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The title compound (GaQ3), [Ga(C9H6NO)3], is the Ga analog of the most widely used organic light-emitting diode (OLED) material, AlQ3. Its molecular structure is a six-coordinated gallium compound, with the angles around the Ga3+ ion indicating approximate octahedral geometry. There is intermolecular π–π stacking of the ligands (8-hydroxy­quinolines) in a multidirectional fashion.

Supporting information

cif

Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536804001242/fl6074sup1.cif
Contains datablock {vcif ERROR: unable to open file /journals/www/e/issues/2004/02/00/fl6074/fl6074sup1.cif - exiting}

hkl

Structure factor file (CIF format) https://doi.org/10.1107/S1600536804001242/fl6074Isup2.hkl
Contains datablock I

CCDC reference: 234822

Key indicators

  • Single-crystal X-ray study
  • T = 293 K
  • Mean [sigma](C-C) = 0.006 Å
  • R factor = 0.050
  • wR factor = 0.117
  • Data-to-parameter ratio = 14.7

checkCIF/PLATON results

No syntax errors found



Alert level C ABSTM02_ALERT_3_C The ratio of expected to reported Tmax/Tmin(RR') is < 0.90 Tmin and Tmax reported: 0.557 0.768 Tmin' and Tmax expected: 0.648 0.768 RR' = 0.858 Please check that your absorption correction is appropriate. RINTA01_ALERT_3_C The value of Rint is greater than 0.10 Rint given 0.144 PLAT020_ALERT_3_C The value of Rint is greater than 0.10 ......... 0.14 PLAT061_ALERT_3_C Tmax/Tmin Range Test RR' too Large ............. 0.84 PLAT710_ALERT_4_C Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 19 N3 -GA1 -N1 -C9 146.70 0.90 1.555 1.555 1.555 1.555 PLAT710_ALERT_4_C Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 24 N3 -GA1 -N1 -C1 -36.30 1.10 1.555 1.555 1.555 1.555 PLAT710_ALERT_4_C Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 39 N1 -GA1 -N3 -C27 108.50 1.00 1.555 1.555 1.555 1.555 PLAT710_ALERT_4_C Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 44 N1 -GA1 -N3 -C19 -71.20 1.00 1.555 1.555 1.555 1.555
0 ALERT level A = In general: serious problem 0 ALERT level B = Potentially serious problem 8 ALERT level C = Check and explain 0 ALERT level G = General alerts; check 0 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 0 ALERT type 2 Indicator that the structure model may be wrong or deficient 4 ALERT type 3 Indicator that the structure quality may be low 4 ALERT type 4 Improvement, methodology, query or suggestion

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