Domino Effect in the Buildup of N-I-N-I Chains of the N-Iodine(triphenylphosphane)imine
Grebe, Jutta; Geiseler, Gertraud; Harms, Klaus; Neumüller, Bernhard; Dehnicke, Kurt; Angewandte Chemie, International Edition 38 (1999) 222–225; doi:10.1002/(sici)1521-3773(19990115)38:1/2<222::aid-anie222>3.0.co;2-5

data_1100568
_publ_section_title
;
 Domino Effect in the Buildup of N-I-N-I Chains of the
 N-Iodine(triphenylphosphane)imine
;
_journal_coden_ASTM              ACIEF5
_journal_issue                   1-2
_journal_name_full               'Angewandte Chemie, International Edition'
_journal_page_first              222
_journal_page_last               225
_journal_paper_doi
10.1002/(sici)1521-3773(19990115)38:1/2<222::aid-anie222>3.0.co;2-5
_journal_volume                  38
_journal_year                    1999
_chemical_formula_sum            'C72 H60 I8 N4 P4'
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 96.54(1)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   16.160(1)
_cell_length_b                   24.931(2)
_cell_length_c                   17.921(1)
_cod_depositor_comments
;

  Following symmetrically equivalent atoms were removed in order to
  leave only atoms from asymmetric unit:

  N1F* N 0.4397(3) 0.42145(18) 0.3580(3)
  I2F* I 0.33505(2) 0.47315(1) 0.35650(2)
  N2F* N 0.2165(3) 0.54163(19) 0.3521(3)
  I3F* I 0.27372(2) 0.61614(1) 0.35422(2)
  P2F* P 0.14385(8) 0.53363(6) 0.40519(8)
  C19F* C 0.1691(3) 0.5517(2) 0.5028(3)
  C20F* C 0.1149(4) 0.5799(3) 0.5433(4)
  H16F* H 0.06240 0.59020 0.51950
  C21F* C 0.1367(4) 0.5928(3) 0.6172(4)
  H17F* H 0.10050 0.61350 0.64310
  C22F* C 0.2118(5) 0.5756(3) 0.6537(4)
  H18F* H 0.22600 0.58360 0.70480
  C23F* C 0.2658(4) 0.5466(3) 0.6152(4)
  H19F* H 0.31670 0.53450 0.64020
  C24F* C 0.2454(4) 0.5351(3) 0.5399(4)
  H20F* H 0.28300 0.51610 0.51360
  C25F* C 0.0462(3) 0.5671(2) 0.3740(3)
  C26F* C 0.0429(4) 0.6231(3) 0.3733(5)
  H21F* H 0.09030 0.64340 0.39020
  C27F* C -0.0316(4) 0.6484(3) 0.3474(5)
  H22F* H -0.03390 0.68610 0.34670
  C28F* C -0.1008(4) 0.6200(3) 0.3231(4)
  H23F* H -0.15020 0.63800 0.30520
  C29F* C -0.0988(4) 0.5645(3) 0.3247(4)
  H24F* H -0.14700 0.54460 0.30830
  C30F* C -0.0252(4) 0.5382(3) 0.3506(4)
  H25F* H -0.02400 0.50050 0.35230
  C31F* C 0.1231(3) 0.4626(2) 0.4019(3)
  C32F* C 0.1200(4) 0.4327(2) 0.4661(4)
  H26F* H 0.12760 0.44920 0.51350
  C33F* C 0.1054(4) 0.3774(3) 0.4600(4)
  H27F* H 0.10330 0.35700 0.50390
  C34F* C 0.0941(4) 0.3525(2) 0.3923(4)
  H28F* H 0.08540 0.31520 0.38940
  C35F* C 0.0956(4) 0.3825(3) 0.3275(4)
  H29F* H 0.08630 0.36570 0.28040
  C36F* C 0.1107(3) 0.4373(2) 0.3316(3)
  H30F* H 0.11260 0.45730 0.28750
  P1F* P 0.43748(8) 0.36932(6) 0.41148(8)
  C1F* C 0.5342(3) 0.3335(2) 0.4098(3)
  C2F* C 0.5363(4) 0.2914(3) 0.3598(5)
  H1F* H 0.48720 0.28110 0.33000
  C3F* C 0.6101(5) 0.2640(3) 0.3530(5)
  H2F* H 0.61140 0.23580 0.31830
  C4F* C 0.6824(4) 0.2791(3) 0.3987(5)
  H3F* H 0.73140 0.25880 0.39900
  C5F* C 0.6810(4) 0.3236(4) 0.4428(4)
  H4F* H 0.73050 0.33610 0.46990
  C6F* C 0.6069(4) 0.3502(3) 0.4477(4)
  H5F* H 0.60690 0.38080 0.47820
  C7F* C 0.4218(3) 0.3897(2) 0.5058(3)
  C8F* C 0.4769(5) 0.4218(5) 0.5470(6)
  H6F* H 0.52590 0.43220 0.52730
  C9F* C 0.4627(6) 0.4396(6) 0.6173(6)
  H7F* H 0.50200 0.46200 0.64450
  C10F* C 0.3944(5) 0.4257(3) 0.6470(4)
  H8F* H 0.38670 0.43620 0.69610
  C11F* C 0.3358(6) 0.3960(4) 0.6056(5)
  H9F* H 0.28590 0.38730 0.62510
  C12F* C 0.3488(6) 0.3785(4) 0.5352(5)
  H10F* H 0.30720 0.35850 0.50670
  C13F* C 0.3583(3) 0.3197(2) 0.3819(3)
  C14F* C 0.3125(4) 0.3253(3) 0.3129(4)
  H11F* H 0.32120 0.35490 0.28230
  C15F* C 0.2526(4) 0.2866(3) 0.2886(4)
  H12F* H 0.22040 0.29060 0.24190
  C16F* C 0.2406(4) 0.2432(3) 0.3321(5)
  H13F* H 0.20070 0.21720 0.31510
  C17F* C 0.2874(4) 0.2373(3) 0.4022(4)
  H14F* H 0.27860 0.20770 0.43280
  C18F* C 0.3467(4) 0.2752(2) 0.4260(4)
  H15F* H 0.37950 0.27080 0.47240
  I4F* I 0.41705(3) 0.73170(2) 0.38513(3)

  Andrius Merkys
  2013-11-15
;
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               1100568