Information card for entry 4061526

Structure parameters

• Formula: C90 H210 K2 N6 O18 Si12 Zr2
• Calculated formula: C90 H197.5 K2 N6 O18 Si12 Zr2
• SMILES: CN(C)[Zr]1(N(C)C)(N(C)C)[Si](CC[Si]1([Si](C)(C)C)[Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C.CN(C)[Zr]1(N(C)C)(N(C)C)[Si](CC[Si]1([Si](C)(C)C)[Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C.C1C[O]2CC[O]3CC[O]4CC[O]5CC[O]6CC[O]1[K]23456.O1CCOCCOCCOCCOCCOCC1.C1C[O]2CC[O]3CC[O]4CC[O]5CC[O]6CC[O]1[K]23456.c1(ccccc1)C.c1(ccccc1)C
• Journal of publication: Organometallics
• Year of publication: 2005
• a: 13.077 ± 0.003 Å
• b: 24.797 ± 0.005 Å
• c: 41.823 ± 0.008 Å
• α: 101.06 ± 0.03°
• β: 92 ± 0.03°
• γ: 101.05 ± 0.03°
• Cell volume: 13028 ± 5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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