Information card for entry 4061193

Structure parameters

• Formula: C22 H28 Cl2 Fe N2 O2
• Calculated formula: C22 H28 Cl2 Fe N2 O2
• SMILES: [Fe]1(Cl)(Cl)[N](c2c(C(C)C)cccc2C(C)C)=C(C)c2[n]1c(ccc2)C(=O)OCC
• Authors of publication: Xiubo Tang; Biao Wu; Wenjuan Zhang
• Journal of publication: Organometallics
• Year of publication: 2004
• a: 9.8641 ± 0.0002 Å
• b: 18.0236 ± 0.0004 Å
• c: 13.0853 ± 0.0003 Å
• α: 90°
• β: 93.224 ± 0.003°
• γ: 90°
• Cell volume: 2322.71 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No