data_3000583
loop_
_publ_author_name
Zugenmaier
_journal_name_full               'To be published in Crystals'
_chemical_formula_sum            'C38 H42 N2 O10'
_chemical_name_systematic
;
ethyl 5-((4'-nitro-[1,1' biphenyl]-4-yl)oxy)pentanoate 
(NO2-Bi-4-S-E) 
;
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_cell_angle_alpha                83.21(5)
_cell_angle_beta                 86.70(4)
_cell_angle_gamma                88.59(4)
_cell_length_a                   7.458(5)
_cell_length_b                   10.646(8)
_cell_length_c                   22.370(10)
_cell_measurement_temperature    293(2)
_cell_volume                     1760.5(19)
_diffrn_ambient_temperature      293(2)
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_refine_ls_goodness_of_fit_ref   0.950
_refine_ls_R_factor_all          0.2067
_refine_ls_R_factor_gt           0.0689
_refine_ls_wR_factor_gt          0.1529
_refine_ls_wR_factor_ref         0.2029
_cod_database_code               3000583
_cod_hold_until_date             2025-06-21
_cod_depositor_requested_release_date 2025-06-21
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
? ? ? ?
