data_2005317
_journal_name_full  'Acta Crystallography'
_journal_year       1996
_journal_volume  C52
_journal_page_first  2223
_journal_page_last  2225
_publ_section_title
;
1-Diisopropylphosphino-2-phenyl-1,2-dicarba-closo-dodecaborane(12)
;
_chemical_formula_sum  'C14 H29 B10 P'
_chemical_formula_weight  336.46
_symmetry_cell_setting  monoclinic
loop_
_symmetry_equiv_pos_as_xyz
 'x,y,z'
 '1/2+x,1/2-y,1/2+z'
 '-x,-y,-z'
 '1/2-x,1/2+y,1/2-z'
_symmetry_space_group_name_H-M  'P 21/n'
_cell_length_a  9.673(1)
_cell_length_b  20.021(2)
_cell_length_c  10.571(2)
_cell_angle_alpha  90
_cell_angle_beta  90.89(1)
_cell_angle_gamma  90
_cell_volume  2047.0(5)
_cell_formula_units_Z  4
_exptl_crystal_density_diffrn  1.092
_cell_measurement_temperature  295
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_u_iso_or_equiv
 P .1080(1) .07041(5) .20574(9) .0503(3)
 C(1) .2075(3) .1416(2) .2787(3) .042(1)
 C(2) .3296(3) .1775(2) .1759(3) .041(1)
 B(3) .3833(4) .1295(2) .3017(4) .047(1)
 B(4) .2716(5) .1468(2) .4300(4) .053(2)
 B(5) .1455(5) .2039(2) .3737(4) .056(2)
 B(6) .1798(4) .2197(2) .2125(4) .048(2)
 B(7) .4699(5) .2043(2) .2613(4) .051(2)
 B(8) .4347(5) .1857(2) .4214(4) .059(2)
 B(9) .2873(5) .2328(2) .4648(5) .063(2)
 B(10) .2298(5) .2779(2) .3309(5) .060(2)
 B(11) .3424(5) .2609(2) .2058(4) .053(2)
 B(12) .4092(5) .2680(2) .3620(4) .061(2)
 C(13) .3453(3) .1515(2) .0437(3) .046(1)
 C(14) .2772(4) .1812(2) -.0567(4) .069(2)
 C(15) .2961(5) .1589(3) -.1780(4) .087(2)
 C(16) .3820(6) .1069(3) -.2026(4) .085(2)
 C(17) .4512(5) .0774(2) -.1044(4) .080(2)
 C(18) .4339(4) .0996(2) .0187(4) .062(2)
 C(19) .1088(4) .0046(2) .3308(3) .058(1)
 C(20) .2495(5) -.0277(2) .3505(4) .085(2)
 C(21) .0054(5) -.0494(2) .2870(4) .087(2)
 C(22) -.0737(4) .1039(2) .2065(4) .065(2)
 C(23) -.1547(5) .0741(3) .0929(4) .103(2)
 C(24) -.1560(4) .0988(2) .3277(4) .090(2)
 H(3) .425(3) .082(2) .281(3) .056
 H(4) .246(3) .108(2) .493(3) .064
 H(5) .040(3) .197(2) .405(3) .067
 H(6) .100(3) .224(1) .140(3) .058
 H(7) .566(3) .199(2) .216(3) .061
 H(8) .518(4) .172(2) .482(3) .071
 H(9) .274(3) .250(2) .558(3) .076
 H(10) .178(3) .325(2) .333(3) .072
 H(11) .361(3) .289(2) .126(3) .064
 H(12) .475(3) .311(2) .391(3) .073
 H(14) .2164 .2175 -.0419 .083
 H(15) .2483 .1802 -.2460 .104
 H(16) .3936 .0915 -.2868 .102
 H(17) .5120 .0412 -.1203 .096
 H(18) .4837 .0789 .0862 .074
 H(19) .0791 .0234 .4083 .070
 H(20A) .2767 -.0475 .2731 .102
 H(20B) .3142 .0059 .3742 .102
 H(20C) .2500 -.0612 .4142 .102
 H(21A) -.0845 -.0308 .2777 .104
 H(21B) .0332 -.0679 .2086 .104
 H(21C) .0059 -.0829 .3507 .104
 H(22) -.0658 .1504 .1893 .078
 H(23A) -.1113 .0864 .0164 .124
 H(23B) -.1566 .0268 .0998 .124
 H(23C) -.2464 .0910 .0933 .124
 H(24A) -.1609 .0528 .3491 .108
 H(24B) -.1053 .1220 .3916 .108
 H(24C) -.2477 .1157 .3281 .108