Information card for entry 4062244

Structure parameters

• Formula: C42 H56 B18 Co N P2
• Calculated formula: C42 H56 B18 Co N P2
• SMILES: N(=P(c1ccccc1)(c1ccccc1)c1ccccc1)[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[BH]1234[BH]567[BH]89%10[CH]%1136[CH]368[BH]8%12%13[B]%141([BH]125[BH]279[BH]%1038[BH]%12%1412)(C)[Co]12354%116%13[BH]467[BH]89%10[BH]%11%12%13[CH]379[CH]35%11[BH]571[B]124([BH]268[BH]4%10%12[BH]%1335[BH]7124)C
• Title of publication: Methylation and Demethylation in Cobaltabis(dicarbollide) Derivatives
• Authors of publication: Rojo, Isabel; Teixidor, Francesc; Kivekäs, Raikko; Sillanpää, Reijo; Viñas, Clara
• Journal of publication: Organometallics
• Year of publication: 2003
• Journal volume: 22
• Journal issue: 23
• Pages of publication: 4642 - 4646
• a: 30.993 ± 0.0007 Å
• b: 8.9763 ± 0.0002 Å
• c: 18.5724 ± 0.0005 Å
• α: 90°
• β: 115.937 ± 0.0011°
• γ: 90°
• Cell volume: 4646.44 ± 0.19 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No