Information card for entry 4062276

Structure parameters

• Formula: C24 H47 B Cl O2 P2 Rh
• Calculated formula: C24 H47 B Cl O2 P2 Rh
• SMILES: [Rh]1([H][B]21Oc1c(O2)cccc1)(Cl)([P](C(C)C)(C(C)C)C(C)C)[P](C(C)C)(C(C)C)C(C)C
• Title of publication: Accurate Molecular Structures of 16-Electron Rhodium Hydrido Boryl Complexes: Low-Temperature Single-Crystal X-ray and Neutron Diffraction and Computational Studies of [(PR~3~)~2~RhHCl(Boryl)] (Boryl = Bpin, Bcat)
• Authors of publication: Lam, Wai Han; Shimada, Shigeru; Batsanov, Andrei S.; Lin, Zhenyang; Marder, Todd B.; Cowan, John A.; Howard, Judith A. K.; Mason, Sax A.; McIntyre, Garry J.
• Journal of publication: Organometallics
• Year of publication: 2003
• Journal volume: 22
• Journal issue: 22
• Pages of publication: 4557 - 4568
• a: 11.228 ± 0.003 Å
• b: 11.101 ± 0.003 Å
• c: 23.414 ± 0.007 Å
• α: 90°
• β: 102.28 ± 0.04°
• γ: 90°
• Cell volume: 2851.6 ± 1.4 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• 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