data_0-TOPOS_QONMAJ_11T53
_database_code_CSD                  QONMAJ
_audit_creation_date                12/23/2020
_audit_creation_method              ToposPro
_chemical_formula_structural        11T53
_chemical_name_systematic
;
1,3-bis(2,6-Di-isopropylphenyl)-N-(1,4,5,6-tetramethyl-3,4-dihydro-1,
4,2-diazaborinin-2(1H)-yl)-1,3-dihydro-2H-imidazol-2-imine. 
;
_chemical_formula_sum               ZA0
_citation_journal_abbrev            'Chem.Asian J.'
_citation_year                      2014
_citation_journal_volume            9
_citation_page_first                2083
_citation_special_details
;
Experiment details: Air-sensitive, Moisture-sensitive, Oxygen-sensiti
ve. File: search24.cif. 
CENTAT: Sc1
SIMPLIG: ZA=Sc
SIMPPAR: METH=
Stand; INTRA=V| 
;
loop_
_publ_author_name
'Franz D.'
'Shigeyoshi INOUE'
_cell_length_a                      10.6309
_cell_length_b                      13.8608
_cell_length_c                      22.2227
_cell_angle_alpha                   90
_cell_angle_beta                    98.079
_cell_angle_gamma                   90
_cell_volume                        3242.077
_cell_formula_units_Z               4
_symmetry_space_group_name_H-M      'P 21/n'
_symmetry_Int_Tables_number         14
_refine_ls_R_factor_all             0
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 x,y,z
2 1/2-x,1/2+y,1/2-z
3 -x,-y,-z
4 1/2+x,1/2-y,1/2+z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_symmetry_multiplicity
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
ZA1 ZA 4 0.82782 0.50640 0.20233 1.0000
loop_
_topol_link.node_label_1
_topol_link.node_label_2
_topol_link.distance
_topol_link.site_symmetry_symop_1
_topol_link.site_symmetry_translation_1_x
_topol_link.site_symmetry_translation_1_y
_topol_link.site_symmetry_translation_1_z
_topol_link.site_symmetry_symop_2
_topol_link.site_symmetry_translation_2_x
_topol_link.site_symmetry_translation_2_y
_topol_link.site_symmetry_translation_2_z
_topol_link.type
_topol_link.multiplicity
ZA1 ZA1 7.4995 1 0 0 0 2 1 -1 0 v 4
ZA1 ZA1 14.6260 1 0 0 0 4 -1 1 0 v 4
ZA1 ZA1 10.1762 1 0 0 0 3 2 1 0 v 2
ZA1 ZA1 10.6309 1 0 0 0 1 -1 0 0 v 4
ZA1 ZA1 13.2233 1 0 0 0 3 2 1 1 v 2
ZA1 ZA1 10.5765 1 0 0 0 3 1 1 0 v 2
ZA1 ZA1 11.3026 1 0 0 0 2 2 -1 0 v 4
#End of data_0-TOPOS_QONMAJ_11T53