Information card for entry 7246209

Structure parameters

• Formula: C62 H50 Cl6 Cu2 I2 N10 P2
• Calculated formula: C62 H50 Cl6 Cu2 I2 N10 P2
• Title of publication: Structure and emission properties of dinuclear copper(i) complexes with pyridyltriazole
• Authors of publication: Gusev, Alexey; Kiskin, Mikhail; Braga, Elena; Zamnius, Ekaterina; Kryukova, Mariya; Karaush-Karmazin, Nataliya; Baryshnikov, Glib; Minaev, Boris; Linert, Wolfgang
• Journal of publication: RSC Advances
• Year of publication: 2023
• Journal volume: 13
• Journal issue: 6
• Pages of publication: 3899 - 3909
• a: 27.091 ± 0.004 Å
• b: 8.3928 ± 0.0014 Å
• c: 28.914 ± 0.005 Å
• α: 90°
• β: 104.454 ± 0.005°
• γ: 90°
• Cell volume: 6366.1 ± 1.8 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1311
• Residual factor for significantly intense reflections: 0.0878
• Weighted residual factors for significantly intense reflections: 0.196
• Weighted residual factors for all reflections included in the refinement: 0.2193
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No