Information card for entry 4320876

Structure parameters

• Common name: none
• Chemical name: Bis(2,6-di(phenylimino)piperidinato)bisacetatodimolybdenum(II)
• Formula: C38 H38 Mo2 N6 O4
• Calculated formula: C38 H38 Mo2 N6 O4
• SMILES: [Mo]1234[Mo]([N](c5ccccc5)=C5N2C(=N\c2ccccc2)\CCC5)([N]2=C(N1c1ccccc1)CCCC\2=N/c1ccccc1)([O]=C(C)O4)OC(C)=[O]3
• Title of publication: Heteronuclear Chains of Four Metal Atoms Including One Quadruply Bonded Dimetal Unit. Dichromium and Dimolybdenum Compounds with Appended Copper(I) Atoms
• Authors of publication: F. Albert Cotton; Carlos A. Murillo; Lindsay E. Roy; Hong-Cai Zhou
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 1743 - 1747
• a: 8.7909 ± 0.0013 Å
• b: 9.939 ± 0.002 Å
• c: 10.69 ± 0.002 Å
• α: 69.43 ± 0.01°
• β: 85.647 ± 0.01°
• γ: 88.901 ± 0.014°
• Cell volume: 871.9 ± 0.3 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0389
• Residual factor for significantly intense reflections: 0.0383
• Weighted residual factors for all reflections: 0.0993
• Weighted residual factors for significantly intense reflections: 0.0974
• Goodness-of-fit parameter for all reflections: 1.15
• Goodness-of-fit parameter for significantly intense reflections: 1.152
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No