Information card for entry 8100525

Structure parameters

• Formula: C36 H72 B2 K Nd O8 P2
• Calculated formula: C36 H72 B2 K Nd O8 P2
• SMILES: [Nd]123456789%10(P%11[C]1(=[C]2([C]3(=[C]4%11C)C)C)C)(P1[C]5(=[C]6([C]7(=[C]81C)C)C)C)([H][BH2][H]9)[H][BH2][H]%10.[K]12345([O]6CC[O]2CC[O]1CC[O]3CC[O]4CC[O]5CC6)([O]1CCCC1)[O]1CCCC1
• Title of publication: Crystal structure of (18-crown-6)bis(tetra-hydrofuran)potassiumbis (2,3,4,5-tetramethylphospholyl)bis(borohydride)neodymium(III), [K (C~12~H~24~O~6~)(C~4~H~8~O)~2~]{[C~4~(CH~3~)~4~P]~2~Nd(BH~4~)~2~}
• Authors of publication: Cendrowski-Guillaume, Sophie; Le Gland, Gildas; Ephritikhine, Michel; Nierlich, Martine
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2002
• Journal volume: 217
• Journal issue: 1
• Pages of publication: 35 - 37
• a: 10.489 ± 0.002 Å
• b: 11.784 ± 0.002 Å
• c: 19.103 ± 0.004 Å
• α: 98.29 ± 0.03°
• β: 94.07 ± 0.03°
• γ: 104.26 ± 0.03°
• Cell volume: 2250.6 ± 0.8 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No