Information card for entry 7122073

Structure parameters

• Formula: C23 H24 Cl2 N O2 Ta
• Calculated formula: C23 H24 Cl2 N O2 Ta
• Title of publication: A cytotoxic tantalum(v) half-sandwich complex: a new challenge for metal-based anticancer agents.
• Authors of publication: Štarha, Pavel; Trávníček, Zdeněk; Dvořák, Zdeněk
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 68
• Pages of publication: 9533 - 9536
• a: 16.827 ± 0.0012 Å
• b: 14.9556 ± 0.001 Å
• c: 8.5588 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2153.9 ± 0.3 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0611
• Residual factor for significantly intense reflections: 0.0475
• Weighted residual factors for significantly intense reflections: 0.1055
• Weighted residual factors for all reflections included in the refinement: 0.1103
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No