Information card for entry 4100227

Structure parameters

• Formula: C34 H40 I2 O10 P2 Zn2
• Calculated formula: C34 H40 I2 O10 P2 Zn2
• SMILES: IC[Zn]1([O]=P(O[Zn](CI)([O]=P(O1)(Oc1ccccc1)Oc1ccccc1)[O]1CCCC1)(Oc1ccccc1)Oc1ccccc1)[O]1CCCC1
• Title of publication: Structure of CHAR91
• Authors of publication: Charette, André B.; Poulard, Cyril; Bélanger-Gariépy, Francine
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 9.8027 ± 0.0003 Å
• b: 9.5376 ± 0.0003 Å
• c: 21.8327 ± 0.0007 Å
• α: 90°
• β: 100.932 ± 0.002°
• γ: 90°
• Cell volume: 2004.19 ± 0.11 ų
• Cell temperature: 220 ± 2 K
• Ambient diffraction temperature: 220 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No