_crystal_F_000     608
_exptl_absorpt_coefficient_mu     0.659
_exptl_absorpt_correction_type     '\y scan'
_exptl_absorpt_process_details     '(XEMP; Nicolet, 1987)'
_exptl_absorpt_correction_T_min     0.801
_exptl_absorpt_correction_T_max     0.991
_exptl_special_details
;
 ?
;
_diffrn_ambient_temperature     178(2)
_diffrn_radiation_type     MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_source     'fine-focus sealed tube'
_diffrn_radiation_monochromator     graphite
_diffrn_measurement_device_type     'Nicolet R3'
_diffrn_measurement_method     ω
_diffrn_detector_area_resol_mean     ?
_diffrn_reflns_number     5120
_diffrn_reflns_av_R_equivalents     0.0383
_diffrn_reflns_av_sigmaI/netI     0.0369
_diffrn_reflns_theta_min     3.09
_diffrn_reflns_theta_max     25.05
_diffrn_reflns_theta_full     24.50
_diffrn_measured_fraction_theta_max     0.959
_diffrn_measured_fraction_theta_full     0.996
_diffrn_reflns_limit_h_min     -11
_diffrn_reflns_limit_h_max     11
_diffrn_reflns_limit_k_min     -11
_diffrn_reflns_limit_k_max     11
_diffrn_reflns_limit_l_min     -12
_diffrn_reflns_limit_l_max     17
_diffrn_standards_number     3
_diffrn_standards_interval_count     147
_diffrn_standards_interval_time     ?
_diffrn_standards_decay_%     0
_refine_special_details
;
 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 > 2sigma(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.
;
_reflns_number_total     4578
_reflns_number_gt     3476
_reflns_threshold_expression     I>2σ(I)
_refine_ls_structure_factor_coef     Fsqd
_refine_ls_matrix_type     full
_refine_ls_R_factor_all     0.0594
_refine_ls_R_factor_gt     0.0404
_refine_ls_wR_factor_gt     0.0967
_refine_ls_wR_factor_ref     0.1080
_refine_ls_goodness_of_fit_ref     1.028
_refine_ls_restrained_S_all     1.028
_refine_ls_number_reflns     4578
_refine_ls_number_parameters     343
_refine_ls_number_restraints     0
_refine_ls_hydrogen_treatment     constr
_refine_ls_weighting_scheme     calc
_refine_ls_weighting_details
     'calc w = 1/[σ²(Fo²)+(0.0464P)²+1.6663P] where P = (Fo²+2Fc²)/3'
_atom_sites_solution_hydrogens     geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary     difmap
_refine_ls_shift/su_max     <0.001
_refine_ls_shift/su_mean     0.000
_refine_diff_density_max     0.478
_refine_diff_density_min     -0.472
_refine_ls_extinction_method     none
_refine_ls_extinction_coef     ?
loop_
    _atom_type_symbol
    _atom_type_description
    _atom_type_scat_dispersion_real
    _atom_type_scat_dispersion_imag
    _atom_type_scat_source
    'C' 'C' 0.0033 0.0016
                         'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
    'H' 'H' 0.0000 0.0000
                         'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
    'O' 'O' 0.0106 0.0060
                         'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
    'P' 'P' 0.1023 0.0942
                         'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
    'S' 'S' 0.1246 0.1234
                         'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
    'Cr' 'Cr' 0.3209 0.6236
                         'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4'
_computing_data_collection     'P3 (Nicolet, 1987)'
_computing_cell_refinement     'P3'
_computing_data_reduction     'XDISK (Nicolet, 1987)'
_computing_structure_solution     'SHELXS97 (Sheldrick, 1990)'
_computing_structure_refinement     'SHELXL97 (Sheldrick, 1997)'
_computing_molecular_graphics     'XP (Siemens, 1994)'
_computing_publication_material     SHELXL97
loop_
    _atom_site_label
    _atom_site_fract_x
    _atom_site_fract_y
    _atom_site_fract_z
    _atom_site_U_iso_or_equiv
    _atom_site_adp_type
    _atom_site_calc_flag
    _atom_site_refinement_flags
    _atom_site_occupancy
    _atom_site_disorder_assembly
    _atom_site_disorder_group
    _atom_site_type_symbol
    Cr 0.12119(5) 0.22328(5) 0.40722(3) 0.02628(15) Uani d . 1 . . Cr
    S 0.06062(9) 0.57737(10) 0.15723(6) 0.0382(2) Uani d . 1 . . S
    P1 0.23659(8) 0.21117(8) 0.25938(5) 0.02230(19) Uani d . 1 . . P
    P2 0.25228(8) 0.42161(8) 0.17823(5) 0.02327(19) Uani d . 1 . . P
    O1 0.3039(3) -0.0945(3) 0.47601(17) 0.0481(7) Uani d . 1 . . O
    O2 0.3385(3) 0.3212(3) 0.48080(17) 0.0508(7) Uani d . 1 . . O
    O3 -0.0302(3) 0.2233(3) 0.59188(18) 0.0514(7) Uani d . 1 . . O
    O4 -0.1003(3) 0.1140(3) 0.35052(18) 0.0489(7) Uani d . 1 . . O
    O5 -0.0987(3) 0.5345(3) 0.3672(2) 0.0626(8) Uani d . 1 . . O
    C1 0.4255(3) 0.0849(3) 0.2502(2) 0.0240(6) Uani d . 1 . . C
    C2 0.4827(3) 0.0388(3) 0.1683(2) 0.0299(7) Uani d . 1 . . C
    H2 0.4217 0.0691 0.1168 0.036 Uiso calc R 1 . . H
    C3 0.6278(4) -0.0508(4) 0.1620(3) 0.0378(8) Uani d . 1 . . C
    H3 0.6666 -0.0801 0.1056 0.045 Uiso calc R 1 . . H
    C4 0.7171(4) -0.0983(4) 0.2370(3) 0.0425(9) Uani d . 1 . . C
    H4 0.8160 -0.1620 0.2327 0.051 Uiso calc R 1 . . H
    C5 0.6619(4) -0.0527(4) 0.3175(2) 0.0400(9) Uani d . 1 . . C
    H5 0.7235 -0.0837 0.3688 0.048 Uiso calc R 1 . . H
    C6 0.5170(3) 0.0381(4) 0.3248(2) 0.0321(7) Uani d . 1 . . C
    H6 0.4799 0.0687 0.3810 0.038 Uiso calc R 1 . . H
    C7 0.1355(3) 0.1573(3) 0.1860(2) 0.0237(6) Uani d . 1 . . C
    C8 0.0092(4) 0.2571(4) 0.1432(2) 0.0365(8) Uani d . 1 . . C
    H8 -0.0171 0.3576 0.1435 0.044 Uiso calc R 1 . . H
    C9 -0.0793(4) 0.2120(4) 0.0998(3) 0.0450(9) Uani d . 1 . . C
    H9 -0.1650 0.2815 0.0699 0.054 Uiso calc R 1 . . H
    C10 -0.0430(4) 0.0660(4) 0.1002(2) 0.0407(9) Uani d . 1 . . C
    H10 -0.1036 0.0350 0.0704 0.049 Uiso calc R 1 . . H
    C11 0.0804(4) -0.0344(4) 0.1435(2) 0.0405(9) Uani d . 1 . . C
    H11 0.1046 -0.1350 0.1442 0.049 Uiso calc R 1 . . H
    C12 0.1698(3) 0.0107(4) 0.1862(2) 0.0322(7) Uani d . 1 . . C
    H12 0.2554 -0.0594 0.2159 0.039 Uiso calc R 1 . . H
    C13 0.3465(3) 0.3827(3) 0.0705(2) 0.0245(6) Uani d . 1 . . C
    C14 0.2578(4) 0.3983(4) -0.0014(2) 0.0325(7) Uani d . 1 . . C
    H14 0.1543 0.4310 0.0070 0.039 Uiso calc R 1 . . H
    C15 0.3201(4) 0.3664(4) -0.0847(2) 0.0397(8) Uani d . 1 . . C
    H15 0.2593 0.3772 -0.1334 0.048 Uiso calc R 1 . . H
    C16 0.4705(4) 0.3189(4) -0.0978(2) 0.0358(8) Uani d . 1 . . C
    H16 0.5133 0.2968 -0.1551 0.043 Uiso calc R 1 . . H
    C17 0.5573(4) 0.3040(4) -0.0273(2) 0.0378(8) Uani d . 1 . . C
    H17 0.6607 0.2715 -0.0362 0.045 Uiso calc R 1 . . H
    C18 0.4972(3) 0.3354(4) 0.0562(2) 0.0324(7) Uani d . 1 . . C
    H18 0.5592 0.3245 0.1042 0.039 Uiso calc R 1 . . H
    C19 0.3649(3) 0.4636(3) 0.2496(2) 0.0265(7) Uani d . 1 . . C
    C20 0.5115(3) 0.3782(4) 0.2695(2) 0.0311(7) Uani d . 1 . . C
    H20 0.5586 0.2917 0.2455 0.037 Uiso calc R 1 . . H
    C21 0.5876(4) 0.4198(4) 0.3243(3) 0.0435(9) Uani d . 1 . . C
    H21 0.6875 0.3623 0.3370 0.052 Uiso calc R 1 . . H
    C22 0.5201(4) 0.5442(4) 0.3606(3) 0.0466(10) Uani d . 1 . . C
    H22 0.5737 0.5726 0.3976 0.056 Uiso calc R 1 . . H
    C23 0.3750(4) 0.6270(4) 0.3433(2) 0.0412(9) Uani d . 1 . . C
    H23 0.3280 0.7119 0.3689 0.049 Uiso calc R 1 . . H
    C24 0.2971(4) 0.5864(4) 0.2883(2) 0.0336(8) Uani d . 1 . . C
    H24 0.1966 0.6432 0.2771 0.040 Uiso calc R 1 . . H
    C25 0.2382(4) 0.0257(4) 0.4483(2) 0.0333(8) Uani d . 1 . . C
    C26 0.2590(4) 0.2869(4) 0.4496(2) 0.0346(8) Uani d . 1 . . C
    C27 0.0275(4) 0.2238(4) 0.5217(2) 0.0365(8) Uani d . 1 . . C
    C28 -0.0164(4) 0.1567(4) 0.3695(2) 0.0334(8) Uani d . 1 . . C
    C29 -0.0118(4) 0.4205(4) 0.3756(2) 0.0376(8) Uani d . 1 . . C
_geom_special_details
;
 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.
;
loop_
    _geom_bond_atom_site_label_1
    _geom_bond_atom_site_label_2
    _geom_bond_site_symmetry_2
    _geom_bond_distance
    _geom_bond_publ_flag
    Cr C27 . 1.865(4) Y
    Cr C25 . 1.893(4) Y
    Cr C28 . 1.895(4) Y
    Cr C26 . 1.909(4) Y
    Cr C29 . 1.916(4) Y
    Cr P1 . 2.3921(13) Y
    S P2 . 1.9531(15) Y
    P1 C1 . 1.830(3) Y
    P1 C7 . 1.833(3) Y
    P1 P2 . 2.2659(15) Y
    P2 C13 . 1.821(3) Y
    P2 C19 . 1.822(3) Y
    O1 C25 . 1.146(4) ?
    O2 C26 . 1.135(4) ?
    O3 C27 . 1.144(4) ?
    O4 C28 . 1.144(4) ?
    O5 C29 . 1.138(4) ?
    C1 C6 . 1.391(4) ?
    C1 C2 . 1.394(4) ?
    C2 C3 . 1.382(5) ?
    C2 H2 . 0.9500 ?
    C3 C4 . 1.383(5) ?
    C3 H3 . 0.9500 ?
    C4 C5 . 1.371(5) ?
    C4 H4 . 0.9500 ?
    C5 C6 . 1.384(5) ?
    C5 H5 . 0.9500 ?
    C6 H6 . 0.9500 ?
    C7 C8 . 1.384(4) ?
    C7 C12 . 1.388(4) ?
    C8 C9 . 1.384(5) ?
    C8 H8 . 0.9500 ?
    C9 C10 . 1.378(5) ?
    C9 H9 . 0.9500 ?
    C10 C11 . 1.369(5) ?
    C10 H10 . 0.9500 ?
    C11 C12 . 1.386(5) ?
    C11 H11 . 0.9500 ?
    C12 H12 . 0.9500 ?
    C13 C18 . 1.387(4) ?
    C13 C14 . 1.399(4) ?
    C14 C15 . 1.381(5) ?
    C14 H14 . 0.9500 ?
    C15 C16 . 1.382(5) ?
    C15 H15 . 0.9500 ?
    C16 C17 . 1.371(5) ?
    C16 H16 . 0.9500 ?
    C17 C18 . 1.376(5) ?
    C17 H17 . 0.9500 ?
    C18 H18 . 0.9500 ?
    C19 C24 . 1.387(4) ?
    C19 C20 . 1.399(4) ?
    C20 C21 . 1.381(5) ?
    C20 H20 . 0.9500 ?
    C21 C22 . 1.380(5) ?
    C21 H21 . 0.9500 ?
    C22 C23 . 1.376(5) ?
    C22 H22 . 0.9500 ?
    C23 C24 . 1.389(5) ?
    C23 H23 . 0.9500 ?
    C24 H24 . 0.9500 ?
loop_
    _geom_angle_atom_site_label_1
    _geom_angle_atom_site_label_2
    _geom_angle_atom_site_label_3
    _geom_angle_site_symmetry_1
    _geom_angle_site_symmetry_3
    _geom_angle
    _geom_angle_publ_flag
    C27 Cr C25 . . 88.48(15) Y
    C27 Cr C28 . . 88.55(15) Y
    C25 Cr C28 . . 87.44(15) Y
    C27 Cr C26 . . 89.65(15) Y
    C25 Cr C26 . . 91.50(15) Y
    C28 Cr C26 . . 177.94(14) Y
    C27 Cr C29 . . 85.89(15) Y
    C25 Cr C29 . . 173.94(14) Y
    C28 Cr C29 . . 90.19(15) Y
    C26 Cr C29 . . 90.69(16) Y
    C27 Cr P1 . . 176.55(11) Y
    C25 Cr P1 . . 89.77(10) Y
    C28 Cr P1 . . 88.40(10) Y
    C26 Cr P1 . . 93.36(10) Y
    C29 Cr P1 . . 95.75(11) Y
    C1 P1 C7 . . 103.54(14) Y
    C1 P1 P2 . . 101.21(10) Y
    C7 P1 P2 . . 104.56(10) Y
    C1 P1 Cr . . 119.02(11) Y
    C7 P1 Cr . . 110.78(10) Y
    P2 P1 Cr . . 116.02(5) Y
    C13 P2 C19 . . 110.90(14) Y
    C13 P2 S . . 111.01(11) Y
    C19 P2 S . . 111.67(11) Y
    C13 P2 P1 . . 107.35(10) Y
    C19 P2 P1 . . 103.03(11) Y
    S P2 P1 . . 112.55(6) Y
    C6 C1 C2 . . 118.7(3) ?
    C6 C1 P1 . . 119.9(2) ?
    C2 C1 P1 . . 121.3(2) ?
    C3 C2 C1 . . 120.1(3) ?
    C3 C2 H2 . . 119.9 ?
    C1 C2 H2 . . 119.9 ?
    C2 C3 C4 . . 120.6(3) ?
    C2 C3 H3 . . 119.7 ?
    C4 C3 H3 . . 119.7 ?
    C5 C4 C3 . . 119.6(3) ?
    C5 C4 H4 . . 120.2 ?
    C3 C4 H4 . . 120.2 ?
    C4 C5 C6 . . 120.5(3) ?
    C4 C5 H5 . . 119.7 ?
    C6 C5 H5 . . 119.7 ?
    C5 C6 C1 . . 120.5(3) ?
    C5 C6 H6 . . 119.8 ?
    C1 C6 H6 . . 119.8 ?
    C8 C7 C12 . . 118.5(3) ?
    C8 C7 P1 . . 121.0(2) ?
    C12 C7 P1 . . 119.4(2) ?
    C9 C8 C7 . . 120.8(3) ?
    C9 C8 H8 . . 119.6 ?
    C7 C8 H8 . . 119.6 ?
    C10 C9 C8 . . 119.9(3) ?
    C10 C9 H9 . . 120.1 ?
    C8 C9 H9 . . 120.1 ?
    C11 C10 C9 . . 120.1(3) ?
    C11 C10 H10 . . 119.9 ?
    C9 C10 H10 . . 119.9 ?
    C10 C11 C12 . . 120.0(3) ?
    C10 C11 H11 . . 120.0 ?
    C12 C11 H11 . . 120.0 ?
    C11 C12 C7 . . 120.6(3) ?
    C11 C12 H12 . . 119.7 ?
    C7 C12 H12 . . 119.7 ?
    C18 C13 C14 . . 118.7(3) ?
    C18 C13 P2 . . 125.1(2) ?
    C14 C13 P2 . . 116.2(2) ?
    C15 C14 C13 . . 120.2(3) ?
    C15 C14 H14 . . 119.9 ?
    C13 C14 H14 . . 119.9 ?
    C14 C15 C16 . . 120.4(3) ?
    C14 C15 H15 . . 119.8 ?
    C16 C15 H15 . . 119.8 ?
    C17 C16 C15 . . 119.3(3) ?
    C17 C16 H16 . . 120.3 ?
    C15 C16 H16 . . 120.3 ?
    C16 C17 C18 . . 121.1(3) ?
    C16 C17 H17 . . 119.4 ?
    C18 C17 H17 . . 119.4 ?
    C17 C18 C13 . . 120.2(3) ?
    C17 C18 H18 . . 119.9 ?
    C13 C18 H18 . . 119.9 ?
    C24 C19 C20 . . 118.9(3) ?
    C24 C19 P2 . . 116.7(2) ?
    C20 C19 P2 . . 124.4(2) ?
    C21 C20 C19 . . 119.9(3) ?
    C21 C20 H20 . . 120.0 ?
    C19 C20 H20 . . 120.0 ?
    C22 C21 C20 . . 120.7(3) ?
    C22 C21 H21 . . 119.7 ?
    C20 C21 H21 . . 119.7 ?
    C23 C22 C21 . . 119.9(3) ?
    C23 C22 H22 . . 120.1 ?
    C21 C22 H22 . . 120.1 ?
    C22 C23 C24 . . 120.0(3) ?
    C22 C23 H23 . . 120.0 ?
    C24 C23 H23 . . 120.0 ?
    C19 C24 C23 . . 120.5(3) ?
    C19 C24 H24 . . 119.7 ?
    C23 C24 H24 . . 119.7 ?
    O1 C25 Cr . . 176.9(3) ?
    O2 C26 Cr . . 175.3(3) ?
    O3 C27 Cr . . 179.6(3) ?
    O4 C28 Cr . . 177.1(3) ?
    O5 C29 Cr . . 171.5(3) ?
loop_
    _geom_torsion_atom_site_label_1
    _geom_torsion_atom_site_label_2
    _geom_torsion_atom_site_label_3
    _geom_torsion_atom_site_label_4
    _geom_torsion_site_symmetry_1
    _geom_torsion_site_symmetry_2
    _geom_torsion_site_symmetry_3
    _geom_torsion_site_symmetry_4
    _geom_torsion
    _geom_torsion_publ_flag
    C25 Cr P1 C1 . . . . -29.32(15) ?
    C28 Cr P1 C1 . . . . -116.76(15) ?
    C26 Cr P1 C1 . . . . 62.17(16) ?
    C29 Cr P1 C1 . . . . 153.20(15) ?
    C25 Cr P1 C7 . . . . 90.49(15) ?
    C28 Cr P1 C7 . . . . 3.04(15) ?
    C26 Cr P1 C7 . . . . -178.02(15) ?
    C29 Cr P1 C7 . . . . -86.99(15) ?
    C25 Cr P1 P2 . . . . -150.53(11) ?
    C28 Cr P1 P2 . . . . 122.02(11) ?
    C26 Cr P1 P2 . . . . -59.04(12) ?
    C29 Cr P1 P2 . . . . 31.99(12) ?
    C1 P1 P2 C13 . . . . 48.63(15) Y
    C7 P1 P2 C13 . . . . -58.72(15) Y
    Cr P1 P2 C13 . . . . 178.96(10) Y
    C1 P1 P2 C19 . . . . -68.50(15) Y
    C7 P1 P2 C19 . . . . -175.85(14) Y
    Cr P1 P2 C19 . . . . 61.83(11) Y
    C1 P1 P2 S . . . . 171.07(11) Y
    C7 P1 P2 S . . . . 63.72(11) Y
    Cr P1 P2 S . . . . -58.60(7) Y
    C7 P1 C1 C6 . . . . -146.8(3) ?
    P2 P1 C1 C6 . . . . 105.1(2) ?
    Cr P1 C1 C6 . . . . -23.3(3) ?
    C7 P1 C1 C2 . . . . 36.1(3) ?
    P2 P1 C1 C2 . . . . -72.0(2) ?
    Cr P1 C1 C2 . . . . 159.5(2) ?
    C6 C1 C2 C3 . . . . -0.4(4) ?
    P1 C1 C2 C3 . . . . 176.8(2) ?
    C1 C2 C3 C4 . . . . 1.3(5) ?
    C2 C3 C4 C5 . . . . -1.7(5) ?
    C3 C4 C5 C6 . . . . 1.2(5) ?
    C4 C5 C6 C1 . . . . -0.2(5) ?
    C2 C1 C6 C5 . . . . -0.2(5) ?
    P1 C1 C6 C5 . . . . -177.3(3) ?
    C1 P1 C7 C8 . . . . -152.0(3) ?
    P2 P1 C7 C8 . . . . -46.4(3) ?
    Cr P1 C7 C8 . . . . 79.3(3) ?
    C1 P1 C7 C12 . . . . 39.8(3) ?
    P2 P1 C7 C12 . . . . 145.4(2) ?
    Cr P1 C7 C12 . . . . -88.9(2) ?
    C12 C7 C8 C9 . . . . -1.4(5) ?
    P1 C7 C8 C9 . . . . -169.7(3) ?
    C7 C8 C9 C10 . . . . 1.0(6) ?
    C8 C9 C10 C11 . . . . 0.1(6) ?
    C9 C10 C11 C12 . . . . -0.7(5) ?
    C10 C11 C12 C7 . . . . 0.2(5) ?
    C8 C7 C12 C11 . . . . 0.8(5) ?
    P1 C7 C12 C11 . . . . 169.3(3) ?
    C19 P2 C13 C18 . . . . 23.4(3) ?
    S P2 C13 C18 . . . . 148.1(3) ?
    P1 P2 C13 C18 . . . . -88.5(3) ?
    C19 P2 C13 C14 . . . . -158.7(2) ?
    S P2 C13 C14 . . . . -33.9(3) ?
    P1 P2 C13 C14 . . . . 89.5(2) ?
    C18 C13 C14 C15 . . . . 0.2(5) ?
    P2 C13 C14 C15 . . . . -177.8(3) ?
    C13 C14 C15 C16 . . . . 0.0(5) ?
    C14 C15 C16 C17 . . . . -0.1(5) ?
    C15 C16 C17 C18 . . . . 0.1(5) ?
    C16 C17 C18 C13 . . . . 0.1(5) ?
    C14 C13 C18 C17 . . . . -0.3(5) ?
    P2 C13 C18 C17 . . . . 177.6(3) ?
    C13 P2 C19 C24 . . . . 132.2(3) ?
    S P2 C19 C24 . . . . 7.9(3) ?
    P1 P2 C19 C24 . . . . -113.2(2) ?
    C13 P2 C19 C20 . . . . -49.9(3) ?
    S P2 C19 C20 . . . . -174.3(2) ?
    P1 P2 C19 C20 . . . . 64.7(3) ?
    C24 C19 C20 C21 . . . . -2.4(5) ?
    P2 C19 C20 C21 . . . . 179.8(3) ?
    C19 C20 C21 C22 . . . . 0.8(5) ?
    C20 C21 C22 C23 . . . . 0.8(6) ?
    C21 C22 C23 C24 . . . . -0.8(6) ?
    C20 C19 C24 C23 . . . . 2.4(5) ?
    P2 C19 C24 C23 . . . . -179.7(3) ?
    C22 C23 C24 C19 . . . . -0.8(5) ?
loop_
    _geom_hbond_atom_site_label_D
    _geom_hbond_atom_site_label_H
    _geom_hbond_atom_site_label_A
    _geom_hbond_site_symmetry_A
    _geom_hbond_distance_DH
    _geom_hbond_distance_HA
    _geom_hbond_distance_DA
    _geom_hbond_angle_DHA
    C22 H22 O2 2_666 0.95 2.65 3.581(4) 166.4
    C21 H21 O4 1_655 0.95 2.57 3.426(5) 149.3
data_global
_journal_date_recd_electronic     2002-08-01
_journal_date_accepted     2002-08-07
_journal_name_full     'Acta Crystallographica, Section E'
_journal_year     2002
_journal_volume     58
_journal_issue      9
_journal_page_first     m478
_journal_page_last     m479
_journal_paper_category     EM
_publ_contact_author_name     'Peter G. Jones'
_publ_contact_author_address
;
Institut fur Anorganische und Analytische Chemie
Technische Universitat Braunschweig
Postfach 3329
38023 Braunschweig
Germany
;
_publ_contact_author_email     jones@xray36.anchem.nat.tu-bs.de
_publ_contact_author_fax     '049 531 391-5387'
_publ_contact_author_phone     '049 531 391-5382'
_publ_section_title
;
Pentacarbonyl(tetraphenyldiphosphine monosulfide-P)chromium(0)
;
loop_
    _publ_author_name
    _publ_author_address
    'Jones, Peter G.'
;     Institut für Anorganische und Analytische Chemie
      Technische Universität Braunschweig
      Postfach 3329
      38023 Braunschweig
      Germany
;
    'Fischer, Axel K.'
;     Institut für Anorganische und Analytische Chemie
      Technische Universität Braunschweig
      Postfach 3329
      38023 Braunschweig
      Germany
;
    'Farkens, Michael'
;     Institut für Anorganische und Analytische Chemie
      Technische Universität Braunschweig
      Postfach 3329
      38023 Braunschweig
      Germany
;
    'Schmutzler, Reinhard'
;     Institut für Anorganische und Analytische Chemie
      Technische Universität Braunschweig
      Postfach 3329
      38023 Braunschweig
      Germany
;
