#------------------------------------------------------------------------------ #$Date$ #$Revision$ #$URL$ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_5900002 _journal_name_full Strukturbericht _journal_page_first 660 _journal_volume 3 _chemical_formula_sum 'C H4 N2 O' _chemical_name_systematic Diaminomethanal _symmetry_Int_Tables_number 113 _symmetry_space_group_name_H-M 'P -4 21 m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 5.670 _cell_length_b 5.670 _cell_length_c 4.726 _[local]_cod_data_source_file 003_diaminomethanal.cif _[local]_cod_data_source_block diaminomethanal loop_ _atom_site_label _atom_site_type_symbol _atom_site_symmetry_multiplicity _atom_site_Wyckoff_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z C C 2 c 0 0.5 0.335 O O 2 c 0 0.5 0.600 N N 4 e 0.145 0.640 0.180 loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_distance C O 1.25(5) C N 1.37(5) loop_ _citation_id _citation_coordinate_linkage _citation_title _citation_book_title _citation_country _citation_page_first _citation_page_last _citation_year _citation_book_publisher _[local]_cod_citation_special_details 1 yes ? 'Organicheskaja Kristallokhimija' USSR ? ? 1955 'Izdatel'stvo Akademii Nauk SSSR' ; Coordinates are presented as published in this book, Kitajgorodskij's "Organicheskaja Kristallokhimija", keyed in manually. Saulius Gra\