Alert level A
EXPT005_ALERT_1_A _exptl_crystal_description is missing
Crystal habit description.
The following tests will not be performed.
CRYSR_01
DIFF003_ALERT_1_A _diffrn_measurement_device_type is missing
Diffractometer make and type. Replaces _diffrn_measurement_type.
PLAT183_ALERT_1_A Missing _cell_measurement_reflns_used Value .... Please Do !
PLAT184_ALERT_1_A Missing _cell_measurement_theta_min Value ...... Please Do !
PLAT185_ALERT_1_A Missing _cell_measurement_theta_max Value ...... Please Do !
PLAT699_ALERT_1_A Missing _exptl_crystal_description Value ....... Please Do !
Alert level C
PLAT052_ALERT_1_C Info on Absorption Correction Method Not Given Please Do !
PLAT057_ALERT_3_C Correction for Absorption Required RT(exp) ... 1.11 Do !
PLAT234_ALERT_4_C Large Hirshfeld Difference C18 --C17 . 0.18 Ang.
PLAT260_ALERT_2_C Large Average Ueq of Residue Including O1A 0.125 Check,
从晶体数据是推不出SQUEEZE的分子的,既然你有元素分析和分子式,完全可以自己推
Alert level A
EXPT005_ALERT_1_A _exptl_crystal_description is missing
Crystal habit description.
The following tests will not be performed.
CRYSR_01
DIFF003_ALERT_1_A _diffrn_measurement_device_type is missing
Diffractometer make and type. Replaces _diffrn_measurement_type.
PLAT183_ALERT_1_A Missing _cell_measurement_reflns_used Value .... Please Do !
PLAT184_ALERT_1_A Missing _cell_measurement_theta_min Value ...... Please Do !
PLAT185_ALERT_1_A Missing _cell_measurement_theta_max Value ...... Please Do !
PLAT699_ALERT_1_A Missing _exptl_crystal_description Value ....... Please Do !
Alert level C
PLAT052_ALERT_1_C Info on Absorption Correction Method Not Given Please Do !
PLAT057_ALERT_3_C Correction for Absorption Required RT(exp) ... 1.11 Do !
PLAT234_ALERT_4_C Large Hirshfeld Difference C18 --C17 . 0.18 Ang.
PLAT260_ALERT_2_C Large Average Ueq of Residue Including O1A 0.125 Check,
只有一个dmf
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