Information card for entry 4062206

Structure parameters

• Formula: C27 H34 Fe2 O4 Si
• Calculated formula: C27 H34 Fe2 O4 Si
• SMILES: [Fe]12345([Fe]6789(C#[O])(C#[O])[c]%10%11[c]6(C(C)(C)[c]62[c]1([Si]%10(C)C)[cH]5[c]4([cH]36)C(C)(C)C)[cH]7[c]8([cH]9%11)C(C)(C)C)(C#[O])C#[O]
• Title of publication: Reactions of Doubly Bridged Bis(cyclopentadienes) with Iron Pentacarbonyl
• Authors of publication: Wang, Baiquan; Zhu, Bolin; Zhang, Jianyong; Xu, Shansheng; Zhou, Xiuzhong; Weng, Linhong
• Journal of publication: Organometallics
• Year of publication: 2003
• Journal volume: 22
• Journal issue: 26
• Pages of publication: 5543 - 5555
• a: 9.429 ± 0.003 Å
• b: 10.627 ± 0.003 Å
• c: 28.228 ± 0.008 Å
• α: 90°
• β: 92.313 ± 0.005°
• γ: 90°
• Cell volume: 2826.2 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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