Coumarin centered copper(ii) complex with appended-imidazole as cancer chemotherapeutic agents against lung cancer: molecular insight via DFT-based vibrational analysis
Usman, Mohammad; Zaki, Mehvash; Khan, Rais Ahmad; Alsalme, Ali; Ahmad, Musheer; Tabassum, Sartaj; RSC Adv. 7 (2017) 36056–; doi:10.1039/C7RA05874H

data_7228713
_publ_section_title
;
 Coumarin centered copper(ii) complex with appended-imidazole as cancer
 chemotherapeutic agents against lung cancer: molecular insight via
 DFT-based vibrational analysis
;
_journal_issue                   57
_journal_name_full               'RSC Adv.'
_journal_page_first              36056
_journal_paper_doi               10.1039/C7RA05874H
_journal_volume                  7
_journal_year                    2017
_chemical_formula_sum            'C23 H17 Cu N5 O6'
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_space_group_name_Hall           '-P 2yn'
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_audit_update_record
;
2017-01-20 deposited with the CCDC.
2017-07-07 downloaded from the CCDC.
;
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_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0531P)^2^+2.0470P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_cod_data_source_file            c7ra05874h2.cif
_cod_data_source_block           Complex1
_cod_depositor_comments
;
The following automatic conversions were performed:

'_exptl_absorpt_correction_type' value 'Multi-Scan' changed to
'multi-scan' according to
/home/data/users/saulius/crontab/automatic-downloads/rss-feeds/RSC/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 4973 2017-02-22 13:04:09Z antanas 
;
_cod_database_code               7228713
_shelx_shelxl_version_number     2016/6
_shelx_estimated_absorpt_t_min   0.740
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_shelx_res_checksum              88065