Information card for entry 8100172

Structure parameters

• Formula: C38 H28 I2 N4 O6 Pb
• Calculated formula: C38 H28 I2 N4 O6 Pb
• SMILES: [Pb]123(OC(=[O]1)c1c(I)cccc1)([n]1cccc4ccc5ccc[n]2c5c14)[n]1cccc2ccc4ccc[n]3c4c12.Ic1c(cccc1)C(=O)[O-].O.O
• Title of publication: Crystal structure of bis(1,10-phenanthroline-N,N')(2-iodo-benzoato) lead(II) 2-iodo-benzoate dihydrate, [Pb(C~7~H~4~O~2~I)(C~12~H~8~N~2~)~2~] (C~7~H~4~O~2~I) · 2H~2~O
• Authors of publication: Zhang, Bi-Song; Ying, Tao-Kai; Cheng, Cun-Gui
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2004
• Journal volume: 219
• Journal issue: 4
• Pages of publication: 483 - 484
• a: 12.727 ± 0.003 Å
• b: 12.991 ± 0.003 Å
• c: 13.116 ± 0.003 Å
• α: 79.83 ± 0.03°
• β: 63.31 ± 0.03°
• γ: 78.33 ± 0.03°
• Cell volume: 1888.4 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No