Information card for entry 4061587

Structure parameters

• Formula: C32 H62 B20 Mo O2 Rh2 Se4
• Calculated formula: C32 H62 B20 Mo O2 Rh2 Se4
• SMILES: [Mo]123456([Rh]789%10%11([Se]1[C]1%12%13%14[C]%15%16%17([Se]27)[BH]271[BH]1%18%12[BH]%12%19%13[BH]%13%14%15[BH]%14%15%19[BH]%19%18%12[BH]%1271[BH]1%162[BH]%17%13%14[BH]%15%19%121)(C5=O)[c]1([cH]8[c]9([cH]%10[cH]%111)C(C)(C)C)C(C)(C)C)[Rh]12578([Se]3[C]39%10%11[C]%12%13%14([Se]41)[BH]143[BH]3%159[BH]9%16%10[BH]%10%11%12[BH]%11%12%16[BH]%16%159[BH]943[BH]3%131[BH]%14%10%11[BH]%12%1693)(C6=O)[c]1([cH]2[cH]5[c]7([cH]81)C(C)(C)C)C(C)(C)C
• Title of publication: Heteronuclear Molybdenum and Nickel Derivatives of the 16-Electron Half-Sandwich Complex Cp'Rh[E2C2(B10H10)] (E = S, Se)
• Authors of publication: Cai, Shuyi; Wang, Jian-Qiang; Jin, Guo-Xin
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 17
• Pages of publication: 4226 - 4231
• a: 9.991 ± 0.003 Å
• b: 23.134 ± 0.006 Å
• c: 24.827 ± 0.006 Å
• α: 90°
• β: 92.53 ± 0.005°
• γ: 90°
• Cell volume: 5733 ± 3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• 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