Information card for entry 7003287

Structure parameters

• Common name: Chisholm 1135
• Formula: C30 H50 Li2 N4 O2 S2
• Calculated formula: C30 H50 Li2 N4 O2 S2
• Title of publication: Amidinate‒carboxylate complexes of dimolybdenum and ditungsten: M2(O2CR)2((NiPr)2CR′)2. Preparations, molecular and electronic structures and reactions
• Authors of publication: Brown, Douglas J.; Chisholm, Malcolm H.; Gallucci, Judith C.
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 12
• Pages of publication: 1615 - 1624
• a: 9.173 ± 0.0001 Å
• b: 10.9696 ± 0.0001 Å
• c: 17.1896 ± 0.0002 Å
• α: 90°
• β: 95.9532 ± 0.0007°
• γ: 90°
• Cell volume: 1720.36 ± 0.03 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0659
• Residual factor for significantly intense reflections: 0.0472
• Weighted residual factors for all reflections: 0.1361
• Weighted residual factors for significantly intense reflections: 0.1249
• Goodness-of-fit parameter for all reflections: 1.04
• Goodness-of-fit parameter for significantly intense reflections: 1.118
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No