data_2005524
_journal_name_full  'Acta Crystallographica'
_journal_year       1996
_journal_volume    	C52
_journal_page_first    	2409
_journal_page_last    	2412
_publ_section_title    	
;
Addition of Methanol to Copper(II)-Coordinated Dicyanonitrosomethanide:
(3-Amino-3-methoxy-2-nitrosoacrylonitrilato-N^2^,N^3^)-
(bipyridine-N,N')(dicyanamido-N)copper(II)
;
_chemical_formula_moiety    	'[Cu(C4 H4 N3 O2)(C2 N3)(C10 H8 N2)]'
_chemical_formula_sum    	'C16 H12 Cu N8 O2'
_chemical_formula_structural    	'[Cu(C4 H4 N3 O2)(C2 N3)(C10 H8 N2)]'
_chemical_formula_weight    	411.88
_symmetry_cell_setting    	'monoclinic'
loop_
_symmetry_equiv_pos_as_xyz
    'x, y, z'
    '-x+1/2, y+1/2, -z+1/2'
    '-x, -y, -z'
    'x-1/2, -y-1/2, z-1/2'
_symmetry_space_group_name_H-M    	'P 21/n'
_cell_length_a    	9.1800(9)
_cell_length_b    	7.3440(7)
_cell_length_c    	25.385(3)
_cell_angle_alpha    	90.00(2)
_cell_angle_beta    	91.22(2)
_cell_angle_gamma    	90.00(2)
_cell_volume    	1711.0(3)
_cell_formula_units_Z    	4
_exptl_crystal_density_diffrn    	1.599
_exptl_crystal_density_meas    	1.579
_cell_measurement_temperature    	293(2)
loop_
_atom_site_label
_atom_site_occupancy
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
    Cu1 1 0.18911(6) 0.21593(7) 0.36308(2) 0.0490(2)
    O1 1 0.2323(4) 0.5653(5) 0.30539(14) 0.0775(11)
    O2 1 0.5433(3) 0.0981(4) 0.27650(12) 0.0581(9)
    N1 1 0.0948(4) 0.0113(5) 0.40278(14) 0.0506(10)
    N2 1 -0.0116(4) 0.3210(5) 0.37086(13) 0.0481(10)
    N3 1 0.2730(4) 0.4030(5) 0.31278(14) 0.0525(10)
    N4 1 0.3495(5) 0.0738(7) 0.3344(2) 0.0570(13)
    N5 1 0.5250(5) 0.5174(7) 0.2190(2) 0.089(2)
    N6 1 0.3054(4) 0.3252(6) 0.4323(2) 0.0676(12)
    N7 1 0.4995(5) 0.2646(9) 0.4958(2) 0.115(2)
    N8 1 0.4826(4) 0.1999(7) 0.5885(2) 0.0794(13)
    C1 1 0.1601(6) -0.1395(8) 0.4201(2) 0.0630(14)
    C2 1 0.0921(6) -0.2653(8) 0.4503(2) 0.071(2)
    C3 1 -0.0474(6) -0.2373(9) 0.4643(2) 0.076(2)
    C4 1 -0.1161(6) -0.0838(9) 0.4465(2) 0.067(2)
    C5 1 -0.0437(5) 0.0406(7) 0.4159(2) 0.0491(12)
    C6 1 -0.1057(4) 0.2106(7) 0.3952(2) 0.0517(12)
    C7 1 -0.2496(6) 0.2559(10) 0.4003(2) 0.073(2)
    C8 1 -0.2983(8) 0.4161(11) 0.3795(3) 0.086(2)
    C9 1 -0.2052(8) 0.5271(10) 0.3549(2) 0.082(2)
    C10 1 -0.0613(6) 0.4746(8) 0.3510(2) 0.0673(15)
    C11 1 0.4259(5) 0.1548(6) 0.3008(2) 0.0441(11)
    C12 1 0.3843(5) 0.3375(6) 0.2872(2) 0.0475(12)
    C13 1 0.4612(5) 0.4380(7) 0.2496(2) 0.0597(13)
    C14 1 0.5900(9) -0.0848(11) 0.2862(3) 0.089(2)
    C15 1 0.3906(5) 0.2967(7) 0.4641(2) 0.0624(13)
    C16 1 0.4824(5) 0.2287(7) 0.5452(2) 0.0622(13)
    H1 1 0.2547(44) -0.1450(53) 0.4113(15) 0.046(12)
    H2 1 0.1440(53) -0.3517(71) 0.4576(20) 0.075(19)
    H3 1 -0.1091(65) -0.3181(83) 0.4812(24) 0.123(25)
    H4 1 -0.2007(49) -0.0502(64) 0.4538(17) 0.063(16)
    H7 1 -0.2977(52) 0.1669(70) 0.4178(19) 0.075(20)
    H8 1 -0.3742(62) 0.4432(85) 0.3851(22) 0.098(24)
    H9 1 -0.2150(44) 0.6403(62) 0.3390(16) 0.053(14)
    H10 1 0.0081(38) 0.5498(50) 0.3350(14) 0.029(11)
    H11 1 0.3722(42) -0.0101(52) 0.3433(15) 0.022(13)
    H141 1 0.6647(59) -0.1143(79) 0.2661(21) 0.099(20)
    H142 1 0.6200(60) -0.0937(85) 0.3195(24) 0.106(25)
    H143 1 0.5065(69) -0.1868(86) 0.2801(23) 0.117(26)